0 B10R1.4 C=C=Cc1ccccc1Br 271570a_100015277604_100000695589 [0,0,0,0,0,0|1,0,3]=4 1 B10R1.4 C=C=Cc1ccccc1C 271570a_100015277604_100000210755 [0,0,0,0,0,0|1,0,3]=4 2 B10R1.4 C=C=Cc1ccccc1Cl 271570a_100015277604_100000764095 [0,0,0,0,0,0|1,0,3]=4 3 B10R1.4 C=C=Cc1ccccc1F 271570a_100015277604_100011215700 [0,0,0,0,0,0|1,0,3]=4 4 B10R1.4 C=C=Cc1ccccc1N 271570a_100015277604_100000210017 [0,0,0,0,0,0|1,0,3]=4 5 B10R1.4 C=C=Cc1ccccc1O 271570a_100015277604_100000739446 [0,0,0,0,0,0|0,0,3]=3 6 B10R1.4 C=C=Cc1ccncc1O 271570a_100015277604_100009817591 [0,0,0,0,0,0|1,0,3]=4 7 B10R1.4 C=C=Cc1ncccc1O 271570a_100015277604_100000034122 [0,0,0,0,0,0|1,0,3]=4 8 B10R1.4 C=CCc1ccccc1O 271570a_203496583355_100009828059 [0,0,0,0,0,0|0,0,2]=2 9 B10R1.4 CC=Cc1c[nH]ccc1=O 271570a_100016259895_100009998708 [0,0,0,0,0,0|1,0,3]=4 10 B10R1.4 CC=Cc1c[nH]ccc1=S 271570a_100016259895_200012280681 [0,0,0,0,0,0|1,1,2]=4 11 B10R1.4 CC=Cc1ccc[nH]c1=O 271570a_100016259895_100000050042 [0,0,0,0,0,0|1,0,3]=4 12 B10R1.4 CC=Cc1cccc[n+]1C 271570a_100016259895_100000212160 [0,0,0,0,0,0|2,0,2]=4 13 B10R1.4 CC=Cc1cccc[n+]1[O-] 271570a_100016259895_200000042595 [0,0,0,0,0,0|1,0,3]=4 14 B10R1.4 CC=Cc1ccccc1Br 271570a_100016259895_100000695589 [0,0,0,0,0,0|1,0,2]=3 15 B10R1.4 CC=Cc1ccccc1C 271570a_100016259895_100000210755 [0,0,0,0,0,0|1,0,2]=3 16 B10R1.4 CC=Cc1ccccc1Cl 271570a_100016259895_100000764095 [0,0,0,0,0,0|1,0,2]=3 17 B10R1.4 CC=Cc1ccccc1F 271570a_100016259895_100011215700 [0,0,0,0,0,0|1,0,2]=3 18 B10R1.4 CC=Cc1ccccc1N 271570a_100016259895_100000210017 [0,0,0,0,0,0|1,0,2]=3 19 B10R1.4 CC=Cc1ccccc1O 271570a_100016259895_100000739446 [0,0,0,0,0,0|0,0,2]=2 20 B10R1.4 CC=Cc1cccnc1Br 271570a_100016259895_100010202626 [0,0,0,0,0,0|2,0,2]=4 21 B10R1.4 CC=Cc1cccnc1C 271570a_100016259895_100000751574 [0,0,0,0,0,0|2,0,2]=4 22 B10R1.4 CC=Cc1cccnc1Cl 271570a_100016259895_100000036424 [0,0,0,0,0,0|2,0,2]=4 23 B10R1.4 CC=Cc1cccnc1F 271570a_100016259895_100009816115 [0,0,0,0,0,0|2,0,2]=4 24 B10R1.4 CC=Cc1cccnc1N 271570a_100016259895_100000045569 [0,0,0,0,0,0|2,0,2]=4 25 B10R1.4 CC=Cc1ccncc1Br 271570a_100016259895_100000726257 [0,0,0,0,0,0|2,0,2]=4 26 B10R1.4 CC=Cc1ccncc1C 271570a_100016259895_100015191297 [0,0,0,0,0,0|2,0,2]=4 27 B10R1.4 CC=Cc1ccncc1Cl 271570a_100016259895_100000708259 [0,0,0,0,0,0|2,0,2]=4 28 B10R1.4 CC=Cc1ccncc1F 271570a_100016259895_100000047030 [0,0,0,0,0,0|2,0,2]=4 29 B10R1.4 CC=Cc1ccncc1N 271570a_100016259895_100009815883 [0,0,0,0,0,0|2,0,2]=4 30 B10R1.4 CC=Cc1ccncc1O 271570a_100016259895_100009817591 [0,0,0,0,0,0|1,0,2]=3 31 B10R1.4 CC=Cc1cnccc1Br 271570a_100016259895_100010138639 [0,0,0,0,0,0|2,0,2]=4 32 B10R1.4 CC=Cc1cnccc1C 271570a_100016259895_100000761580 [0,0,0,0,0,0|2,0,2]=4 33 B10R1.4 CC=Cc1cnccc1Cl 271570a_100016259895_100009995489 [0,0,0,0,0,0|2,0,2]=4 34 B10R1.4 CC=Cc1cnccc1F 271570a_100016259895_100009820683 [0,0,0,0,0,0|2,0,2]=4 35 B10R1.4 CC=Cc1cnccc1N 271570a_100016259895_100000047001 [0,0,0,0,0,0|2,0,2]=4 36 B10R1.4 CC=Cc1cncnc1O 271570a_100016259895_100000751107 [0,0,0,0,0,0|2,0,2]=4 37 B10R1.4 CC=Cc1ncccc1Br 271570a_100016259895_100000696092 [0,0,0,0,0,0|2,0,2]=4 38 B10R1.4 CC=Cc1ncccc1C 271570a_100016259895_100000751373 [0,0,0,0,0,0|2,0,2]=4 39 B10R1.4 CC=Cc1ncccc1Cl 271570a_100016259895_100011356963 [0,0,0,0,0,0|2,0,2]=4 40 B10R1.4 CC=Cc1ncccc1F 271570a_100016259895_100000685392 [0,0,0,0,0,0|2,0,2]=4 41 B10R1.4 CC=Cc1ncccc1N 271570a_100016259895_100000688686 [0,0,0,0,0,0|2,0,2]=4 42 B10R1.4 CC=Cc1ncccc1O 271570a_100016259895_100000034122 [0,0,0,0,0,0|1,0,2]=3 43 B10R1.4 CCCc1ncncc1O 271570a_203496583355_100009816987 [0,0,0,0,0,0|2,0,0]=2 44 B10R1.4 CCNc1ccccc1Br 34a_100000210017_100000210202 [0,0,0,0,0,0|2,0,0]=2 45 B10R1.4 CCNc1ccccc1C 34a_100015192222_100000210202 [0,0,0,0,0,0|2,0,0]=2 46 B10R1.4 CCNc1ccccc1Cl 34a_100000185783_100000210202 [0,0,0,0,0,0|2,0,0]=2 47 B10R1.4 CCNc1ccccc1F 34a_100000210422_100000210202 [0,0,0,0,0,0|2,0,0]=2 48 B10R1.4 CCNc1ccccc1I 34a_100000210053_100000210202 [0,0,0,0,0,0|2,0,0]=2 49 B10R1.4 CCNc1ccccc1O 271570a_203496583355_114873767003 [0,0,0,0,0,0|1,0,0]=1 50 B10R1.4 CCNc1ccccc1O 34a_100000185747_100000210202 [0,0,0,0,0,0|1,0,0]=1 51 B10R1.4 CCNc1ccn[nH]c1=O 27a_100015525214_100000087129 [0,0,0,0,0,0|3,0,1]=4 52 B10R1.4 CCNc1ccncc1Br 27a_100015525214_100000726257 [0,0,0,0,0,0|3,0,0]=3 53 B10R1.4 CCNc1ccncc1C 27a_100015525214_100000765111 [0,0,0,0,0,0|3,0,0]=3 54 B10R1.4 CCNc1ccncc1F 27a_100015525214_100000035921 [0,0,0,0,0,0|3,0,0]=3 55 B10R1.4 CCNc1ncccc1Br 27a_100015525214_100000696092 [0,0,0,0,0,0|3,0,0]=3 56 B10R1.4 CCNc1nccnc1C 27a_100015525214_100011999405 [0,0,0,0,0,0|4,0,0]=4 57 B10R1.4 CCNc1nccnc1F 27a_100015525214_200010125657 [0,0,0,0,0,0|4,0,0]=4 58 B10R1.4 CCNc1ncncc1C 27a_100015525214_100011998708 [0,0,0,0,0,0|4,0,0]=4 59 B10R1.4 CCNc1ncncc1F 27a_100015525214_100000069762 [0,0,0,0,0,0|4,0,0]=4 60 B10R1.4 CCNc1ncncc1N 27a_100015525214_100000709731 [0,0,0,0,0,0|4,0,0]=4 61 B10R1.4 CCNc1nnccc1C 27a_100015525214_100000089043 [0,0,0,0,0,0|4,0,0]=4 62 B10R1.4 CCOc1cccc[n+]1[O-] 7a_100000211761_100000210202 [0,0,0,0,0,0|2,0,1]=3 63 B10R1.4 CCOc1ccccc1Br 34a_100000181306_100000210202 [0,0,0,0,0,0|2,0,0]=2 64 B10R1.4 CCOc1ccccc1Br 7a_100000181306_100000210202 [0,0,0,0,0,0|2,0,0]=2 65 B10R1.4 CCOc1ccccc1C 34a_100000210338_100000210202 [0,0,0,0,0,0|2,0,0]=2 66 B10R1.4 CCOc1ccccc1C 7a_100000210338_100000210202 [0,0,0,0,0,0|2,0,0]=2 67 B10R1.4 CCOc1ccccc1Cl 34a_100000210172_100000210202 [0,0,0,0,0,0|2,0,0]=2 68 B10R1.4 CCOc1ccccc1Cl 7a_100000210172_100000210202 [0,0,0,0,0,0|2,0,0]=2 69 B10R1.4 CCOc1ccccc1F 34a_100000210171_100000210202 [0,0,0,0,0,0|2,0,0]=2 70 B10R1.4 CCOc1ccccc1F 7a_100000210171_100000210202 [0,0,0,0,0,0|2,0,0]=2 71 B10R1.4 CCOc1ccccc1I 34a_100000739446_100000210202 [0,0,0,0,0,0|2,0,0]=2 72 B10R1.4 CCOc1ccccc1I 7a_100000739446_100000210202 [0,0,0,0,0,0|2,0,0]=2 73 B10R1.4 CCOc1ccccc1N 34a_100000185747_100000210202 [0,0,0,0,0,0|2,0,0]=2 74 B10R1.4 CCOc1ccccc1N 7a_100000185747_100000210202 [0,0,0,0,0,0|2,0,0]=2 75 B10R1.4 CCOc1ccccc1O 271570a_203496583355_100000230754 [0,0,0,0,0,0|1,0,0]=1 76 B10R1.4 CCOc1cccnc1Br 34a_100000744436_100000210202 [0,0,0,0,0,0|3,0,0]=3 77 B10R1.4 CCOc1cccnc1Br 7a_100000744436_100000210202 [0,0,0,0,0,0|3,0,0]=3 78 B10R1.4 CCOc1cccnc1C 34a_100000745507_100000210202 [0,0,0,0,0,0|3,0,0]=3 79 B10R1.4 CCOc1cccnc1C 7a_100000745507_100000210202 [0,0,0,0,0,0|3,0,0]=3 80 B10R1.4 CCOc1cccnc1Cl 34a_100000757616_100000210202 [0,0,0,0,0,0|3,0,0]=3 81 B10R1.4 CCOc1cccnc1Cl 7a_100000757616_100000210202 [0,0,0,0,0,0|3,0,0]=3 82 B10R1.4 CCOc1cccnc1F 34a_100000061740_100000210202 [0,0,0,0,0,0|3,0,0]=3 83 B10R1.4 CCOc1cccnc1F 7a_100000061740_100000210202 [0,0,0,0,0,0|3,0,0]=3 84 B10R1.4 CCOc1cccnc1I 34a_100000034122_100000210202 [0,0,0,0,0,0|3,0,0]=3 85 B10R1.4 CCOc1cccnc1I 7a_100000034122_100000210202 [0,0,0,0,0,0|3,0,0]=3 86 B10R1.4 CCOc1cccnc1N 34a_100000211975_100000210202 [0,0,0,0,0,0|3,0,0]=3 87 B10R1.4 CCOc1cccnc1N 7a_100000211975_100000210202 [0,0,0,0,0,0|3,0,0]=3 88 B10R1.4 CCOc1cccnc1O 271570a_203496583355_100011597540 [0,0,0,0,0,0|2,0,0]=2 89 B10R1.4 CCOc1cccoc1=O 34a_100000077404_100000210202 [0,0,0,0,0,0|2,0,1]=3 90 B10R1.4 CCOc1cccoc1=O 7a_100000077404_100000210202 [0,0,0,0,0,0|2,0,1]=3 91 B10R1.4 CCOc1ccncc1Br 34a_100011996408_100000210202 [0,0,0,0,0,0|3,0,0]=3 92 B10R1.4 CCOc1ccncc1C 34a_100000694293_100000210202 [0,0,0,0,0,0|3,0,0]=3 93 B10R1.4 CCOc1ccncc1Cl 34a_100011997054_100000210202 [0,0,0,0,0,0|3,0,0]=3 94 B10R1.4 CCOc1ccncc1F 34a_200000081243_100000210202 [0,0,0,0,0,0|3,0,0]=3 95 B10R1.4 CCOc1cnccc1C 34a_100011997053_100000210202 [0,0,0,0,0,0|3,0,0]=3 96 B10R1.4 CCOc1cnccc1C 7a_100011997053_100000210202 [0,0,0,0,0,0|3,0,0]=3 97 B10R1.4 CCOc1cnccc1Cl 34a_100011996695_100000210202 [0,0,0,0,0,0|3,0,0]=3 98 B10R1.4 CCOc1cnccc1I 34a_100000050107_100000210202 [0,0,0,0,0,0|3,0,0]=3 99 B10R1.4 CCOc1cnccc1N 34a_100000753702_100000210202 [0,0,0,0,0,0|3,0,0]=3 100 B10R1.4 CCOc1cncnc1N 7a_100000112926_100000210202 [0,0,0,0,0,0|4,0,0]=4 101 B10R1.4 CCOc1coccc1=O 34a_100000060831_100000210202 [0,0,0,0,0,0|2,0,1]=3 102 B10R1.4 CCOc1ncccc1Cl 34a_100011290957_100000210202 [0,0,0,0,0,0|3,0,0]=3 103 B10R1.4 CCOc1ncccc1F 34a_100011219419_100000210202 [0,0,0,0,0,0|3,0,0]=3 104 B10R1.4 CCOc1ncccc1N 34a_100000746358_100000210202 [0,0,0,0,0,0|3,0,0]=3 105 B10R1.4 CCOc1ncccc1O 271570a_203496583355_100011465154 [0,0,0,0,0,0|2,0,0]=2 106 B10R1.4 CCOc1nccnc1C 34a_100000766352_100000210202 [0,0,0,0,0,0|4,0,0]=4 107 B10R1.4 CCOc1nccnc1O 271570a_203496583355_200010128176 [0,0,0,0,0,0|3,0,0]=3 108 B10R1.4 CCSc1c[nH]ccc1=O 62a_100000210202_100009998708 [0,0,0,0,0,0|2,0,1]=3 109 B10R1.4 CCSc1c[nH]ccc1=O 62a_100009998708_100000210202 [0,0,0,0,0,0|2,0,1]=3 110 B10R1.4 CCSc1c[nH]ccc1=S 62a_100000210202_200012280681 [0,0,0,0,0,0|2,1,0]=3 111 B10R1.4 CCSc1c[nH]ccc1=S 62a_200012280681_100000210202 [0,0,0,0,0,0|2,1,0]=3 112 B10R1.4 CCSc1cccc[n+]1C 62a_100000210202_100000212160 [0,0,0,0,0,0|3,0,0]=3 113 B10R1.4 CCSc1cccc[n+]1[O-] 62a_100000210202_200000042595 [0,0,0,0,0,0|2,0,1]=3 114 B10R1.4 CCSc1ccccc1Br 62a_100000210202_100000695589 [0,0,0,0,0,0|2,0,0]=2 115 B10R1.4 CCSc1ccccc1Br 62a_100000695589_100000210202 [0,0,0,0,0,0|2,0,0]=2 116 B10R1.4 CCSc1ccccc1C 62a_100000210202_100000210755 [0,0,0,0,0,0|2,0,0]=2 117 B10R1.4 CCSc1ccccc1C 62a_100000210755_100000210202 [0,0,0,0,0,0|2,0,0]=2 118 B10R1.4 CCSc1ccccc1Cl 62a_100000210202_100000764095 [0,0,0,0,0,0|2,0,0]=2 119 B10R1.4 CCSc1ccccc1Cl 62a_100000764095_100000210202 [0,0,0,0,0,0|2,0,0]=2 120 B10R1.4 CCSc1ccccc1F 62a_100000210202_100011215700 [0,0,0,0,0,0|2,0,0]=2 121 B10R1.4 CCSc1ccccc1F 62a_100011215700_100000210202 [0,0,0,0,0,0|2,0,0]=2 122 B10R1.4 CCSc1ccccc1N 62a_100000210017_100000210202 [0,0,0,0,0,0|2,0,0]=2 123 B10R1.4 CCSc1ccccc1N 62a_100000210202_100000210017 [0,0,0,0,0,0|2,0,0]=2 124 B10R1.4 CCSc1ccccc1O 271570a_203496583355_100000230856 [0,0,0,0,0,0|1,0,0]=1 125 B10R1.4 CCSc1ccccc1O 62a_100000210202_100000739446 [0,0,0,0,0,0|1,0,0]=1 126 B10R1.4 CCSc1ccccc1O 62a_100000739446_100000210202 [0,0,0,0,0,0|1,0,0]=1 127 B10R1.4 CCSc1cccnc1Br 62a_100000210202_100010202626 [0,0,0,0,0,0|3,0,0]=3 128 B10R1.4 CCSc1cccnc1Br 62a_100010202626_100000210202 [0,0,0,0,0,0|3,0,0]=3 129 B10R1.4 CCSc1cccnc1C 62a_100000210202_100000751574 [0,0,0,0,0,0|3,0,0]=3 130 B10R1.4 CCSc1cccnc1C 62a_100000751574_100000210202 [0,0,0,0,0,0|3,0,0]=3 131 B10R1.4 CCSc1cccnc1Cl 62a_100000036424_100000210202 [0,0,0,0,0,0|3,0,0]=3 132 B10R1.4 CCSc1cccnc1Cl 62a_100000210202_100000036424 [0,0,0,0,0,0|3,0,0]=3 133 B10R1.4 CCSc1cccnc1F 62a_100000210202_100009816115 [0,0,0,0,0,0|3,0,0]=3 134 B10R1.4 CCSc1cccnc1F 62a_100009816115_100000210202 [0,0,0,0,0,0|3,0,0]=3 135 B10R1.4 CCSc1cccnc1N 62a_100000045569_100000210202 [0,0,0,0,0,0|3,0,0]=3 136 B10R1.4 CCSc1cccnc1N 62a_100000210202_100000045569 [0,0,0,0,0,0|3,0,0]=3 137 B10R1.4 CCSc1cccnc1O 62a_100000210202_100000760158 [0,0,0,0,0,0|2,0,0]=2 138 B10R1.4 CCSc1cccnc1O 62a_100000760158_100000210202 [0,0,0,0,0,0|2,0,0]=2 139 B10R1.4 CCSc1ccn[nH]c1=O 62a_100000210202_100000087129 [0,0,0,0,0,0|3,0,1]=4 140 B10R1.4 CCSc1ccncc1Br 62a_100000210202_100000726257 [0,0,0,0,0,0|3,0,0]=3 141 B10R1.4 CCSc1ccncc1Br 62a_100000726257_100000210202 [0,0,0,0,0,0|3,0,0]=3 142 B10R1.4 CCSc1ccncc1C 62a_100000210202_100000765111 [0,0,0,0,0,0|3,0,0]=3 143 B10R1.4 CCSc1ccncc1C 62a_100000765111_100000210202 [0,0,0,0,0,0|3,0,0]=3 144 B10R1.4 CCSc1ccncc1Cl 62a_100000210202_100000708259 [0,0,0,0,0,0|3,0,0]=3 145 B10R1.4 CCSc1ccncc1Cl 62a_100000708259_100000210202 [0,0,0,0,0,0|3,0,0]=3 146 B10R1.4 CCSc1ccncc1F 62a_100000047030_100000210202 [0,0,0,0,0,0|3,0,0]=3 147 B10R1.4 CCSc1ccncc1F 62a_100000210202_100000047030 [0,0,0,0,0,0|3,0,0]=3 148 B10R1.4 CCSc1ccncc1N 62a_100000210202_100000756074 [0,0,0,0,0,0|3,0,0]=3 149 B10R1.4 CCSc1ccncc1N 62a_100000756074_100000210202 [0,0,0,0,0,0|3,0,0]=3 150 B10R1.4 CCSc1ccncc1O 62a_100000210202_100009817591 [0,0,0,0,0,0|2,0,0]=2 151 B10R1.4 CCSc1ccncc1O 62a_100009817591_100000210202 [0,0,0,0,0,0|2,0,0]=2 152 B10R1.4 CCSc1cnccc1Br 62a_100000210202_100010138639 [0,0,0,0,0,0|3,0,0]=3 153 B10R1.4 CCSc1cnccc1Br 62a_100010138639_100000210202 [0,0,0,0,0,0|3,0,0]=3 154 B10R1.4 CCSc1cnccc1C 62a_100000210202_100000761580 [0,0,0,0,0,0|3,0,0]=3 155 B10R1.4 CCSc1cnccc1C 62a_100000761580_100000210202 [0,0,0,0,0,0|3,0,0]=3 156 B10R1.4 CCSc1cnccc1Cl 62a_100000210202_100009995489 [0,0,0,0,0,0|3,0,0]=3 157 B10R1.4 CCSc1cnccc1Cl 62a_100009995489_100000210202 [0,0,0,0,0,0|3,0,0]=3 158 B10R1.4 CCSc1cnccc1F 62a_100000210202_100009820683 [0,0,0,0,0,0|3,0,0]=3 159 B10R1.4 CCSc1cnccc1F 62a_100009820683_100000210202 [0,0,0,0,0,0|3,0,0]=3 160 B10R1.4 CCSc1cnccc1N 62a_100000047001_100000210202 [0,0,0,0,0,0|3,0,0]=3 161 B10R1.4 CCSc1cnccc1N 62a_100000210202_100000047001 [0,0,0,0,0,0|3,0,0]=3 162 B10R1.4 CCSc1cncnc1Br 62a_100000210202_200012461658 [0,0,0,0,0,0|4,0,0]=4 163 B10R1.4 CCSc1cncnc1Br 62a_200012461658_100000210202 [0,0,0,0,0,0|4,0,0]=4 164 B10R1.4 CCSc1cncnc1C 62a_100000210202_100009819671 [0,0,0,0,0,0|4,0,0]=4 165 B10R1.4 CCSc1cncnc1C 62a_100009819671_100000210202 [0,0,0,0,0,0|4,0,0]=4 166 B10R1.4 CCSc1cncnc1Cl 62a_100000210202_100000758962 [0,0,0,0,0,0|4,0,0]=4 167 B10R1.4 CCSc1cncnc1Cl 62a_100000758962_100000210202 [0,0,0,0,0,0|4,0,0]=4 168 B10R1.4 CCSc1cncnc1N 62a_100000210202_100011996079 [0,0,0,0,0,0|4,0,0]=4 169 B10R1.4 CCSc1cncnc1N 62a_100011996079_100000210202 [0,0,0,0,0,0|4,0,0]=4 170 B10R1.4 CCSc1cncnc1O 62a_100000210202_100000751107 [0,0,0,0,0,0|3,0,0]=3 171 B10R1.4 CCSc1cncnc1O 62a_100000751107_100000210202 [0,0,0,0,0,0|3,0,0]=3 172 B10R1.4 CCSc1cnncc1N 62a_100000210202_100009829405 [0,0,0,0,0,0|4,0,0]=4 173 B10R1.4 CCSc1cnncc1N 62a_100009829405_100000210202 [0,0,0,0,0,0|4,0,0]=4 174 B10R1.4 CCSc1ncc[nH]c1=O 62a_100000210202_100000763361 [0,0,0,0,0,0|3,0,1]=4 175 B10R1.4 CCSc1ncccc1Br 62a_100000210202_100000696092 [0,0,0,0,0,0|3,0,0]=3 176 B10R1.4 CCSc1ncccc1Br 62a_100000696092_100000210202 [0,0,0,0,0,0|3,0,0]=3 177 B10R1.4 CCSc1ncccc1C 62a_100000210202_100000751373 [0,0,0,0,0,0|3,0,0]=3 178 B10R1.4 CCSc1ncccc1C 62a_100000751373_100000210202 [0,0,0,0,0,0|3,0,0]=3 179 B10R1.4 CCSc1ncccc1Cl 62a_100000210202_100011356963 [0,0,0,0,0,0|3,0,0]=3 180 B10R1.4 CCSc1ncccc1Cl 62a_100011356963_100000210202 [0,0,0,0,0,0|3,0,0]=3 181 B10R1.4 CCSc1ncccc1F 62a_100000210202_100000685392 [0,0,0,0,0,0|3,0,0]=3 182 B10R1.4 CCSc1ncccc1F 62a_100000685392_100000210202 [0,0,0,0,0,0|3,0,0]=3 183 B10R1.4 CCSc1ncccc1N 62a_100000210202_100000688686 [0,0,0,0,0,0|3,0,0]=3 184 B10R1.4 CCSc1ncccc1N 62a_100000688686_100000210202 [0,0,0,0,0,0|3,0,0]=3 185 B10R1.4 CCSc1ncccc1O 62a_100000034122_100000210202 [0,0,0,0,0,0|2,0,0]=2 186 B10R1.4 CCSc1ncccc1O 62a_100000210202_100000034122 [0,0,0,0,0,0|2,0,0]=2 187 B10R1.4 CCSc1nccnc1C 62a_100000210202_100011999405 [0,0,0,0,0,0|4,0,0]=4 188 B10R1.4 CCSc1nccnc1C 62a_100011999405_100000210202 [0,0,0,0,0,0|4,0,0]=4 189 B10R1.4 CCSc1nccnc1Cl 62a_100000210202_100010886584 [0,0,0,0,0,0|4,0,0]=4 190 B10R1.4 CCSc1nccnc1Cl 62a_100010886584_100000210202 [0,0,0,0,0,0|4,0,0]=4 191 B10R1.4 CCSc1nccnc1F 62a_100000210202_200010125657 [0,0,0,0,0,0|4,0,0]=4 192 B10R1.4 CCSc1nccnc1F 62a_200010125657_100000210202 [0,0,0,0,0,0|4,0,0]=4 193 B10R1.4 CCSc1nccnc1N 62a_100000210202_100000747729 [0,0,0,0,0,0|4,0,0]=4 194 B10R1.4 CCSc1nccnc1N 62a_100000747729_100000210202 [0,0,0,0,0,0|4,0,0]=4 195 B10R1.4 CCSc1ncncc1C 62a_100000210202_100011998708 [0,0,0,0,0,0|4,0,0]=4 196 B10R1.4 CCSc1ncncc1C 62a_100011998708_100000210202 [0,0,0,0,0,0|4,0,0]=4 197 B10R1.4 CCSc1ncncc1F 62a_100000069762_100000210202 [0,0,0,0,0,0|4,0,0]=4 198 B10R1.4 CCSc1ncncc1F 62a_100000210202_100000069762 [0,0,0,0,0,0|4,0,0]=4 199 B10R1.4 CCSc1ncncc1N 62a_100000210202_100000709731 [0,0,0,0,0,0|4,0,0]=4 200 B10R1.4 CCSc1ncncc1N 62a_100000709731_100000210202 [0,0,0,0,0,0|4,0,0]=4 201 B10R1.4 CCSc1nnccc1C 62a_100000210202_100000089043 [0,0,0,0,0,0|4,0,0]=4 202 B10R1.4 CNCc1ccccc1Br 207a_100102657272_100000211189 [0,0,0,0,0,0|2,0,0]=2 203 B10R1.4 CNCc1ccccc1Br 2230a_100000689332_200000210301 [0,0,0,0,0,0|2,0,0]=2 204 B10R1.4 CNCc1ccccc1Br 2230a_106832991635_100000184730 [0,0,0,0,0,0|2,0,0]=2 205 B10R1.4 CNCc1ccccc1Br 26a_100102657272_100000181306 [0,0,0,0,0,0|2,0,0]=2 206 B10R1.4 CNCc1ccccc1Br 270004a_106832991635_100000211189 [0,0,0,0,0,0|2,0,0]=2 207 B10R1.4 CNCc1ccccc1Br 34a_100000689332_200000210301 [0,0,0,0,0,0|2,0,0]=2 208 B10R1.4 CNCc1ccccc1Br 34a_100102657272_100000184730 [0,0,0,0,0,0|2,0,0]=2 209 B10R1.4 CNCc1ccccc1Br 7a_106832991635_100000184730 [0,0,0,0,0,0|2,0,0]=2 210 B10R1.4 CNCc1ccccc1C 207a_100102657272_100000211143 [0,0,0,0,0,0|2,0,0]=2 211 B10R1.4 CNCc1ccccc1C 2230a_106832991635_100000211839 [0,0,0,0,0,0|2,0,0]=2 212 B10R1.4 CNCc1ccccc1C 270004a_106832991635_100000211143 [0,0,0,0,0,0|2,0,0]=2 213 B10R1.4 CNCc1ccccc1C 34a_100000174972_200000210301 [0,0,0,0,0,0|2,0,0]=2 214 B10R1.4 CNCc1ccccc1C 34a_100102657272_100000211839 [0,0,0,0,0,0|2,0,0]=2 215 B10R1.4 CNCc1ccccc1C 7a_106832991635_100000211839 [0,0,0,0,0,0|2,0,0]=2 216 B10R1.4 CNCc1ccccc1Cl 207a_100102657272_100000210073 [0,0,0,0,0,0|2,0,0]=2 217 B10R1.4 CNCc1ccccc1Cl 2230a_100000174879_200000210301 [0,0,0,0,0,0|2,0,0]=2 218 B10R1.4 CNCc1ccccc1Cl 2230a_106832991635_100000187162 [0,0,0,0,0,0|2,0,0]=2 219 B10R1.4 CNCc1ccccc1Cl 26a_100102657272_100000210172 [0,0,0,0,0,0|2,0,0]=2 220 B10R1.4 CNCc1ccccc1Cl 270004a_106832991635_100000210073 [0,0,0,0,0,0|2,0,0]=2 221 B10R1.4 CNCc1ccccc1Cl 34a_100000174879_200000210301 [0,0,0,0,0,0|2,0,0]=2 222 B10R1.4 CNCc1ccccc1Cl 34a_100102657272_100000187162 [0,0,0,0,0,0|2,0,0]=2 223 B10R1.4 CNCc1ccccc1Cl 7a_106832991635_100000187162 [0,0,0,0,0,0|2,0,0]=2 224 B10R1.4 CNCc1ccccc1F 207a_100102657272_100000210811 [0,0,0,0,0,0|2,0,0]=2 225 B10R1.4 CNCc1ccccc1F 2230a_106832991635_100000211605 [0,0,0,0,0,0|2,0,0]=2 226 B10R1.4 CNCc1ccccc1F 270004a_106832991635_100000210811 [0,0,0,0,0,0|2,0,0]=2 227 B10R1.4 CNCc1ccccc1F 34a_100000174869_200000210301 [0,0,0,0,0,0|2,0,0]=2 228 B10R1.4 CNCc1ccccc1F 34a_100102657272_100000211605 [0,0,0,0,0,0|2,0,0]=2 229 B10R1.4 CNCc1ccccc1F 7a_106832991635_100000211605 [0,0,0,0,0,0|2,0,0]=2 230 B10R1.4 CNCc1ccccc1I 207a_100102657272_100000010305 [0,0,0,0,0,0|2,0,0]=2 231 B10R1.4 CNCc1ccccc1I 2230a_106832991635_100011215278 [0,0,0,0,0,0|2,0,0]=2 232 B10R1.4 CNCc1ccccc1I 270004a_106832991635_100000010305 [0,0,0,0,0,0|2,0,0]=2 233 B10R1.4 CNCc1ccccc1I 34a_100102657272_100011215278 [0,0,0,0,0,0|2,0,0]=2 234 B10R1.4 CNCc1ccccc1I 7a_106832991635_100011215278 [0,0,0,0,0,0|2,0,0]=2 235 B10R1.4 CNCc1ccccc1O 271570a_203496583355_100000184654 [0,0,0,0,0,0|1,0,0]=1 236 B10R1.4 CNCc1ccccc1O 34a_100000185550_200000210301 [0,0,0,0,0,0|1,0,0]=1 237 B10R1.4 CNCc1cccnc1Br 2230a_100009818023_200000210301 [0,0,0,0,0,0|3,0,0]=3 238 B10R1.4 CNCc1cccnc1Br 2230a_106832991635_100010140945 [0,0,0,0,0,0|3,0,0]=3 239 B10R1.4 CNCc1cccnc1Br 34a_100009818023_200000210301 [0,0,0,0,0,0|3,0,0]=3 240 B10R1.4 CNCc1cccnc1Br 34a_100102657272_100010140945 [0,0,0,0,0,0|3,0,0]=3 241 B10R1.4 CNCc1cccnc1Br 7a_106832991635_100010140945 [0,0,0,0,0,0|3,0,0]=3 242 B10R1.4 CNCc1cccnc1C 207a_100102657272_100000751968 [0,0,0,0,0,0|3,0,0]=3 243 B10R1.4 CNCc1cccnc1C 2230a_106832991635_100000732876 [0,0,0,0,0,0|3,0,0]=3 244 B10R1.4 CNCc1cccnc1C 270004a_106832991635_100000751968 [0,0,0,0,0,0|3,0,0]=3 245 B10R1.4 CNCc1cccnc1C 34a_100102657272_100000732876 [0,0,0,0,0,0|3,0,0]=3 246 B10R1.4 CNCc1cccnc1C 7a_106832991635_100000732876 [0,0,0,0,0,0|3,0,0]=3 247 B10R1.4 CNCc1cccnc1Cl 2230a_100015189234_200000210301 [0,0,0,0,0,0|3,0,0]=3 248 B10R1.4 CNCc1cccnc1Cl 2230a_106832991635_100000045678 [0,0,0,0,0,0|3,0,0]=3 249 B10R1.4 CNCc1cccnc1Cl 34a_100015189234_200000210301 [0,0,0,0,0,0|3,0,0]=3 250 B10R1.4 CNCc1cccnc1Cl 34a_100102657272_100000045678 [0,0,0,0,0,0|3,0,0]=3 251 B10R1.4 CNCc1cccnc1Cl 7a_106832991635_100000045678 [0,0,0,0,0,0|3,0,0]=3 252 B10R1.4 CNCc1cccnc1F 2230a_106832991635_100000099810 [0,0,0,0,0,0|3,0,0]=3 253 B10R1.4 CNCc1cccnc1F 34a_100000724633_200000210301 [0,0,0,0,0,0|3,0,0]=3 254 B10R1.4 CNCc1cccnc1F 34a_100102657272_100000099810 [0,0,0,0,0,0|3,0,0]=3 255 B10R1.4 CNCc1cccnc1F 7a_106832991635_100000099810 [0,0,0,0,0,0|3,0,0]=3 256 B10R1.4 CNCc1cccnc1O 207a_100102657272_100011998315 [0,0,0,0,0,0|2,0,0]=2 257 B10R1.4 CNCc1cccnc1O 270004a_106832991635_100011998315 [0,0,0,0,0,0|2,0,0]=2 258 B10R1.4 CNCc1cccnc1O 271570a_203496583355_103496529121 [0,0,0,0,0,0|2,0,0]=2 259 B10R1.4 CNCc1ccncc1Br 270004a_106832991635_100000755692 [0,0,0,0,0,0|3,0,0]=3 260 B10R1.4 CNCc1ccncc1C 2230a_106832991635_100020672808 [0,0,0,0,0,0|3,0,0]=3 261 B10R1.4 CNCc1ccncc1C 34a_100102657272_100020672809 [0,0,0,0,0,0|3,0,0]=3 262 B10R1.4 CNCc1ccncc1C 7a_106832991635_100020672808 [0,0,0,0,0,0|3,0,0]=3 263 B10R1.4 CNCc1ccncc1Cl 207a_100102657272_100011934409 [0,0,0,0,0,0|3,0,0]=3 264 B10R1.4 CNCc1ccncc1Cl 2230a_106832991635_100000763264 [0,0,0,0,0,0|3,0,0]=3 265 B10R1.4 CNCc1ccncc1Cl 270004a_106832991635_100011934409 [0,0,0,0,0,0|3,0,0]=3 266 B10R1.4 CNCc1ccncc1Cl 7a_106832991635_100000763264 [0,0,0,0,0,0|3,0,0]=3 267 B10R1.4 CNCc1ccncc1F 34a_100011935246_200000210301 [0,0,0,0,0,0|3,0,0]=3 268 B10R1.4 CNCc1cnccc1Br 270004a_106832991635_100009816821 [0,0,0,0,0,0|3,0,0]=3 269 B10R1.4 CNCc1cnccc1C 207a_100102657272_100000685662 [0,0,0,0,0,0|3,0,0]=3 270 B10R1.4 CNCc1cnccc1C 2230a_106832991635_100000690890 [0,0,0,0,0,0|3,0,0]=3 271 B10R1.4 CNCc1cnccc1C 270004a_106832991635_100000685662 [0,0,0,0,0,0|3,0,0]=3 272 B10R1.4 CNCc1cnccc1C 34a_100102657272_100000690890 [0,0,0,0,0,0|3,0,0]=3 273 B10R1.4 CNCc1cnccc1C 7a_106832991635_100000690890 [0,0,0,0,0,0|3,0,0]=3 274 B10R1.4 CNCc1cnccc1Cl 270004a_106832991635_100000050567 [0,0,0,0,0,0|3,0,0]=3 275 B10R1.4 CNCc1ncccc1Br 207a_100102657272_100011934733 [0,0,0,0,0,0|3,0,0]=3 276 B10R1.4 CNCc1ncccc1Br 2230a_106832991635_100025702911 [0,0,0,0,0,0|3,0,0]=3 277 B10R1.4 CNCc1ncccc1Br 270004a_106832991635_100011934733 [0,0,0,0,0,0|3,0,0]=3 278 B10R1.4 CNCc1ncccc1Br 34a_100102657272_100025702911 [0,0,0,0,0,0|3,0,0]=3 279 B10R1.4 CNCc1ncccc1Br 7a_106832991635_100025702911 [0,0,0,0,0,0|3,0,0]=3 280 B10R1.4 CNCc1ncccc1C 207a_100102657272_100000698913 [0,0,0,0,0,0|3,0,0]=3 281 B10R1.4 CNCc1ncccc1C 2230a_106832991635_100000696600 [0,0,0,0,0,0|3,0,0]=3 282 B10R1.4 CNCc1ncccc1C 270004a_106832991635_100000698913 [0,0,0,0,0,0|3,0,0]=3 283 B10R1.4 CNCc1ncccc1C 34a_100011223789_200000210301 [0,0,0,0,0,0|3,0,0]=3 284 B10R1.4 CNCc1ncccc1C 34a_100102657272_100000696600 [0,0,0,0,0,0|3,0,0]=3 285 B10R1.4 CNCc1ncccc1C 7a_106832991635_100000696600 [0,0,0,0,0,0|3,0,0]=3 286 B10R1.4 CNCc1ncccc1Cl 207a_100102657272_100012001307 [0,0,0,0,0,0|3,0,0]=3 287 B10R1.4 CNCc1ncccc1Cl 2230a_100015189233_200000210301 [0,0,0,0,0,0|3,0,0]=3 288 B10R1.4 CNCc1ncccc1Cl 2230a_106832991635_100000099807 [0,0,0,0,0,0|3,0,0]=3 289 B10R1.4 CNCc1ncccc1Cl 270004a_106832991635_100012001307 [0,0,0,0,0,0|3,0,0]=3 290 B10R1.4 CNCc1ncccc1Cl 7a_106832991635_100000099807 [0,0,0,0,0,0|3,0,0]=3 291 B10R1.4 CNCc1ncccc1F 207a_100102657272_100011934734 [0,0,0,0,0,0|3,0,0]=3 292 B10R1.4 CNCc1ncccc1F 2230a_106832991635_100000104219 [0,0,0,0,0,0|3,0,0]=3 293 B10R1.4 CNCc1ncccc1F 270004a_106832991635_100011934734 [0,0,0,0,0,0|3,0,0]=3 294 B10R1.4 CNCc1ncccc1F 34a_100000690088_200000210301 [0,0,0,0,0,0|3,0,0]=3 295 B10R1.4 CNCc1ncccc1F 34a_100102657272_100000104219 [0,0,0,0,0,0|3,0,0]=3 296 B10R1.4 CNCc1ncccc1F 7a_106832991635_100000104219 [0,0,0,0,0,0|3,0,0]=3 297 B10R1.4 CNCc1ncccc1O 34a_100102657272_200020655725 [0,0,0,0,0,0|2,0,0]=2 298 B10R1.4 CNCc1ncccc1O 7a_106832991635_200020655725 [0,0,0,0,0,0|2,0,0]=2 299 B10R1.4 CNCc1nccnc1C 2230a_100020641712_200000210301 [0,0,0,0,0,0|4,0,0]=4 300 B10R1.4 CNCc1nccnc1C 270004a_106832991635_100000050726 [0,0,0,0,0,0|4,0,0]=4 301 B10R1.4 CNCc1nccnc1C 34a_100020641712_200000210301 [0,0,0,0,0,0|4,0,0]=4 302 B10R1.4 CNCc1nccnc1Cl 2230a_100000729963_200000210301 [0,0,0,0,0,0|4,0,0]=4 303 B10R1.4 COCc1ccccc1Br 34a_100000756307_200000210301 [0,0,0,0,0,0|2,0,0]=2 304 B10R1.4 COCc1ccccc1Br 34a_100138415774_100000184730 [0,0,0,0,0,0|2,0,0]=2 305 B10R1.4 COCc1ccccc1Br 7a_100000756307_200000210301 [0,0,0,0,0,0|2,0,0]=2 306 B10R1.4 COCc1ccccc1C 34a_100000698903_200000210301 [0,0,0,0,0,0|2,0,0]=2 307 B10R1.4 COCc1ccccc1C 34a_100138415774_100000211839 [0,0,0,0,0,0|2,0,0]=2 308 B10R1.4 COCc1ccccc1C 7a_100000698903_200000210301 [0,0,0,0,0,0|2,0,0]=2 309 B10R1.4 COCc1ccccc1Cl 34a_100000210847_200000210301 [0,0,0,0,0,0|2,0,0]=2 310 B10R1.4 COCc1ccccc1Cl 34a_100138415774_100000187162 [0,0,0,0,0,0|2,0,0]=2 311 B10R1.4 COCc1ccccc1Cl 7a_100000210847_200000210301 [0,0,0,0,0,0|2,0,0]=2 312 B10R1.4 COCc1ccccc1F 34a_100000211962_200000210301 [0,0,0,0,0,0|2,0,0]=2 313 B10R1.4 COCc1ccccc1F 34a_100138415774_100000211605 [0,0,0,0,0,0|2,0,0]=2 314 B10R1.4 COCc1ccccc1F 7a_100000211962_200000210301 [0,0,0,0,0,0|2,0,0]=2 315 B10R1.4 COCc1ccccc1I 34a_100000187465_200000210301 [0,0,0,0,0,0|2,0,0]=2 316 B10R1.4 COCc1ccccc1I 34a_100138415774_100011215278 [0,0,0,0,0,0|2,0,0]=2 317 B10R1.4 COCc1ccccc1I 7a_100000187465_200000210301 [0,0,0,0,0,0|2,0,0]=2 318 B10R1.4 COCc1ccccc1N 34a_100000212039_200000210301 [0,0,0,0,0,0|2,0,0]=2 319 B10R1.4 COCc1ccccc1O 271570a_203496583355_100011493684 [0,0,0,0,0,0|1,0,0]=1 320 B10R1.4 COCc1cccnc1Br 34a_100000719692_200000210301 [0,0,0,0,0,0|3,0,0]=3 321 B10R1.4 COCc1cccnc1Br 34a_100138415774_100010140945 [0,0,0,0,0,0|3,0,0]=3 322 B10R1.4 COCc1cccnc1Br 7a_100000719692_200000210301 [0,0,0,0,0,0|3,0,0]=3 323 B10R1.4 COCc1cccnc1C 34a_100000729262_200000210301 [0,0,0,0,0,0|3,0,0]=3 324 B10R1.4 COCc1cccnc1C 34a_100138415774_100000732876 [0,0,0,0,0,0|3,0,0]=3 325 B10R1.4 COCc1cccnc1C 7a_100000729262_200000210301 [0,0,0,0,0,0|3,0,0]=3 326 B10R1.4 COCc1cccnc1Cl 34a_100000748726_200000210301 [0,0,0,0,0,0|3,0,0]=3 327 B10R1.4 COCc1cccnc1Cl 34a_100138415774_100000045678 [0,0,0,0,0,0|3,0,0]=3 328 B10R1.4 COCc1cccnc1Cl 7a_100000748726_200000210301 [0,0,0,0,0,0|3,0,0]=3 329 B10R1.4 COCc1cccnc1F 34a_100000079888_200000210301 [0,0,0,0,0,0|3,0,0]=3 330 B10R1.4 COCc1cccnc1F 34a_100138415774_100000099810 [0,0,0,0,0,0|3,0,0]=3 331 B10R1.4 COCc1cccnc1F 7a_100000079888_200000210301 [0,0,0,0,0,0|3,0,0]=3 332 B10R1.4 COCc1ccncc1C 34a_100011997032_200000210301 [0,0,0,0,0,0|3,0,0]=3 333 B10R1.4 COCc1ccncc1C 34a_100138415774_100020672809 [0,0,0,0,0,0|3,0,0]=3 334 B10R1.4 COCc1ccncc1F 34a_100012172863_200000210301 [0,0,0,0,0,0|3,0,0]=3 335 B10R1.4 COCc1cnccc1C 34a_100011996381_200000210301 [0,0,0,0,0,0|3,0,0]=3 336 B10R1.4 COCc1cnccc1C 34a_100138415774_100000690890 [0,0,0,0,0,0|3,0,0]=3 337 B10R1.4 COCc1cnccc1Cl 34a_100000117392_200000210301 [0,0,0,0,0,0|3,0,0]=3 338 B10R1.4 COCc1ncccc1Br 34a_100011996772_200000210301 [0,0,0,0,0,0|3,0,0]=3 339 B10R1.4 COCc1ncccc1Br 34a_100138415774_100025702911 [0,0,0,0,0,0|3,0,0]=3 340 B10R1.4 COCc1ncccc1C 34a_100000698912_200000210301 [0,0,0,0,0,0|3,0,0]=3 341 B10R1.4 COCc1ncccc1C 34a_100138415774_100000696600 [0,0,0,0,0,0|3,0,0]=3 342 B10R1.4 COCc1ncccc1Cl 34a_100012002383_200000210301 [0,0,0,0,0,0|3,0,0]=3 343 B10R1.4 COCc1ncccc1F 34a_100011934865_200000210301 [0,0,0,0,0,0|3,0,0]=3 344 B10R1.4 COCc1ncccc1F 34a_100138415774_100000104219 [0,0,0,0,0,0|3,0,0]=3 345 B10R1.4 COCc1ncccc1N 34a_114873767017_200000210301 [0,0,0,0,0,0|3,0,0]=3 346 B10R1.4 COCc1ncccc1O 34a_100138415774_200020655725 [0,0,0,0,0,0|2,0,0]=2 347 B10R1.4 COCc1nccnc1Cl 34a_100000057004_200000210301 [0,0,0,0,0,0|4,0,0]=4 348 B10R1.4 CSCc1ccccc1Br 62a_100000184730_200000210301 [0,0,0,0,0,0|2,0,0]=2 349 B10R1.4 CSCc1ccccc1Br 62a_200000210301_100000184730 [0,0,0,0,0,0|2,0,0]=2 350 B10R1.4 CSCc1ccccc1C 62a_100000211839_200000210301 [0,0,0,0,0,0|2,0,0]=2 351 B10R1.4 CSCc1ccccc1C 62a_200000210301_100000211839 [0,0,0,0,0,0|2,0,0]=2 352 B10R1.4 CSCc1ccccc1Cl 62a_100000187162_200000210301 [0,0,0,0,0,0|2,0,0]=2 353 B10R1.4 CSCc1ccccc1Cl 62a_200000210301_100000187162 [0,0,0,0,0,0|2,0,0]=2 354 B10R1.4 CSCc1ccccc1F 62a_100000211605_200000210301 [0,0,0,0,0,0|2,0,0]=2 355 B10R1.4 CSCc1ccccc1F 62a_200000210301_100000211605 [0,0,0,0,0,0|2,0,0]=2 356 B10R1.4 CSCc1ccccc1I 62a_100011216222_200000210301 [0,0,0,0,0,0|2,0,0]=2 357 B10R1.4 CSCc1ccccc1I 62a_200000210301_100011216222 [0,0,0,0,0,0|2,0,0]=2 358 B10R1.4 CSCc1ccccc1O 271570a_203496583355_100000148299 [0,0,0,0,0,0|1,0,0]=1 359 B10R1.4 CSCc1cccnc1Br 62a_100010140945_200000210301 [0,0,0,0,0,0|3,0,0]=3 360 B10R1.4 CSCc1cccnc1Br 62a_200000210301_100010140945 [0,0,0,0,0,0|3,0,0]=3 361 B10R1.4 CSCc1cccnc1C 62a_100000732876_200000210301 [0,0,0,0,0,0|3,0,0]=3 362 B10R1.4 CSCc1cccnc1C 62a_200000210301_100000732876 [0,0,0,0,0,0|3,0,0]=3 363 B10R1.4 CSCc1cccnc1Cl 62a_100000045678_200000210301 [0,0,0,0,0,0|3,0,0]=3 364 B10R1.4 CSCc1cccnc1Cl 62a_200000210301_100000045678 [0,0,0,0,0,0|3,0,0]=3 365 B10R1.4 CSCc1cccnc1F 62a_100000099810_200000210301 [0,0,0,0,0,0|3,0,0]=3 366 B10R1.4 CSCc1cccnc1F 62a_200000210301_100000099810 [0,0,0,0,0,0|3,0,0]=3 367 B10R1.4 CSCc1ccncc1C 62a_100020672808_200000210301 [0,0,0,0,0,0|3,0,0]=3 368 B10R1.4 CSCc1ccncc1C 62a_200000210301_100020672808 [0,0,0,0,0,0|3,0,0]=3 369 B10R1.4 CSCc1ccncc1Cl 62a_100000763264_200000210301 [0,0,0,0,0,0|3,0,0]=3 370 B10R1.4 CSCc1ccncc1Cl 62a_200000210301_100000763264 [0,0,0,0,0,0|3,0,0]=3 371 B10R1.4 CSCc1cnccc1C 62a_100000690890_200000210301 [0,0,0,0,0,0|3,0,0]=3 372 B10R1.4 CSCc1cnccc1C 62a_200000210301_100000690890 [0,0,0,0,0,0|3,0,0]=3 373 B10R1.4 CSCc1ncccc1Br 62a_100025702911_200000210301 [0,0,0,0,0,0|3,0,0]=3 374 B10R1.4 CSCc1ncccc1Br 62a_200000210301_100025702911 [0,0,0,0,0,0|3,0,0]=3 375 B10R1.4 CSCc1ncccc1C 62a_100000696600_200000210301 [0,0,0,0,0,0|3,0,0]=3 376 B10R1.4 CSCc1ncccc1C 62a_200000210301_100000696600 [0,0,0,0,0,0|3,0,0]=3 377 B10R1.4 CSCc1ncccc1Cl 62a_100000099807_200000210301 [0,0,0,0,0,0|3,0,0]=3 378 B10R1.4 CSCc1ncccc1Cl 62a_200000210301_100000099807 [0,0,0,0,0,0|3,0,0]=3 379 B10R1.4 CSCc1ncccc1F 62a_100000104219_200000210301 [0,0,0,0,0,0|3,0,0]=3 380 B10R1.4 CSCc1ncccc1F 62a_200000210301_100000104219 [0,0,0,0,0,0|3,0,0]=3 381 B10R1.4 CSCc1ncccc1O 62a_200000210301_200020655725 [0,0,0,0,0,0|2,0,0]=2 382 B10R1.4 CSCc1ncccc1O 62a_200020655725_200000210301 [0,0,0,0,0,0|2,0,0]=2 383 B10R1.4 C[n+]1ccccc1SCF 62a_100015361967_100000212160 [0,0,0,0,0,0|4,0,0]=4 384 B10R1.4 Cc1ccccc1CN[13CH3] 34a_100000174972_200025704644 [0,0,0,0,0,0|2,0,0]=2 385 B10R1.4 Cc1ccccc1CO[13CH3] 34a_100000698903_200025704644 [0,0,0,0,0,0|2,0,0]=2 386 B10R1.4 Cc1ccccc1CO[13CH3] 7a_100000698903_200025704644 [0,0,0,0,0,0|2,0,0]=2 387 B10R1.4 Cc1ccccc1CS[13CH3] 62a_100000211839_200025704644 [0,0,0,0,0,0|2,0,0]=2 388 B10R1.4 Cc1ccccc1CS[13CH3] 62a_200025704644_100000211839 [0,0,0,0,0,0|2,0,0]=2 389 B10R1.4 Cc1ccccc1NCF 34a_100015192222_100015361967 [0,0,0,0,0,0|3,0,0]=3 390 B10R1.4 Cc1ccccc1OCF 34a_100000210338_100015361967 [0,0,0,0,0,0|3,0,0]=3 391 B10R1.4 Cc1ccccc1OCF 7a_100000210338_100015361967 [0,0,0,0,0,0|3,0,0]=3 392 B10R1.4 Cc1ccccc1SCF 62a_100000210755_100015361967 [0,0,0,0,0,0|3,0,0]=3 393 B10R1.4 Cc1ccccc1SCF 62a_100015361967_100000210755 [0,0,0,0,0,0|3,0,0]=3 394 B10R1.4 Cc1cccnc1CN[13CH3] 34a_100011223789_200025704644 [0,0,0,0,0,0|3,0,0]=3 395 B10R1.4 Cc1cccnc1CO[13CH3] 34a_100000698912_200025704644 [0,0,0,0,0,0|3,0,0]=3 396 B10R1.4 Cc1cccnc1CS[13CH3] 62a_100000696600_200025704644 [0,0,0,0,0,0|3,0,0]=3 397 B10R1.4 Cc1cccnc1CS[13CH3] 62a_200025704644_100000696600 [0,0,0,0,0,0|3,0,0]=3 398 B10R1.4 Cc1cccnc1SCF 62a_100000751373_100015361967 [0,0,0,0,0,0|4,0,0]=4 399 B10R1.4 Cc1cccnc1SCF 62a_100015361967_100000751373 [0,0,0,0,0,0|4,0,0]=4 400 B10R1.4 Cc1ccncc1CO[13CH3] 34a_100011996381_200025704644 [0,0,0,0,0,0|3,0,0]=3 401 B10R1.4 Cc1ccncc1CS[13CH3] 62a_100000690890_200025704644 [0,0,0,0,0,0|3,0,0]=3 402 B10R1.4 Cc1ccncc1CS[13CH3] 62a_200025704644_100000690890 [0,0,0,0,0,0|3,0,0]=3 403 B10R1.4 Cc1ccncc1OCF 34a_100011997053_100015361967 [0,0,0,0,0,0|4,0,0]=4 404 B10R1.4 Cc1ccncc1OCF 7a_100011997053_100015361967 [0,0,0,0,0,0|4,0,0]=4 405 B10R1.4 Cc1ccncc1SCF 62a_100000761580_100015361967 [0,0,0,0,0,0|4,0,0]=4 406 B10R1.4 Cc1ccncc1SCF 62a_100015361967_100000761580 [0,0,0,0,0,0|4,0,0]=4 407 B10R1.4 Cc1cnccc1CO[13CH3] 34a_100011997032_200025704644 [0,0,0,0,0,0|3,0,0]=3 408 B10R1.4 Cc1cnccc1CS[13CH3] 62a_100020672808_200025704644 [0,0,0,0,0,0|3,0,0]=3 409 B10R1.4 Cc1cnccc1CS[13CH3] 62a_200025704644_100020672808 [0,0,0,0,0,0|3,0,0]=3 410 B10R1.4 Cc1cnccc1OCF 34a_100000694293_100015361967 [0,0,0,0,0,0|4,0,0]=4 411 B10R1.4 Cc1cnccc1SCF 62a_100000765111_100015361967 [0,0,0,0,0,0|4,0,0]=4 412 B10R1.4 Cc1cnccc1SCF 62a_100015361967_100000765111 [0,0,0,0,0,0|4,0,0]=4 413 B10R1.4 Cc1ncccc1CO[13CH3] 34a_100000729262_200025704644 [0,0,0,0,0,0|3,0,0]=3 414 B10R1.4 Cc1ncccc1CO[13CH3] 7a_100000729262_200025704644 [0,0,0,0,0,0|3,0,0]=3 415 B10R1.4 Cc1ncccc1CS[13CH3] 62a_100000732876_200025704644 [0,0,0,0,0,0|3,0,0]=3 416 B10R1.4 Cc1ncccc1CS[13CH3] 62a_200025704644_100000732876 [0,0,0,0,0,0|3,0,0]=3 417 B10R1.4 Cc1ncccc1OCF 34a_100000745507_100015361967 [0,0,0,0,0,0|4,0,0]=4 418 B10R1.4 Cc1ncccc1OCF 7a_100000745507_100015361967 [0,0,0,0,0,0|4,0,0]=4 419 B10R1.4 Cc1ncccc1SCF 62a_100000751574_100015361967 [0,0,0,0,0,0|4,0,0]=4 420 B10R1.4 Cc1ncccc1SCF 62a_100015361967_100000751574 [0,0,0,0,0,0|4,0,0]=4 421 B10R1.4 Cc1nccnc1CN[13CH3] 2230a_100020641712_200025704644 [0,0,0,0,0,0|4,0,0]=4 422 B10R1.4 Cc1nccnc1CN[13CH3] 34a_100020641712_200025704644 [0,0,0,0,0,0|4,0,0]=4 423 B10R1.4 FCNc1ccccc1Br 34a_100000210017_100015361967 [0,0,0,0,0,0|3,0,0]=3 424 B10R1.4 FCNc1ccccc1Cl 34a_100000185783_100015361967 [0,0,0,0,0,0|3,0,0]=3 425 B10R1.4 FCNc1ccccc1F 34a_100000210422_100015361967 [0,0,0,0,0,0|3,0,0]=3 426 B10R1.4 FCNc1ccccc1I 34a_100000210053_100015361967 [0,0,0,0,0,0|3,0,0]=3 427 B10R1.4 FCOc1ccccc1Br 34a_100000181306_100015361967 [0,0,0,0,0,0|3,0,0]=3 428 B10R1.4 FCOc1ccccc1Br 7a_100000181306_100015361967 [0,0,0,0,0,0|3,0,0]=3 429 B10R1.4 FCOc1ccccc1Cl 34a_100000210172_100015361967 [0,0,0,0,0,0|3,0,0]=3 430 B10R1.4 FCOc1ccccc1Cl 7a_100000210172_100015361967 [0,0,0,0,0,0|3,0,0]=3 431 B10R1.4 FCOc1ccccc1F 34a_100000210171_100015361967 [0,0,0,0,0,0|3,0,0]=3 432 B10R1.4 FCOc1ccccc1F 7a_100000210171_100015361967 [0,0,0,0,0,0|3,0,0]=3 433 B10R1.4 FCOc1ccccc1I 34a_100000739446_100015361967 [0,0,0,0,0,0|3,0,0]=3 434 B10R1.4 FCOc1ccccc1I 7a_100000739446_100015361967 [0,0,0,0,0,0|3,0,0]=3 435 B10R1.4 FCOc1cccnc1Br 34a_100000744436_100015361967 [0,0,0,0,0,0|4,0,0]=4 436 B10R1.4 FCOc1cccnc1Br 7a_100000744436_100015361967 [0,0,0,0,0,0|4,0,0]=4 437 B10R1.4 FCOc1cccnc1Cl 34a_100000757616_100015361967 [0,0,0,0,0,0|4,0,0]=4 438 B10R1.4 FCOc1cccnc1Cl 7a_100000757616_100015361967 [0,0,0,0,0,0|4,0,0]=4 439 B10R1.4 FCOc1cccnc1F 34a_100000061740_100015361967 [0,0,0,0,0,0|4,0,0]=4 440 B10R1.4 FCOc1cccnc1F 7a_100000061740_100015361967 [0,0,0,0,0,0|4,0,0]=4 441 B10R1.4 FCOc1cccnc1I 34a_100000034122_100015361967 [0,0,0,0,0,0|4,0,0]=4 442 B10R1.4 FCOc1cccnc1I 7a_100000034122_100015361967 [0,0,0,0,0,0|4,0,0]=4 443 B10R1.4 FCOc1ccncc1Br 34a_100011996408_100015361967 [0,0,0,0,0,0|4,0,0]=4 444 B10R1.4 FCOc1ccncc1Cl 34a_100011997054_100015361967 [0,0,0,0,0,0|4,0,0]=4 445 B10R1.4 FCOc1ccncc1F 34a_200000081243_100015361967 [0,0,0,0,0,0|4,0,0]=4 446 B10R1.4 FCOc1cnccc1Cl 34a_100011996695_100015361967 [0,0,0,0,0,0|4,0,0]=4 447 B10R1.4 FCOc1cnccc1I 34a_100000050107_100015361967 [0,0,0,0,0,0|4,0,0]=4 448 B10R1.4 FCOc1ncccc1Cl 34a_100011290957_100015361967 [0,0,0,0,0,0|4,0,0]=4 449 B10R1.4 FCOc1ncccc1F 34a_100011219419_100015361967 [0,0,0,0,0,0|4,0,0]=4 450 B10R1.4 FCSc1c[nH]ccc1=S 62a_100015361967_200012280681 [0,0,0,0,0,0|3,1,0]=4 451 B10R1.4 FCSc1c[nH]ccc1=S 62a_200012280681_100015361967 [0,0,0,0,0,0|3,1,0]=4 452 B10R1.4 FCSc1ccccc1Br 62a_100000695589_100015361967 [0,0,0,0,0,0|3,0,0]=3 453 B10R1.4 FCSc1ccccc1Br 62a_100015361967_100000695589 [0,0,0,0,0,0|3,0,0]=3 454 B10R1.4 FCSc1ccccc1Cl 62a_100000764095_100015361967 [0,0,0,0,0,0|3,0,0]=3 455 B10R1.4 FCSc1ccccc1Cl 62a_100015361967_100000764095 [0,0,0,0,0,0|3,0,0]=3 456 B10R1.4 FCSc1ccccc1F 62a_100011215700_100015361967 [0,0,0,0,0,0|3,0,0]=3 457 B10R1.4 FCSc1ccccc1F 62a_100015361967_100011215700 [0,0,0,0,0,0|3,0,0]=3 458 B10R1.4 FCSc1cccnc1Br 62a_100010202626_100015361967 [0,0,0,0,0,0|4,0,0]=4 459 B10R1.4 FCSc1cccnc1Br 62a_100015361967_100010202626 [0,0,0,0,0,0|4,0,0]=4 460 B10R1.4 FCSc1cccnc1Cl 62a_100000036424_100015361967 [0,0,0,0,0,0|4,0,0]=4 461 B10R1.4 FCSc1cccnc1Cl 62a_100015361967_100000036424 [0,0,0,0,0,0|4,0,0]=4 462 B10R1.4 FCSc1cccnc1F 62a_100009816115_100015361967 [0,0,0,0,0,0|4,0,0]=4 463 B10R1.4 FCSc1cccnc1F 62a_100015361967_100009816115 [0,0,0,0,0,0|4,0,0]=4 464 B10R1.4 FCSc1ccncc1Br 62a_100000726257_100015361967 [0,0,0,0,0,0|4,0,0]=4 465 B10R1.4 FCSc1ccncc1Br 62a_100015361967_100000726257 [0,0,0,0,0,0|4,0,0]=4 466 B10R1.4 FCSc1ccncc1Cl 62a_100000708259_100015361967 [0,0,0,0,0,0|4,0,0]=4 467 B10R1.4 FCSc1ccncc1Cl 62a_100015361967_100000708259 [0,0,0,0,0,0|4,0,0]=4 468 B10R1.4 FCSc1ccncc1F 62a_100000047030_100015361967 [0,0,0,0,0,0|4,0,0]=4 469 B10R1.4 FCSc1ccncc1F 62a_100015361967_100000047030 [0,0,0,0,0,0|4,0,0]=4 470 B10R1.4 FCSc1cnccc1Br 62a_100010138639_100015361967 [0,0,0,0,0,0|4,0,0]=4 471 B10R1.4 FCSc1cnccc1Br 62a_100015361967_100010138639 [0,0,0,0,0,0|4,0,0]=4 472 B10R1.4 FCSc1cnccc1Cl 62a_100009995489_100015361967 [0,0,0,0,0,0|4,0,0]=4 473 B10R1.4 FCSc1cnccc1Cl 62a_100015361967_100009995489 [0,0,0,0,0,0|4,0,0]=4 474 B10R1.4 FCSc1cnccc1F 62a_100009820683_100015361967 [0,0,0,0,0,0|4,0,0]=4 475 B10R1.4 FCSc1cnccc1F 62a_100015361967_100009820683 [0,0,0,0,0,0|4,0,0]=4 476 B10R1.4 FCSc1ncccc1Br 62a_100000696092_100015361967 [0,0,0,0,0,0|4,0,0]=4 477 B10R1.4 FCSc1ncccc1Br 62a_100015361967_100000696092 [0,0,0,0,0,0|4,0,0]=4 478 B10R1.4 FCSc1ncccc1Cl 62a_100011356963_100015361967 [0,0,0,0,0,0|4,0,0]=4 479 B10R1.4 FCSc1ncccc1Cl 62a_100015361967_100011356963 [0,0,0,0,0,0|4,0,0]=4 480 B10R1.4 FCSc1ncccc1F 62a_100000685392_100015361967 [0,0,0,0,0,0|4,0,0]=4 481 B10R1.4 FCSc1ncccc1F 62a_100015361967_100000685392 [0,0,0,0,0,0|4,0,0]=4 482 B10R1.4 N#CCc1ccccc1O 271570a_203496583355_100000033512 [0,0,0,0,0,0|1,0,1]=2 483 B10R1.4 N#CCc1cccnc1O 271570a_203496583355_100000096391 [0,0,0,0,0,0|2,0,1]=3 484 B10R1.4 N#CCc1ncccc1O 271570a_203496583355_100011824415 [0,0,0,0,0,0|2,0,1]=3 485 B10R1.4 NCCc1ccccc1O 271570a_203496583355_100000747383 [0,0,0,0,0,0|1,0,0]=1 486 B10R1.4 NNCc1ccccc1O 271570a_203496583355_200016993956 [0,0,0,0,0,0|2,0,0]=2 487 B10R1.4 Nc1ccccc1OCF 34a_100000185747_100015361967 [0,0,0,0,0,0|3,0,0]=3 488 B10R1.4 Nc1ccccc1OCF 7a_100000185747_100015361967 [0,0,0,0,0,0|3,0,0]=3 489 B10R1.4 Nc1ccccc1SCF 62a_100000210017_100015361967 [0,0,0,0,0,0|3,0,0]=3 490 B10R1.4 Nc1ccccc1SCF 62a_100015361967_100000210017 [0,0,0,0,0,0|3,0,0]=3 491 B10R1.4 Nc1cccnc1OCF 34a_100000746358_100015361967 [0,0,0,0,0,0|4,0,0]=4 492 B10R1.4 Nc1cccnc1SCF 62a_100000688686_100015361967 [0,0,0,0,0,0|4,0,0]=4 493 B10R1.4 Nc1cccnc1SCF 62a_100015361967_100000688686 [0,0,0,0,0,0|4,0,0]=4 494 B10R1.4 Nc1ccncc1OCF 34a_100000753702_100015361967 [0,0,0,0,0,0|4,0,0]=4 495 B10R1.4 Nc1ccncc1SCF 62a_100000047001_100015361967 [0,0,0,0,0,0|4,0,0]=4 496 B10R1.4 Nc1ccncc1SCF 62a_100015361967_100000047001 [0,0,0,0,0,0|4,0,0]=4 497 B10R1.4 Nc1cnccc1SCF 62a_100000756074_100015361967 [0,0,0,0,0,0|4,0,0]=4 498 B10R1.4 Nc1cnccc1SCF 62a_100015361967_100000756074 [0,0,0,0,0,0|4,0,0]=4 499 B10R1.4 Nc1ncccc1OCF 34a_100000211975_100015361967 [0,0,0,0,0,0|4,0,0]=4 500 B10R1.4 Nc1ncccc1OCF 7a_100000211975_100015361967 [0,0,0,0,0,0|4,0,0]=4 501 B10R1.4 Nc1ncccc1SCF 62a_100000045569_100015361967 [0,0,0,0,0,0|4,0,0]=4 502 B10R1.4 Nc1ncccc1SCF 62a_100015361967_100000045569 [0,0,0,0,0,0|4,0,0]=4 503 B10R1.4 O=c1cc[nH]cc1SCF 62a_100009998708_100015361967 [0,0,0,0,0,0|3,0,1]=4 504 B10R1.4 O=c1cc[nH]cc1SCF 62a_100015361967_100009998708 [0,0,0,0,0,0|3,0,1]=4 505 B10R1.4 O=c1ccocc1OCF 34a_100000060831_100015361967 [0,0,0,0,0,0|3,0,1]=4 506 B10R1.4 O=c1occcc1OCF 34a_100000077404_100015361967 [0,0,0,0,0,0|3,0,1]=4 507 B10R1.4 O=c1occcc1OCF 7a_100000077404_100015361967 [0,0,0,0,0,0|3,0,1]=4 508 B10R1.4 OCCc1ccccc1O 271570a_203496583355_100000731337 [0,0,0,0,0,0|1,0,0]=1 509 B10R1.4 Oc1ccccc1NCF 34a_100000185747_100015361967 [0,0,0,0,0,0|2,0,0]=2 510 B10R1.4 Oc1ccccc1SCF 62a_100000739446_100015361967 [0,0,0,0,0,0|2,0,0]=2 511 B10R1.4 Oc1ccccc1SCF 62a_100015361967_100000739446 [0,0,0,0,0,0|2,0,0]=2 512 B10R1.4 Oc1cccnc1SCF 62a_100000034122_100015361967 [0,0,0,0,0,0|3,0,0]=3 513 B10R1.4 Oc1cccnc1SCF 62a_100015361967_100000034122 [0,0,0,0,0,0|3,0,0]=3 514 B10R1.4 Oc1cnccc1SCF 62a_100009817591_100015361967 [0,0,0,0,0,0|3,0,0]=3 515 B10R1.4 Oc1cnccc1SCF 62a_100015361967_100009817591 [0,0,0,0,0,0|3,0,0]=3 516 B10R1.4 Oc1ncccc1SCF 62a_100000760158_100015361967 [0,0,0,0,0,0|3,0,0]=3 517 B10R1.4 Oc1ncccc1SCF 62a_100015361967_100000760158 [0,0,0,0,0,0|3,0,0]=3 518 B10R1.4 Oc1ncncc1SCF 62a_100000751107_100015361967 [0,0,0,0,0,0|4,0,0]=4 519 B10R1.4 Oc1ncncc1SCF 62a_100015361967_100000751107 [0,0,0,0,0,0|4,0,0]=4 520 B10R1.4 [13CH3]NCc1ccccc1Br 2230a_100000689332_200025704644 [0,0,0,0,0,0|2,0,0]=2 521 B10R1.4 [13CH3]NCc1ccccc1Br 34a_100000689332_200025704644 [0,0,0,0,0,0|2,0,0]=2 522 B10R1.4 [13CH3]NCc1ccccc1Cl 2230a_100000174879_200025704644 [0,0,0,0,0,0|2,0,0]=2 523 B10R1.4 [13CH3]NCc1ccccc1Cl 34a_100000174879_200025704644 [0,0,0,0,0,0|2,0,0]=2 524 B10R1.4 [13CH3]NCc1ccccc1F 34a_100000174869_200025704644 [0,0,0,0,0,0|2,0,0]=2 525 B10R1.4 [13CH3]NCc1ccccc1O 34a_100000185550_200025704644 [0,0,0,0,0,0|1,0,0]=1 526 B10R1.4 [13CH3]NCc1cccnc1Br 2230a_100009818023_200025704644 [0,0,0,0,0,0|3,0,0]=3 527 B10R1.4 [13CH3]NCc1cccnc1Br 34a_100009818023_200025704644 [0,0,0,0,0,0|3,0,0]=3 528 B10R1.4 [13CH3]NCc1cccnc1Cl 2230a_100015189234_200025704644 [0,0,0,0,0,0|3,0,0]=3 529 B10R1.4 [13CH3]NCc1cccnc1Cl 34a_100015189234_200025704644 [0,0,0,0,0,0|3,0,0]=3 530 B10R1.4 [13CH3]NCc1cccnc1F 34a_100000724633_200025704644 [0,0,0,0,0,0|3,0,0]=3 531 B10R1.4 [13CH3]NCc1ccncc1F 34a_100011935246_200025704644 [0,0,0,0,0,0|3,0,0]=3 532 B10R1.4 [13CH3]NCc1ncccc1Cl 2230a_100015189233_200025704644 [0,0,0,0,0,0|3,0,0]=3 533 B10R1.4 [13CH3]NCc1ncccc1F 34a_100000690088_200025704644 [0,0,0,0,0,0|3,0,0]=3 534 B10R1.4 [13CH3]NCc1nccnc1Cl 2230a_100000729963_200025704644 [0,0,0,0,0,0|4,0,0]=4 535 B10R1.4 [13CH3]OCc1ccccc1Br 34a_100000756307_200025704644 [0,0,0,0,0,0|2,0,0]=2 536 B10R1.4 [13CH3]OCc1ccccc1Br 7a_100000756307_200025704644 [0,0,0,0,0,0|2,0,0]=2 537 B10R1.4 [13CH3]OCc1ccccc1Cl 34a_100000210847_200025704644 [0,0,0,0,0,0|2,0,0]=2 538 B10R1.4 [13CH3]OCc1ccccc1Cl 7a_100000210847_200025704644 [0,0,0,0,0,0|2,0,0]=2 539 B10R1.4 [13CH3]OCc1ccccc1F 34a_100000211962_200025704644 [0,0,0,0,0,0|2,0,0]=2 540 B10R1.4 [13CH3]OCc1ccccc1F 7a_100000211962_200025704644 [0,0,0,0,0,0|2,0,0]=2 541 B10R1.4 [13CH3]OCc1ccccc1I 34a_100000187465_200025704644 [0,0,0,0,0,0|2,0,0]=2 542 B10R1.4 [13CH3]OCc1ccccc1I 7a_100000187465_200025704644 [0,0,0,0,0,0|2,0,0]=2 543 B10R1.4 [13CH3]OCc1ccccc1N 34a_100000212039_200025704644 [0,0,0,0,0,0|2,0,0]=2 544 B10R1.4 [13CH3]OCc1cccnc1Br 34a_100000719692_200025704644 [0,0,0,0,0,0|3,0,0]=3 545 B10R1.4 [13CH3]OCc1cccnc1Br 7a_100000719692_200025704644 [0,0,0,0,0,0|3,0,0]=3 546 B10R1.4 [13CH3]OCc1cccnc1Cl 34a_100000748726_200025704644 [0,0,0,0,0,0|3,0,0]=3 547 B10R1.4 [13CH3]OCc1cccnc1Cl 7a_100000748726_200025704644 [0,0,0,0,0,0|3,0,0]=3 548 B10R1.4 [13CH3]OCc1cccnc1F 34a_100000079888_200025704644 [0,0,0,0,0,0|3,0,0]=3 549 B10R1.4 [13CH3]OCc1cccnc1F 7a_100000079888_200025704644 [0,0,0,0,0,0|3,0,0]=3 550 B10R1.4 [13CH3]OCc1ccncc1F 34a_100012172863_200025704644 [0,0,0,0,0,0|3,0,0]=3 551 B10R1.4 [13CH3]OCc1cnccc1Cl 34a_100000117392_200025704644 [0,0,0,0,0,0|3,0,0]=3 552 B10R1.4 [13CH3]OCc1ncccc1Br 34a_100011996772_200025704644 [0,0,0,0,0,0|3,0,0]=3 553 B10R1.4 [13CH3]OCc1ncccc1Cl 34a_100012002383_200025704644 [0,0,0,0,0,0|3,0,0]=3 554 B10R1.4 [13CH3]OCc1ncccc1F 34a_100011934865_200025704644 [0,0,0,0,0,0|3,0,0]=3 555 B10R1.4 [13CH3]OCc1ncccc1N 34a_114873767017_200025704644 [0,0,0,0,0,0|3,0,0]=3 556 B10R1.4 [13CH3]OCc1nccnc1Cl 34a_100000057004_200025704644 [0,0,0,0,0,0|4,0,0]=4 557 B10R1.4 [13CH3]SCc1ccccc1Br 62a_100000184730_200025704644 [0,0,0,0,0,0|2,0,0]=2 558 B10R1.4 [13CH3]SCc1ccccc1Br 62a_200025704644_100000184730 [0,0,0,0,0,0|2,0,0]=2 559 B10R1.4 [13CH3]SCc1ccccc1Cl 62a_100000187162_200025704644 [0,0,0,0,0,0|2,0,0]=2 560 B10R1.4 [13CH3]SCc1ccccc1Cl 62a_200025704644_100000187162 [0,0,0,0,0,0|2,0,0]=2 561 B10R1.4 [13CH3]SCc1ccccc1F 62a_100000211605_200025704644 [0,0,0,0,0,0|2,0,0]=2 562 B10R1.4 [13CH3]SCc1ccccc1F 62a_200025704644_100000211605 [0,0,0,0,0,0|2,0,0]=2 563 B10R1.4 [13CH3]SCc1ccccc1I 62a_100011216222_200025704644 [0,0,0,0,0,0|2,0,0]=2 564 B10R1.4 [13CH3]SCc1ccccc1I 62a_200025704644_100011216222 [0,0,0,0,0,0|2,0,0]=2 565 B10R1.4 [13CH3]SCc1cccnc1Br 62a_100010140945_200025704644 [0,0,0,0,0,0|3,0,0]=3 566 B10R1.4 [13CH3]SCc1cccnc1Br 62a_200025704644_100010140945 [0,0,0,0,0,0|3,0,0]=3 567 B10R1.4 [13CH3]SCc1cccnc1Cl 62a_100000045678_200025704644 [0,0,0,0,0,0|3,0,0]=3 568 B10R1.4 [13CH3]SCc1cccnc1Cl 62a_200025704644_100000045678 [0,0,0,0,0,0|3,0,0]=3 569 B10R1.4 [13CH3]SCc1cccnc1F 62a_100000099810_200025704644 [0,0,0,0,0,0|3,0,0]=3 570 B10R1.4 [13CH3]SCc1cccnc1F 62a_200025704644_100000099810 [0,0,0,0,0,0|3,0,0]=3 571 B10R1.4 [13CH3]SCc1ccncc1Cl 62a_100000763264_200025704644 [0,0,0,0,0,0|3,0,0]=3 572 B10R1.4 [13CH3]SCc1ccncc1Cl 62a_200025704644_100000763264 [0,0,0,0,0,0|3,0,0]=3 573 B10R1.4 [13CH3]SCc1ncccc1Br 62a_100025702911_200025704644 [0,0,0,0,0,0|3,0,0]=3 574 B10R1.4 [13CH3]SCc1ncccc1Br 62a_200025704644_100025702911 [0,0,0,0,0,0|3,0,0]=3 575 B10R1.4 [13CH3]SCc1ncccc1Cl 62a_100000099807_200025704644 [0,0,0,0,0,0|3,0,0]=3 576 B10R1.4 [13CH3]SCc1ncccc1Cl 62a_200025704644_100000099807 [0,0,0,0,0,0|3,0,0]=3 577 B10R1.4 [13CH3]SCc1ncccc1F 62a_100000104219_200025704644 [0,0,0,0,0,0|3,0,0]=3 578 B10R1.4 [13CH3]SCc1ncccc1F 62a_200025704644_100000104219 [0,0,0,0,0,0|3,0,0]=3 579 B10R1.4 [13CH3]SCc1ncccc1O 62a_200020655725_200025704644 [0,0,0,0,0,0|2,0,0]=2 580 B10R1.4 [13CH3]SCc1ncccc1O 62a_200025704644_200020655725 [0,0,0,0,0,0|2,0,0]=2 581 B10R1.4 [N-]=[N+]=Nc1ccccc1O 271570a_203496583355_100000762926 [0,0,0,0,0,0|3,0,0]=3 582 B10R1.4 [N-]=[N+]=Nc1ncccc1O 271570a_203496583355_100012787798 [0,0,0,0,0,0|4,0,0]=4 583 B10R1.4 [O-][n+]1ccccc1OCF 7a_100000211761_100015361967 [0,0,0,0,0,0|3,0,1]=4 584 B10R1.4 [O-][n+]1ccccc1SCF 62a_100015361967_200000042595 [0,0,0,0,0,0|3,0,1]=4 585 B9R1.8 C=C=Cc1ccccc1 271570a_100015277604_100000210277 [1,0,0,0,0,0|0,0,3]=4 586 B9R1.8 CC=Cc1ccccc1 271570a_100016259895_100000210277 [1,0,0,0,0,0|0,0,2]=3 587 B9R1.8 CC=Cc1ccccn1 271570a_100016259895_100011216584 [1,0,0,0,0,0|1,0,2]=4 588 B9R1.8 CC=Cc1cccnc1 271570a_100016259895_100000752921 [1,0,0,0,0,0|1,0,2]=4 589 B9R1.8 CC=Cc1ccncc1 271570a_100016259895_100000035832 [1,0,0,0,0,0|1,0,2]=4 590 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [1,0,0,0,0,0|1,0,0]=2 591 B9R1.8 CCNc1cccnn1 27a_100015525214_100016991348 [1,0,0,0,0,0|3,0,0]=4 592 B9R1.8 CCNc1ccncn1 27a_100015525214_100000703185 [1,0,0,0,0,0|3,0,0]=4 593 B9R1.8 CCNc1cnccn1 27a_100015525214_100000211759 [1,0,0,0,0,0|3,0,0]=4 594 B9R1.8 CCNc1ncccn1 27a_100015525214_100000211032 [1,0,0,0,0,0|3,0,0]=4 595 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [1,0,0,0,0,0|1,0,0]=2 596 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [1,0,0,0,0,0|1,0,0]=2 597 B9R1.8 CCOc1cccnc1 34a_100000210849_100000210202 [1,0,0,0,0,0|2,0,0]=3 598 B9R1.8 CCOc1cccnc1 7a_100000210849_100000210202 [1,0,0,0,0,0|2,0,0]=3 599 B9R1.8 CCOc1ccncc1 34a_100000212176_100000210202 [1,0,0,0,0,0|2,0,0]=3 600 B9R1.8 CCOc1ccnnc1 34a_100015204005_100000210202 [1,0,0,0,0,0|3,0,0]=4 601 B9R1.8 CCOc1cncnc1 7a_100000754086_100000210202 [1,0,0,0,0,0|3,0,0]=4 602 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [1,0,0,0,0,0|1,0,0]=2 603 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [1,0,0,0,0,0|1,0,0]=2 604 B9R1.8 CCSc1ccccn1 62a_100000210202_100011216584 [1,0,0,0,0,0|2,0,0]=3 605 B9R1.8 CCSc1ccccn1 62a_100011216584_100000210202 [1,0,0,0,0,0|2,0,0]=3 606 B9R1.8 CCSc1cccnc1 62a_100000210063_100000210202 [1,0,0,0,0,0|2,0,0]=3 607 B9R1.8 CCSc1cccnc1 62a_100000210202_100000210063 [1,0,0,0,0,0|2,0,0]=3 608 B9R1.8 CCSc1cccnn1 62a_100000210202_100016991348 [1,0,0,0,0,0|3,0,0]=4 609 B9R1.8 CCSc1cccnn1 62a_100016991348_100000210202 [1,0,0,0,0,0|3,0,0]=4 610 B9R1.8 CCSc1ccncc1 62a_100000210202_100000728582 [1,0,0,0,0,0|2,0,0]=3 611 B9R1.8 CCSc1ccncc1 62a_100000728582_100000210202 [1,0,0,0,0,0|2,0,0]=3 612 B9R1.8 CCSc1ccncn1 62a_100000210202_100000703185 [1,0,0,0,0,0|3,0,0]=4 613 B9R1.8 CCSc1ccncn1 62a_100000703185_100000210202 [1,0,0,0,0,0|3,0,0]=4 614 B9R1.8 CCSc1ccnnc1 62a_100000210202_100000732662 [1,0,0,0,0,0|3,0,0]=4 615 B9R1.8 CCSc1ccnnc1 62a_100000732662_100000210202 [1,0,0,0,0,0|3,0,0]=4 616 B9R1.8 CCSc1cnccn1 62a_100000210202_100000211759 [1,0,0,0,0,0|3,0,0]=4 617 B9R1.8 CCSc1cnccn1 62a_100000211759_100000210202 [1,0,0,0,0,0|3,0,0]=4 618 B9R1.8 CCSc1cncnc1 62a_100000210202_100011206942 [1,0,0,0,0,0|3,0,0]=4 619 B9R1.8 CCSc1cncnc1 62a_100011206942_100000210202 [1,0,0,0,0,0|3,0,0]=4 620 B9R1.8 CCSc1ncccn1 62a_100000210202_100000211032 [1,0,0,0,0,0|3,0,0]=4 621 B9R1.8 CCSc1ncccn1 62a_100000211032_100000210202 [1,0,0,0,0,0|3,0,0]=4 622 B9R1.8 CNCc1ccccc1 207a_100102657272_100015611070 [1,0,0,0,0,0|1,0,0]=2 623 B9R1.8 CNCc1ccccc1 2230a_100015324214_200000210301 [1,0,0,0,0,0|1,0,0]=2 624 B9R1.8 CNCc1ccccc1 2230a_106832991635_100015291786 [1,0,0,0,0,0|1,0,0]=2 625 B9R1.8 CNCc1ccccc1 270004a_106832991635_100015611070 [1,0,0,0,0,0|1,0,0]=2 626 B9R1.8 CNCc1ccccc1 34a_100015324214_200000210301 [1,0,0,0,0,0|1,0,0]=2 627 B9R1.8 CNCc1ccccc1 34a_100102657272_100015291786 [1,0,0,0,0,0|1,0,0]=2 628 B9R1.8 CNCc1ccccc1 7a_106832991635_100000211182 [1,0,0,0,0,0|1,0,0]=2 629 B9R1.8 CNCc1ccccn1 207a_100102657272_100000209966 [1,0,0,0,0,0|2,0,0]=3 630 B9R1.8 CNCc1ccccn1 2230a_106832991635_100000721315 [1,0,0,0,0,0|2,0,0]=3 631 B9R1.8 CNCc1ccccn1 270004a_106832991635_100000209966 [1,0,0,0,0,0|2,0,0]=3 632 B9R1.8 CNCc1ccccn1 34a_100102657272_100000721315 [1,0,0,0,0,0|2,0,0]=3 633 B9R1.8 CNCc1ccccn1 7a_106832991635_100000721315 [1,0,0,0,0,0|2,0,0]=3 634 B9R1.8 CNCc1cccnc1 207a_100102657272_100000209961 [1,0,0,0,0,0|2,0,0]=3 635 B9R1.8 CNCc1cccnc1 2230a_106832991635_100000741622 [1,0,0,0,0,0|2,0,0]=3 636 B9R1.8 CNCc1cccnc1 270004a_106832991635_100000209961 [1,0,0,0,0,0|2,0,0]=3 637 B9R1.8 CNCc1cccnc1 34a_100102657272_100000733263 [1,0,0,0,0,0|2,0,0]=3 638 B9R1.8 CNCc1cccnc1 7a_106832991635_100000741622 [1,0,0,0,0,0|2,0,0]=3 639 B9R1.8 CNCc1cccnn1 2230a_100159270163_200000210301 [1,0,0,0,0,0|3,0,0]=4 640 B9R1.8 CNCc1cccnn1 2230a_106832991635_100016990269 [1,0,0,0,0,0|3,0,0]=4 641 B9R1.8 CNCc1cccnn1 34a_100102657272_100016990269 [1,0,0,0,0,0|3,0,0]=4 642 B9R1.8 CNCc1cccnn1 7a_106832991635_100016990269 [1,0,0,0,0,0|3,0,0]=4 643 B9R1.8 CNCc1ccncc1 207a_100102657272_100000186114 [1,0,0,0,0,0|2,0,0]=3 644 B9R1.8 CNCc1ccncc1 2230a_106832991635_100015193705 [1,0,0,0,0,0|2,0,0]=3 645 B9R1.8 CNCc1ccncc1 7a_106832991635_100015193705 [1,0,0,0,0,0|2,0,0]=3 646 B9R1.8 CNCc1ccnnc1 270004a_106832991635_100011934578 [1,0,0,0,0,0|3,0,0]=4 647 B9R1.8 CNCc1cnccn1 2230a_106832991635_100016995436 [1,0,0,0,0,0|3,0,0]=4 648 B9R1.8 CNCc1cnccn1 270004a_106832991635_100000749867 [1,0,0,0,0,0|3,0,0]=4 649 B9R1.8 CNCc1cnccn1 34a_100102657272_100016995436 [1,0,0,0,0,0|3,0,0]=4 650 B9R1.8 CNCc1cnccn1 7a_106832991635_100016995436 [1,0,0,0,0,0|3,0,0]=4 651 B9R1.8 CNCc1cncnc1 2230a_100011243677_200000210301 [1,0,0,0,0,0|3,0,0]=4 652 B9R1.8 CNCc1cncnc1 2230a_106832991635_100015196519 [1,0,0,0,0,0|3,0,0]=4 653 B9R1.8 CNCc1cncnc1 270004a_106832991635_100000749868 [1,0,0,0,0,0|3,0,0]=4 654 B9R1.8 CNCc1cncnc1 34a_100102657272_100015196519 [1,0,0,0,0,0|3,0,0]=4 655 B9R1.8 CNCc1cncnc1 7a_106832991635_100015196519 [1,0,0,0,0,0|3,0,0]=4 656 B9R1.8 CNCc1ncccn1 2230a_106832991635_100000703007 [1,0,0,0,0,0|3,0,0]=4 657 B9R1.8 CNCc1ncccn1 270004a_106832991635_100011532527 [1,0,0,0,0,0|3,0,0]=4 658 B9R1.8 CNCc1ncccn1 34a_100102657272_100000703007 [1,0,0,0,0,0|3,0,0]=4 659 B9R1.8 CNCc1ncccn1 7a_106832991635_100000703007 [1,0,0,0,0,0|3,0,0]=4 660 B9R1.8 COCc1ccccc1 34a_100000210790_200000210301 [1,0,0,0,0,0|1,0,0]=2 661 B9R1.8 COCc1ccccc1 34a_100138415774_100015291786 [1,0,0,0,0,0|1,0,0]=2 662 B9R1.8 COCc1ccccc1 7a_100000210790_200000210301 [1,0,0,0,0,0|1,0,0]=2 663 B9R1.8 COCc1ccccn1 34a_100138415774_100000721315 [1,0,0,0,0,0|2,0,0]=3 664 B9R1.8 COCc1cccnc1 34a_100138415774_100000733263 [1,0,0,0,0,0|2,0,0]=3 665 B9R1.8 COCc1cccnn1 34a_100138415774_100016990269 [1,0,0,0,0,0|3,0,0]=4 666 B9R1.8 COCc1cnccn1 34a_100138415774_100016995436 [1,0,0,0,0,0|3,0,0]=4 667 B9R1.8 COCc1cncnc1 34a_100138415774_100015196519 [1,0,0,0,0,0|3,0,0]=4 668 B9R1.8 COCc1ncccn1 34a_100138415774_100000703007 [1,0,0,0,0,0|3,0,0]=4 669 B9R1.8 CSCc1ccccc1 62a_100000211182_200000210301 [1,0,0,0,0,0|1,0,0]=2 670 B9R1.8 CSCc1ccccc1 62a_200000210301_100015291786 [1,0,0,0,0,0|1,0,0]=2 671 B9R1.8 CSCc1ccccn1 62a_100000721315_200000210301 [1,0,0,0,0,0|2,0,0]=3 672 B9R1.8 CSCc1ccccn1 62a_200000210301_100000721315 [1,0,0,0,0,0|2,0,0]=3 673 B9R1.8 CSCc1cccnc1 62a_100000741622_200000210301 [1,0,0,0,0,0|2,0,0]=3 674 B9R1.8 CSCc1cccnc1 62a_200000210301_100000741622 [1,0,0,0,0,0|2,0,0]=3 675 B9R1.8 CSCc1cccnn1 62a_100016990269_200000210301 [1,0,0,0,0,0|3,0,0]=4 676 B9R1.8 CSCc1cccnn1 62a_200000210301_100016990269 [1,0,0,0,0,0|3,0,0]=4 677 B9R1.8 CSCc1ccncc1 62a_100015193705_200000210301 [1,0,0,0,0,0|2,0,0]=3 678 B9R1.8 CSCc1ccncc1 62a_200000210301_100015193705 [1,0,0,0,0,0|2,0,0]=3 679 B9R1.8 CSCc1cnccn1 62a_100016995436_200000210301 [1,0,0,0,0,0|3,0,0]=4 680 B9R1.8 CSCc1cnccn1 62a_200000210301_100016995436 [1,0,0,0,0,0|3,0,0]=4 681 B9R1.8 CSCc1cncnc1 62a_100015196519_200000210301 [1,0,0,0,0,0|3,0,0]=4 682 B9R1.8 CSCc1cncnc1 62a_200000210301_100015196519 [1,0,0,0,0,0|3,0,0]=4 683 B9R1.8 CSCc1ncccn1 62a_100000703007_200000210301 [1,0,0,0,0,0|3,0,0]=4 684 B9R1.8 CSCc1ncccn1 62a_200000210301_100000703007 [1,0,0,0,0,0|3,0,0]=4 685 B9R1.8 FCNc1ccccc1 34a_100000106764_100015361967 [1,0,0,0,0,0|2,0,0]=3 686 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [1,0,0,0,0,0|2,0,0]=3 687 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [1,0,0,0,0,0|2,0,0]=3 688 B9R1.8 FCOc1cccnc1 34a_100000210849_100015361967 [1,0,0,0,0,0|3,0,0]=4 689 B9R1.8 FCOc1cccnc1 7a_100000210849_100015361967 [1,0,0,0,0,0|3,0,0]=4 690 B9R1.8 FCOc1ccncc1 34a_100000212176_100015361967 [1,0,0,0,0,0|3,0,0]=4 691 B9R1.8 FCSc1ccccc1 62a_100000719477_100015361967 [1,0,0,0,0,0|2,0,0]=3 692 B9R1.8 FCSc1ccccc1 62a_100015361967_100000041952 [1,0,0,0,0,0|2,0,0]=3 693 B9R1.8 FCSc1ccccn1 62a_100011216584_100015361967 [1,0,0,0,0,0|3,0,0]=4 694 B9R1.8 FCSc1ccccn1 62a_100015361967_100011216584 [1,0,0,0,0,0|3,0,0]=4 695 B9R1.8 FCSc1cccnc1 62a_100000210063_100015361967 [1,0,0,0,0,0|3,0,0]=4 696 B9R1.8 FCSc1cccnc1 62a_100015361967_100000210063 [1,0,0,0,0,0|3,0,0]=4 697 B9R1.8 FCSc1ccncc1 62a_100000728582_100015361967 [1,0,0,0,0,0|3,0,0]=4 698 B9R1.8 FCSc1ccncc1 62a_100015361967_100000728582 [1,0,0,0,0,0|3,0,0]=4 699 B9R1.8 [13CH3]NCc1ccccc1 2230a_100015324214_200025704644 [1,0,0,0,0,0|1,0,0]=2 700 B9R1.8 [13CH3]NCc1ccccc1 34a_100015324214_200025704644 [1,0,0,0,0,0|1,0,0]=2 701 B9R1.8 [13CH3]NCc1cccnn1 2230a_100159270163_200025704644 [1,0,0,0,0,0|3,0,0]=4 702 B9R1.8 [13CH3]NCc1cncnc1 2230a_100011243677_200025704644 [1,0,0,0,0,0|3,0,0]=4 703 B9R1.8 [13CH3]OCc1ccccc1 34a_100000210790_200025704644 [1,0,0,0,0,0|1,0,0]=2 704 B9R1.8 [13CH3]OCc1ccccc1 7a_100000210790_200025704644 [1,0,0,0,0,0|1,0,0]=2 705 B9R1.8 [13CH3]SCc1ccccc1 62a_100000211182_200025704644 [1,0,0,0,0,0|1,0,0]=2 706 B9R1.8 [13CH3]SCc1ccccc1 62a_200025704644_100015291786 [1,0,0,0,0,0|1,0,0]=2 707 B9R1.8 [13CH3]SCc1ccccn1 62a_100000721315_200025704644 [1,0,0,0,0,0|2,0,0]=3 708 B9R1.8 [13CH3]SCc1ccccn1 62a_200025704644_100000721315 [1,0,0,0,0,0|2,0,0]=3 709 B9R1.8 [13CH3]SCc1cccnc1 62a_100000741622_200025704644 [1,0,0,0,0,0|2,0,0]=3 710 B9R1.8 [13CH3]SCc1cccnc1 62a_200025704644_100000741622 [1,0,0,0,0,0|2,0,0]=3 711 B9R1.8 [13CH3]SCc1cccnn1 62a_100016990269_200025704644 [1,0,0,0,0,0|3,0,0]=4 712 B9R1.8 [13CH3]SCc1cccnn1 62a_200025704644_100016990269 [1,0,0,0,0,0|3,0,0]=4 713 B9R1.8 [13CH3]SCc1ccncc1 62a_100015193705_200025704644 [1,0,0,0,0,0|2,0,0]=3 714 B9R1.8 [13CH3]SCc1ccncc1 62a_200025704644_100015193705 [1,0,0,0,0,0|2,0,0]=3 715 B9R1.8 [13CH3]SCc1cnccn1 62a_100016995436_200025704644 [1,0,0,0,0,0|3,0,0]=4 716 B9R1.8 [13CH3]SCc1cnccn1 62a_200025704644_100016995436 [1,0,0,0,0,0|3,0,0]=4 717 B9R1.8 [13CH3]SCc1cncnc1 62a_100015196519_200025704644 [1,0,0,0,0,0|3,0,0]=4 718 B9R1.8 [13CH3]SCc1cncnc1 62a_200025704644_100015196519 [1,0,0,0,0,0|3,0,0]=4 719 B9R1.8 [13CH3]SCc1ncccn1 62a_100000703007_200025704644 [1,0,0,0,0,0|3,0,0]=4 720 B9R1.8 [13CH3]SCc1ncccn1 62a_200025704644_100000703007 [1,0,0,0,0,0|3,0,0]=4 721 B9R1.15 C=Cc1ccccc1Br 271570a_100011290941_100000695589 [1,0,0,0,0,0|1,0,2]=4 722 B9R1.15 C=Cc1ccccc1C 271570a_100011290941_100000210755 [1,0,0,0,0,0|1,0,2]=4 723 B9R1.15 C=Cc1ccccc1Cl 271570a_100011290941_100000764095 [1,0,0,0,0,0|1,0,2]=4 724 B9R1.15 C=Cc1ccccc1F 271570a_100011290941_100011215700 [1,0,0,0,0,0|1,0,2]=4 725 B9R1.15 C=Cc1ccccc1N 271570a_100011290941_100000210017 [1,0,0,0,0,0|1,0,2]=4 726 B9R1.15 C=Cc1ccccc1O 271570a_100011290941_100000739446 [1,0,0,0,0,0|0,0,2]=3 727 B9R1.15 C=Cc1ccncc1O 271570a_100011290941_100009817591 [1,0,0,0,0,0|1,0,2]=4 728 B9R1.15 C=Cc1ncccc1O 271570a_100011290941_100000034122 [1,0,0,0,0,0|1,0,2]=4 729 B9R1.15 CCc1ccccc1O 271570a_203496583355_100011215823 [1,0,0,0,0,0|0,0,0]=1 730 B9R1.15 CCc1ccncc1O 271570a_203496583355_100009819861 [1,0,0,0,0,0|1,0,0]=2 731 B9R1.15 CCc1cnccc1O 271570a_203496583355_100025704421 [1,0,0,0,0,0|1,0,0]=2 732 B9R1.15 CCc1cncnc1O 271570a_203496583355_200000100055 [1,0,0,0,0,0|2,0,0]=3 733 B9R1.15 CCc1ncccc1O 271570a_203496583355_100009877225 [1,0,0,0,0,0|1,0,0]=2 734 B9R1.15 CCc1nccnc1O 271570a_203496583355_100011995844 [1,0,0,0,0,0|2,0,0]=3 735 B9R1.15 CCc1ncncc1O 271570a_203496583355_100009816992 [1,0,0,0,0,0|2,0,0]=3 736 B9R1.15 CNc1ccccc1Br 34a_100000210017_200000210301 [1,0,0,0,0,0|2,0,0]=3 737 B9R1.15 CNc1ccccc1C 34a_100015192222_200000210301 [1,0,0,0,0,0|2,0,0]=3 738 B9R1.15 CNc1ccccc1Cl 34a_100000185783_200000210301 [1,0,0,0,0,0|2,0,0]=3 739 B9R1.15 CNc1ccccc1F 34a_100000210422_200000210301 [1,0,0,0,0,0|2,0,0]=3 740 B9R1.15 CNc1ccccc1I 34a_100000210053_200000210301 [1,0,0,0,0,0|2,0,0]=3 741 B9R1.15 CNc1ccccc1O 271570a_203496583355_100020606079 [1,0,0,0,0,0|1,0,0]=2 742 B9R1.15 CNc1ccccc1O 34a_100000185747_200000210301 [1,0,0,0,0,0|1,0,0]=2 743 B9R1.15 CNc1cccnc1O 271570a_203496583355_200011806188 [1,0,0,0,0,0|2,0,0]=3 744 B9R1.15 CNc1ccncc1Br 27a_100102657272_100000726257 [1,0,0,0,0,0|3,0,0]=4 745 B9R1.15 CNc1ccncc1C 27a_100102657272_100000765111 [1,0,0,0,0,0|3,0,0]=4 746 B9R1.15 CNc1ccncc1F 27a_100102657272_100000035921 [1,0,0,0,0,0|3,0,0]=4 747 B9R1.15 CNc1ccncc1O 271570a_203496583355_100010069531 [1,0,0,0,0,0|2,0,0]=3 748 B9R1.15 CNc1ncccc1Br 27a_100102657272_100000696092 [1,0,0,0,0,0|3,0,0]=4 749 B9R1.15 CNc1ncccc1O 271570a_203496583355_100000700899 [1,0,0,0,0,0|2,0,0]=3 750 B9R1.15 CNc1nccnc1O 271570a_203496583355_100011529439 [1,0,0,0,0,0|3,0,0]=4 751 B9R1.15 CNc1ncncc1O 271570a_203496583355_200012180720 [1,0,0,0,0,0|3,0,0]=4 752 B9R1.15 COc1cccc[n+]1[O-] 7a_100000211761_200000210301 [1,0,0,0,0,0|2,0,1]=4 753 B9R1.15 COc1ccccc1Br 34a_100000181306_200000210301 [1,0,0,0,0,0|2,0,0]=3 754 B9R1.15 COc1ccccc1Br 7a_100000181306_200000210301 [1,0,0,0,0,0|2,0,0]=3 755 B9R1.15 COc1ccccc1C 34a_100000210338_200000210301 [1,0,0,0,0,0|2,0,0]=3 756 B9R1.15 COc1ccccc1C 7a_100000210338_200000210301 [1,0,0,0,0,0|2,0,0]=3 757 B9R1.15 COc1ccccc1Cl 34a_100000210172_200000210301 [1,0,0,0,0,0|2,0,0]=3 758 B9R1.15 COc1ccccc1Cl 7a_100000210172_200000210301 [1,0,0,0,0,0|2,0,0]=3 759 B9R1.15 COc1ccccc1F 34a_100000210171_200000210301 [1,0,0,0,0,0|2,0,0]=3 760 B9R1.15 COc1ccccc1F 7a_100000210171_200000210301 [1,0,0,0,0,0|2,0,0]=3 761 B9R1.15 COc1ccccc1I 34a_100000739446_200000210301 [1,0,0,0,0,0|2,0,0]=3 762 B9R1.15 COc1ccccc1I 7a_100000739446_200000210301 [1,0,0,0,0,0|2,0,0]=3 763 B9R1.15 COc1ccccc1N 34a_100000185747_200000210301 [1,0,0,0,0,0|2,0,0]=3 764 B9R1.15 COc1ccccc1N 7a_100000185747_200000210301 [1,0,0,0,0,0|2,0,0]=3 765 B9R1.15 COc1ccccc1O 271570a_203496583355_100000174000 [1,0,0,0,0,0|1,0,0]=2 766 B9R1.15 COc1cccnc1Br 34a_100000744436_200000210301 [1,0,0,0,0,0|3,0,0]=4 767 B9R1.15 COc1cccnc1Br 7a_100000744436_200000210301 [1,0,0,0,0,0|3,0,0]=4 768 B9R1.15 COc1cccnc1C 34a_100000745507_200000210301 [1,0,0,0,0,0|3,0,0]=4 769 B9R1.15 COc1cccnc1C 7a_100000745507_200000210301 [1,0,0,0,0,0|3,0,0]=4 770 B9R1.15 COc1cccnc1Cl 34a_100000757616_200000210301 [1,0,0,0,0,0|3,0,0]=4 771 B9R1.15 COc1cccnc1Cl 7a_100000757616_200000210301 [1,0,0,0,0,0|3,0,0]=4 772 B9R1.15 COc1cccnc1F 34a_100000061740_200000210301 [1,0,0,0,0,0|3,0,0]=4 773 B9R1.15 COc1cccnc1F 7a_100000061740_200000210301 [1,0,0,0,0,0|3,0,0]=4 774 B9R1.15 COc1cccnc1I 34a_100000034122_200000210301 [1,0,0,0,0,0|3,0,0]=4 775 B9R1.15 COc1cccnc1I 7a_100000034122_200000210301 [1,0,0,0,0,0|3,0,0]=4 776 B9R1.15 COc1cccnc1N 34a_100000211975_200000210301 [1,0,0,0,0,0|3,0,0]=4 777 B9R1.15 COc1cccnc1N 7a_100000211975_200000210301 [1,0,0,0,0,0|3,0,0]=4 778 B9R1.15 COc1cccnc1O 271570a_203496583355_100000690851 [1,0,0,0,0,0|2,0,0]=3 779 B9R1.15 COc1cccoc1=O 34a_100000077404_200000210301 [1,0,0,0,0,0|2,0,1]=4 780 B9R1.15 COc1cccoc1=O 7a_100000077404_200000210301 [1,0,0,0,0,0|2,0,1]=4 781 B9R1.15 COc1ccncc1Br 34a_100011996408_200000210301 [1,0,0,0,0,0|3,0,0]=4 782 B9R1.15 COc1ccncc1C 34a_100000694293_200000210301 [1,0,0,0,0,0|3,0,0]=4 783 B9R1.15 COc1ccncc1Cl 34a_100011997054_200000210301 [1,0,0,0,0,0|3,0,0]=4 784 B9R1.15 COc1ccncc1F 34a_200000081243_200000210301 [1,0,0,0,0,0|3,0,0]=4 785 B9R1.15 COc1ccncc1O 271570a_203496583355_100011997281 [1,0,0,0,0,0|2,0,0]=3 786 B9R1.15 COc1cnccc1C 34a_100011997053_200000210301 [1,0,0,0,0,0|3,0,0]=4 787 B9R1.15 COc1cnccc1C 7a_100011997053_200000210301 [1,0,0,0,0,0|3,0,0]=4 788 B9R1.15 COc1cnccc1Cl 34a_100011996695_200000210301 [1,0,0,0,0,0|3,0,0]=4 789 B9R1.15 COc1cnccc1I 34a_100000050107_200000210301 [1,0,0,0,0,0|3,0,0]=4 790 B9R1.15 COc1cnccc1N 34a_100000753702_200000210301 [1,0,0,0,0,0|3,0,0]=4 791 B9R1.15 COc1cnccc1O 271570a_203496583355_100016988167 [1,0,0,0,0,0|2,0,0]=3 792 B9R1.15 COc1cncnc1O 271570a_203496583355_100012001275 [1,0,0,0,0,0|3,0,0]=4 793 B9R1.15 COc1coccc1=O 34a_100000060831_200000210301 [1,0,0,0,0,0|2,0,1]=4 794 B9R1.15 COc1ncccc1Cl 34a_100011290957_200000210301 [1,0,0,0,0,0|3,0,0]=4 795 B9R1.15 COc1ncccc1F 34a_100011219419_200000210301 [1,0,0,0,0,0|3,0,0]=4 796 B9R1.15 COc1ncccc1N 34a_100000746358_200000210301 [1,0,0,0,0,0|3,0,0]=4 797 B9R1.15 COc1ncccc1O 271570a_203496583355_100000047025 [1,0,0,0,0,0|2,0,0]=3 798 B9R1.15 COc1nccnc1O 271570a_203496583355_100000749998 [1,0,0,0,0,0|3,0,0]=4 799 B9R1.15 COc1ncncc1O 271570a_203496583355_100000719902 [1,0,0,0,0,0|3,0,0]=4 800 B9R1.15 CSc1c[nH]ccc1=O 62a_100009998708_200000210301 [1,0,0,0,0,0|2,0,1]=4 801 B9R1.15 CSc1c[nH]ccc1=O 62a_200000210301_100009998708 [1,0,0,0,0,0|2,0,1]=4 802 B9R1.15 CSc1c[nH]ccc1=S 62a_200000210301_200012280681 [1,0,0,0,0,0|2,1,0]=4 803 B9R1.15 CSc1c[nH]ccc1=S 62a_200012280681_200000210301 [1,0,0,0,0,0|2,1,0]=4 804 B9R1.15 CSc1cccc[n+]1C 62a_200000210301_100000212160 [1,0,0,0,0,0|3,0,0]=4 805 B9R1.15 CSc1cccc[n+]1[O-] 62a_200000210301_200000042595 [1,0,0,0,0,0|2,0,1]=4 806 B9R1.15 CSc1ccccc1Br 62a_100000695589_200000210301 [1,0,0,0,0,0|2,0,0]=3 807 B9R1.15 CSc1ccccc1Br 62a_200000210301_100000695589 [1,0,0,0,0,0|2,0,0]=3 808 B9R1.15 CSc1ccccc1C 62a_100000210755_200000210301 [1,0,0,0,0,0|2,0,0]=3 809 B9R1.15 CSc1ccccc1C 62a_200000210301_100000210755 [1,0,0,0,0,0|2,0,0]=3 810 B9R1.15 CSc1ccccc1Cl 62a_100000764095_200000210301 [1,0,0,0,0,0|2,0,0]=3 811 B9R1.15 CSc1ccccc1Cl 62a_200000210301_100000764095 [1,0,0,0,0,0|2,0,0]=3 812 B9R1.15 CSc1ccccc1F 62a_100011215700_200000210301 [1,0,0,0,0,0|2,0,0]=3 813 B9R1.15 CSc1ccccc1F 62a_200000210301_100011215700 [1,0,0,0,0,0|2,0,0]=3 814 B9R1.15 CSc1ccccc1N 62a_100000210017_200000210301 [1,0,0,0,0,0|2,0,0]=3 815 B9R1.15 CSc1ccccc1N 62a_200000210301_100000210017 [1,0,0,0,0,0|2,0,0]=3 816 B9R1.15 CSc1ccccc1O 271570a_203496583355_100011217816 [1,0,0,0,0,0|1,0,0]=2 817 B9R1.15 CSc1ccccc1O 62a_100000739446_200000210301 [1,0,0,0,0,0|1,0,0]=2 818 B9R1.15 CSc1ccccc1O 62a_200000210301_100000739446 [1,0,0,0,0,0|1,0,0]=2 819 B9R1.15 CSc1cccnc1Br 62a_100010202626_200000210301 [1,0,0,0,0,0|3,0,0]=4 820 B9R1.15 CSc1cccnc1Br 62a_200000210301_100010202626 [1,0,0,0,0,0|3,0,0]=4 821 B9R1.15 CSc1cccnc1C 62a_100000751574_200000210301 [1,0,0,0,0,0|3,0,0]=4 822 B9R1.15 CSc1cccnc1C 62a_200000210301_100000751574 [1,0,0,0,0,0|3,0,0]=4 823 B9R1.15 CSc1cccnc1Cl 62a_100000036424_200000210301 [1,0,0,0,0,0|3,0,0]=4 824 B9R1.15 CSc1cccnc1Cl 62a_200000210301_100000036424 [1,0,0,0,0,0|3,0,0]=4 825 B9R1.15 CSc1cccnc1F 62a_100009816115_200000210301 [1,0,0,0,0,0|3,0,0]=4 826 B9R1.15 CSc1cccnc1F 62a_200000210301_100009816115 [1,0,0,0,0,0|3,0,0]=4 827 B9R1.15 CSc1cccnc1N 62a_100000045569_200000210301 [1,0,0,0,0,0|3,0,0]=4 828 B9R1.15 CSc1cccnc1N 62a_200000210301_100000045569 [1,0,0,0,0,0|3,0,0]=4 829 B9R1.15 CSc1cccnc1O 62a_100000760158_200000210301 [1,0,0,0,0,0|2,0,0]=3 830 B9R1.15 CSc1cccnc1O 62a_200000210301_100000760158 [1,0,0,0,0,0|2,0,0]=3 831 B9R1.15 CSc1ccncc1Br 62a_100000726257_200000210301 [1,0,0,0,0,0|3,0,0]=4 832 B9R1.15 CSc1ccncc1Br 62a_200000210301_100000726257 [1,0,0,0,0,0|3,0,0]=4 833 B9R1.15 CSc1ccncc1C 62a_100000765111_200000210301 [1,0,0,0,0,0|3,0,0]=4 834 B9R1.15 CSc1ccncc1C 62a_200000210301_100000765111 [1,0,0,0,0,0|3,0,0]=4 835 B9R1.15 CSc1ccncc1Cl 62a_100000708259_200000210301 [1,0,0,0,0,0|3,0,0]=4 836 B9R1.15 CSc1ccncc1Cl 62a_200000210301_100000708259 [1,0,0,0,0,0|3,0,0]=4 837 B9R1.15 CSc1ccncc1F 62a_100000047030_200000210301 [1,0,0,0,0,0|3,0,0]=4 838 B9R1.15 CSc1ccncc1F 62a_200000210301_100000047030 [1,0,0,0,0,0|3,0,0]=4 839 B9R1.15 CSc1ccncc1N 62a_100000756074_200000210301 [1,0,0,0,0,0|3,0,0]=4 840 B9R1.15 CSc1ccncc1N 62a_200000210301_100000756074 [1,0,0,0,0,0|3,0,0]=4 841 B9R1.15 CSc1ccncc1O 62a_100009817591_200000210301 [1,0,0,0,0,0|2,0,0]=3 842 B9R1.15 CSc1ccncc1O 62a_200000210301_100009817591 [1,0,0,0,0,0|2,0,0]=3 843 B9R1.15 CSc1cnccc1Br 62a_100010138639_200000210301 [1,0,0,0,0,0|3,0,0]=4 844 B9R1.15 CSc1cnccc1Br 62a_200000210301_100010138639 [1,0,0,0,0,0|3,0,0]=4 845 B9R1.15 CSc1cnccc1C 62a_100000761580_200000210301 [1,0,0,0,0,0|3,0,0]=4 846 B9R1.15 CSc1cnccc1C 62a_200000210301_100000761580 [1,0,0,0,0,0|3,0,0]=4 847 B9R1.15 CSc1cnccc1Cl 62a_100009995489_200000210301 [1,0,0,0,0,0|3,0,0]=4 848 B9R1.15 CSc1cnccc1Cl 62a_200000210301_100009995489 [1,0,0,0,0,0|3,0,0]=4 849 B9R1.15 CSc1cnccc1F 62a_100009820683_200000210301 [1,0,0,0,0,0|3,0,0]=4 850 B9R1.15 CSc1cnccc1F 62a_200000210301_100009820683 [1,0,0,0,0,0|3,0,0]=4 851 B9R1.15 CSc1cnccc1N 62a_100000047001_200000210301 [1,0,0,0,0,0|3,0,0]=4 852 B9R1.15 CSc1cnccc1N 62a_200000210301_100000047001 [1,0,0,0,0,0|3,0,0]=4 853 B9R1.15 CSc1cncnc1O 62a_100000751107_200000210301 [1,0,0,0,0,0|3,0,0]=4 854 B9R1.15 CSc1cncnc1O 62a_200000210301_100000751107 [1,0,0,0,0,0|3,0,0]=4 855 B9R1.15 CSc1ncccc1Br 62a_100000696092_200000210301 [1,0,0,0,0,0|3,0,0]=4 856 B9R1.15 CSc1ncccc1Br 62a_200000210301_100000696092 [1,0,0,0,0,0|3,0,0]=4 857 B9R1.15 CSc1ncccc1C 62a_100000751373_200000210301 [1,0,0,0,0,0|3,0,0]=4 858 B9R1.15 CSc1ncccc1C 62a_200000210301_100000751373 [1,0,0,0,0,0|3,0,0]=4 859 B9R1.15 CSc1ncccc1Cl 62a_100011356963_200000210301 [1,0,0,0,0,0|3,0,0]=4 860 B9R1.15 CSc1ncccc1Cl 62a_200000210301_100011356963 [1,0,0,0,0,0|3,0,0]=4 861 B9R1.15 CSc1ncccc1F 62a_100000685392_200000210301 [1,0,0,0,0,0|3,0,0]=4 862 B9R1.15 CSc1ncccc1F 62a_200000210301_100000685392 [1,0,0,0,0,0|3,0,0]=4 863 B9R1.15 CSc1ncccc1N 62a_100000688686_200000210301 [1,0,0,0,0,0|3,0,0]=4 864 B9R1.15 CSc1ncccc1N 62a_200000210301_100000688686 [1,0,0,0,0,0|3,0,0]=4 865 B9R1.15 CSc1ncccc1O 271570a_203496583355_100011465278 [1,0,0,0,0,0|2,0,0]=3 866 B9R1.15 CSc1ncccc1O 62a_100000034122_200000210301 [1,0,0,0,0,0|2,0,0]=3 867 B9R1.15 CSc1ncccc1O 62a_200000210301_100000034122 [1,0,0,0,0,0|2,0,0]=3 868 B9R1.15 C[n+]1ccccc1S[13CH3] 62a_200025704644_100000212160 [1,0,0,0,0,0|3,0,0]=4 869 B9R1.15 Cc1ccccc1N[13CH3] 34a_100015192222_200025704644 [1,0,0,0,0,0|2,0,0]=3 870 B9R1.15 Cc1ccccc1O[13CH3] 34a_100000210338_200025704644 [1,0,0,0,0,0|2,0,0]=3 871 B9R1.15 Cc1ccccc1O[13CH3] 7a_100000210338_200025704644 [1,0,0,0,0,0|2,0,0]=3 872 B9R1.15 Cc1ccccc1S[13CH3] 62a_100000210755_200025704644 [1,0,0,0,0,0|2,0,0]=3 873 B9R1.15 Cc1ccccc1S[13CH3] 62a_200025704644_100000210755 [1,0,0,0,0,0|2,0,0]=3 874 B9R1.15 Cc1cccnc1S[13CH3] 62a_100000751373_200025704644 [1,0,0,0,0,0|3,0,0]=4 875 B9R1.15 Cc1cccnc1S[13CH3] 62a_200025704644_100000751373 [1,0,0,0,0,0|3,0,0]=4 876 B9R1.15 Cc1ccncc1O[13CH3] 34a_100011997053_200025704644 [1,0,0,0,0,0|3,0,0]=4 877 B9R1.15 Cc1ccncc1O[13CH3] 7a_100011997053_200025704644 [1,0,0,0,0,0|3,0,0]=4 878 B9R1.15 Cc1ccncc1S[13CH3] 62a_100000761580_200025704644 [1,0,0,0,0,0|3,0,0]=4 879 B9R1.15 Cc1ccncc1S[13CH3] 62a_200025704644_100000761580 [1,0,0,0,0,0|3,0,0]=4 880 B9R1.15 Cc1cnccc1O[13CH3] 34a_100000694293_200025704644 [1,0,0,0,0,0|3,0,0]=4 881 B9R1.15 Cc1cnccc1S[13CH3] 62a_100000765111_200025704644 [1,0,0,0,0,0|3,0,0]=4 882 B9R1.15 Cc1cnccc1S[13CH3] 62a_200025704644_100000765111 [1,0,0,0,0,0|3,0,0]=4 883 B9R1.15 Cc1ncccc1O[13CH3] 34a_100000745507_200025704644 [1,0,0,0,0,0|3,0,0]=4 884 B9R1.15 Cc1ncccc1O[13CH3] 7a_100000745507_200025704644 [1,0,0,0,0,0|3,0,0]=4 885 B9R1.15 Cc1ncccc1S[13CH3] 62a_100000751574_200025704644 [1,0,0,0,0,0|3,0,0]=4 886 B9R1.15 Cc1ncccc1S[13CH3] 62a_200025704644_100000751574 [1,0,0,0,0,0|3,0,0]=4 887 B9R1.15 N#Cc1ccccc1O 271570a_203496583355_100000188569 [1,0,0,0,0,0|1,0,1]=3 888 B9R1.15 N#Cc1cccnc1O 271570a_203496583355_100000211984 [1,0,0,0,0,0|2,0,1]=4 889 B9R1.15 N#Cc1ccncc1O 271570a_203496583355_100000684818 [1,0,0,0,0,0|2,0,1]=4 890 B9R1.15 N#Cc1cnccc1O 271570a_203496583355_100000687039 [1,0,0,0,0,0|2,0,1]=4 891 B9R1.15 N#Cc1ncccc1O 271570a_203496583355_100000685805 [1,0,0,0,0,0|2,0,1]=4 892 B9R1.15 NCc1ccccc1O 271570a_203496583355_100000689332 [1,0,0,0,0,0|1,0,0]=2 893 B9R1.15 NCc1cccnc1O 271570a_203496583355_100015189234 [1,0,0,0,0,0|2,0,0]=3 894 B9R1.15 NCc1ccncc1O 271570a_203496583355_100020640021 [1,0,0,0,0,0|2,0,0]=3 895 B9R1.15 NCc1ncccc1O 271570a_203496583355_100020591323 [1,0,0,0,0,0|2,0,0]=3 896 B9R1.15 NCc1nccnc1O 271570a_203496583355_100000729963 [1,0,0,0,0,0|3,0,0]=4 897 B9R1.15 NNc1ccccc1O 271570a_203496583355_100000241748 [1,0,0,0,0,0|2,0,0]=3 898 B9R1.15 NNc1ccncc1O 271570a_203496583355_100013404636 [1,0,0,0,0,0|3,0,0]=4 899 B9R1.15 NNc1ncccc1O 271570a_203496583355_100011464834 [1,0,0,0,0,0|3,0,0]=4 900 B9R1.15 O=Cc1ccccc1O 271570a_203496583355_100000211189 [1,0,0,0,0,0|1,0,1]=3 901 B9R1.15 O=Cc1cccnc1O 271570a_203496583355_100009816751 [1,0,0,0,0,0|2,0,1]=4 902 B9R1.15 O=Cc1ccncc1O 271570a_203496583355_100011934409 [1,0,0,0,0,0|2,0,1]=4 903 B9R1.15 O=Cc1cnccc1O 271570a_203496583355_100000050567 [1,0,0,0,0,0|2,0,1]=4 904 B9R1.15 O=Cc1ncccc1O 271570a_203496583355_100011934733 [1,0,0,0,0,0|2,0,1]=4 905 B9R1.15 OCc1ccccc1O 271570a_203496583355_100000187465 [1,0,0,0,0,0|1,0,0]=2 906 B9R1.15 OCc1cccnc1O 271570a_203496583355_100000748726 [1,0,0,0,0,0|2,0,0]=3 907 B9R1.15 OCc1ccncc1O 271570a_203496583355_100009873359 [1,0,0,0,0,0|2,0,0]=3 908 B9R1.15 OCc1cnccc1O 271570a_203496583355_100000117392 [1,0,0,0,0,0|2,0,0]=3 909 B9R1.15 OCc1ncccc1O 271570a_203496583355_100011996772 [1,0,0,0,0,0|2,0,0]=3 910 B9R1.15 OCc1nccnc1O 271570a_203496583355_100000057004 [1,0,0,0,0,0|3,0,0]=4 911 B9R1.15 [13CH3]Nc1ccccc1Br 34a_100000210017_200025704644 [1,0,0,0,0,0|2,0,0]=3 912 B9R1.15 [13CH3]Nc1ccccc1Cl 34a_100000185783_200025704644 [1,0,0,0,0,0|2,0,0]=3 913 B9R1.15 [13CH3]Nc1ccccc1F 34a_100000210422_200025704644 [1,0,0,0,0,0|2,0,0]=3 914 B9R1.15 [13CH3]Nc1ccccc1I 34a_100000210053_200025704644 [1,0,0,0,0,0|2,0,0]=3 915 B9R1.15 [13CH3]Nc1ccccc1O 34a_100000185747_200025704644 [1,0,0,0,0,0|1,0,0]=2 916 B9R1.15 [13CH3]Oc1cccc[n+]1[O-] 7a_100000211761_200025704644 [1,0,0,0,0,0|2,0,1]=4 917 B9R1.15 [13CH3]Oc1ccccc1Br 34a_100000181306_200025704644 [1,0,0,0,0,0|2,0,0]=3 918 B9R1.15 [13CH3]Oc1ccccc1Br 7a_100000181306_200025704644 [1,0,0,0,0,0|2,0,0]=3 919 B9R1.15 [13CH3]Oc1ccccc1Cl 34a_100000210172_200025704644 [1,0,0,0,0,0|2,0,0]=3 920 B9R1.15 [13CH3]Oc1ccccc1Cl 7a_100000210172_200025704644 [1,0,0,0,0,0|2,0,0]=3 921 B9R1.15 [13CH3]Oc1ccccc1F 34a_100000210171_200025704644 [1,0,0,0,0,0|2,0,0]=3 922 B9R1.15 [13CH3]Oc1ccccc1F 7a_100000210171_200025704644 [1,0,0,0,0,0|2,0,0]=3 923 B9R1.15 [13CH3]Oc1ccccc1I 34a_100000739446_200025704644 [1,0,0,0,0,0|2,0,0]=3 924 B9R1.15 [13CH3]Oc1ccccc1I 7a_100000739446_200025704644 [1,0,0,0,0,0|2,0,0]=3 925 B9R1.15 [13CH3]Oc1ccccc1N 34a_100000185747_200025704644 [1,0,0,0,0,0|2,0,0]=3 926 B9R1.15 [13CH3]Oc1ccccc1N 7a_100000185747_200025704644 [1,0,0,0,0,0|2,0,0]=3 927 B9R1.15 [13CH3]Oc1cccnc1Br 34a_100000744436_200025704644 [1,0,0,0,0,0|3,0,0]=4 928 B9R1.15 [13CH3]Oc1cccnc1Br 7a_100000744436_200025704644 [1,0,0,0,0,0|3,0,0]=4 929 B9R1.15 [13CH3]Oc1cccnc1Cl 34a_100000757616_200025704644 [1,0,0,0,0,0|3,0,0]=4 930 B9R1.15 [13CH3]Oc1cccnc1Cl 7a_100000757616_200025704644 [1,0,0,0,0,0|3,0,0]=4 931 B9R1.15 [13CH3]Oc1cccnc1F 34a_100000061740_200025704644 [1,0,0,0,0,0|3,0,0]=4 932 B9R1.15 [13CH3]Oc1cccnc1F 7a_100000061740_200025704644 [1,0,0,0,0,0|3,0,0]=4 933 B9R1.15 [13CH3]Oc1cccnc1I 34a_100000034122_200025704644 [1,0,0,0,0,0|3,0,0]=4 934 B9R1.15 [13CH3]Oc1cccnc1I 7a_100000034122_200025704644 [1,0,0,0,0,0|3,0,0]=4 935 B9R1.15 [13CH3]Oc1cccnc1N 34a_100000211975_200025704644 [1,0,0,0,0,0|3,0,0]=4 936 B9R1.15 [13CH3]Oc1cccnc1N 7a_100000211975_200025704644 [1,0,0,0,0,0|3,0,0]=4 937 B9R1.15 [13CH3]Oc1cccoc1=O 34a_100000077404_200025704644 [1,0,0,0,0,0|2,0,1]=4 938 B9R1.15 [13CH3]Oc1cccoc1=O 7a_100000077404_200025704644 [1,0,0,0,0,0|2,0,1]=4 939 B9R1.15 [13CH3]Oc1ccncc1Br 34a_100011996408_200025704644 [1,0,0,0,0,0|3,0,0]=4 940 B9R1.15 [13CH3]Oc1ccncc1Cl 34a_100011997054_200025704644 [1,0,0,0,0,0|3,0,0]=4 941 B9R1.15 [13CH3]Oc1ccncc1F 34a_200000081243_200025704644 [1,0,0,0,0,0|3,0,0]=4 942 B9R1.15 [13CH3]Oc1cnccc1Cl 34a_100011996695_200025704644 [1,0,0,0,0,0|3,0,0]=4 943 B9R1.15 [13CH3]Oc1cnccc1I 34a_100000050107_200025704644 [1,0,0,0,0,0|3,0,0]=4 944 B9R1.15 [13CH3]Oc1cnccc1N 34a_100000753702_200025704644 [1,0,0,0,0,0|3,0,0]=4 945 B9R1.15 [13CH3]Oc1coccc1=O 34a_100000060831_200025704644 [1,0,0,0,0,0|2,0,1]=4 946 B9R1.15 [13CH3]Oc1ncccc1Cl 34a_100011290957_200025704644 [1,0,0,0,0,0|3,0,0]=4 947 B9R1.15 [13CH3]Oc1ncccc1F 34a_100011219419_200025704644 [1,0,0,0,0,0|3,0,0]=4 948 B9R1.15 [13CH3]Oc1ncccc1N 34a_100000746358_200025704644 [1,0,0,0,0,0|3,0,0]=4 949 B9R1.15 [13CH3]Sc1c[nH]ccc1=O 62a_100009998708_200025704644 [1,0,0,0,0,0|2,0,1]=4 950 B9R1.15 [13CH3]Sc1c[nH]ccc1=O 62a_200025704644_100009998708 [1,0,0,0,0,0|2,0,1]=4 951 B9R1.15 [13CH3]Sc1c[nH]ccc1=S 62a_200012280681_200025704644 [1,0,0,0,0,0|2,1,0]=4 952 B9R1.15 [13CH3]Sc1c[nH]ccc1=S 62a_200025704644_200012280681 [1,0,0,0,0,0|2,1,0]=4 953 B9R1.15 [13CH3]Sc1cccc[n+]1[O-] 62a_200025704644_200000042595 [1,0,0,0,0,0|2,0,1]=4 954 B9R1.15 [13CH3]Sc1ccccc1Br 62a_100000695589_200025704644 [1,0,0,0,0,0|2,0,0]=3 955 B9R1.15 [13CH3]Sc1ccccc1Br 62a_200025704644_100000695589 [1,0,0,0,0,0|2,0,0]=3 956 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_100000764095_200025704644 [1,0,0,0,0,0|2,0,0]=3 957 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_200025704644_100000764095 [1,0,0,0,0,0|2,0,0]=3 958 B9R1.15 [13CH3]Sc1ccccc1F 62a_100011215700_200025704644 [1,0,0,0,0,0|2,0,0]=3 959 B9R1.15 [13CH3]Sc1ccccc1F 62a_200025704644_100011215700 [1,0,0,0,0,0|2,0,0]=3 960 B9R1.15 [13CH3]Sc1ccccc1N 62a_100000210017_200025704644 [1,0,0,0,0,0|2,0,0]=3 961 B9R1.15 [13CH3]Sc1ccccc1N 62a_200025704644_100000210017 [1,0,0,0,0,0|2,0,0]=3 962 B9R1.15 [13CH3]Sc1ccccc1O 62a_100000739446_200025704644 [1,0,0,0,0,0|1,0,0]=2 963 B9R1.15 [13CH3]Sc1ccccc1O 62a_200025704644_100000739446 [1,0,0,0,0,0|1,0,0]=2 964 B9R1.15 [13CH3]Sc1cccnc1Br 62a_100010202626_200025704644 [1,0,0,0,0,0|3,0,0]=4 965 B9R1.15 [13CH3]Sc1cccnc1Br 62a_200025704644_100010202626 [1,0,0,0,0,0|3,0,0]=4 966 B9R1.15 [13CH3]Sc1cccnc1Cl 62a_100000036424_200025704644 [1,0,0,0,0,0|3,0,0]=4 967 B9R1.15 [13CH3]Sc1cccnc1Cl 62a_200025704644_100000036424 [1,0,0,0,0,0|3,0,0]=4 968 B9R1.15 [13CH3]Sc1cccnc1F 62a_100009816115_200025704644 [1,0,0,0,0,0|3,0,0]=4 969 B9R1.15 [13CH3]Sc1cccnc1F 62a_200025704644_100009816115 [1,0,0,0,0,0|3,0,0]=4 970 B9R1.15 [13CH3]Sc1cccnc1N 62a_100000045569_200025704644 [1,0,0,0,0,0|3,0,0]=4 971 B9R1.15 [13CH3]Sc1cccnc1N 62a_200025704644_100000045569 [1,0,0,0,0,0|3,0,0]=4 972 B9R1.15 [13CH3]Sc1cccnc1O 62a_100000760158_200025704644 [1,0,0,0,0,0|2,0,0]=3 973 B9R1.15 [13CH3]Sc1cccnc1O 62a_200025704644_100000760158 [1,0,0,0,0,0|2,0,0]=3 974 B9R1.15 [13CH3]Sc1ccncc1Br 62a_100000726257_200025704644 [1,0,0,0,0,0|3,0,0]=4 975 B9R1.15 [13CH3]Sc1ccncc1Br 62a_200025704644_100000726257 [1,0,0,0,0,0|3,0,0]=4 976 B9R1.15 [13CH3]Sc1ccncc1Cl 62a_100000708259_200025704644 [1,0,0,0,0,0|3,0,0]=4 977 B9R1.15 [13CH3]Sc1ccncc1Cl 62a_200025704644_100000708259 [1,0,0,0,0,0|3,0,0]=4 978 B9R1.15 [13CH3]Sc1ccncc1F 62a_100000047030_200025704644 [1,0,0,0,0,0|3,0,0]=4 979 B9R1.15 [13CH3]Sc1ccncc1F 62a_200025704644_100000047030 [1,0,0,0,0,0|3,0,0]=4 980 B9R1.15 [13CH3]Sc1ccncc1N 62a_100000756074_200025704644 [1,0,0,0,0,0|3,0,0]=4 981 B9R1.15 [13CH3]Sc1ccncc1N 62a_200025704644_100000756074 [1,0,0,0,0,0|3,0,0]=4 982 B9R1.15 [13CH3]Sc1ccncc1O 62a_100009817591_200025704644 [1,0,0,0,0,0|2,0,0]=3 983 B9R1.15 [13CH3]Sc1ccncc1O 62a_200025704644_100009817591 [1,0,0,0,0,0|2,0,0]=3 984 B9R1.15 [13CH3]Sc1cnccc1Br 62a_100010138639_200025704644 [1,0,0,0,0,0|3,0,0]=4 985 B9R1.15 [13CH3]Sc1cnccc1Br 62a_200025704644_100010138639 [1,0,0,0,0,0|3,0,0]=4 986 B9R1.15 [13CH3]Sc1cnccc1Cl 62a_100009995489_200025704644 [1,0,0,0,0,0|3,0,0]=4 987 B9R1.15 [13CH3]Sc1cnccc1Cl 62a_200025704644_100009995489 [1,0,0,0,0,0|3,0,0]=4 988 B9R1.15 [13CH3]Sc1cnccc1F 62a_100009820683_200025704644 [1,0,0,0,0,0|3,0,0]=4 989 B9R1.15 [13CH3]Sc1cnccc1F 62a_200025704644_100009820683 [1,0,0,0,0,0|3,0,0]=4 990 B9R1.15 [13CH3]Sc1cnccc1N 62a_100000047001_200025704644 [1,0,0,0,0,0|3,0,0]=4 991 B9R1.15 [13CH3]Sc1cnccc1N 62a_200025704644_100000047001 [1,0,0,0,0,0|3,0,0]=4 992 B9R1.15 [13CH3]Sc1cncnc1O 62a_100000751107_200025704644 [1,0,0,0,0,0|3,0,0]=4 993 B9R1.15 [13CH3]Sc1cncnc1O 62a_200025704644_100000751107 [1,0,0,0,0,0|3,0,0]=4 994 B9R1.15 [13CH3]Sc1ncccc1Br 62a_100000696092_200025704644 [1,0,0,0,0,0|3,0,0]=4 995 B9R1.15 [13CH3]Sc1ncccc1Br 62a_200025704644_100000696092 [1,0,0,0,0,0|3,0,0]=4 996 B9R1.15 [13CH3]Sc1ncccc1Cl 62a_100011356963_200025704644 [1,0,0,0,0,0|3,0,0]=4 997 B9R1.15 [13CH3]Sc1ncccc1Cl 62a_200025704644_100011356963 [1,0,0,0,0,0|3,0,0]=4 998 B9R1.15 [13CH3]Sc1ncccc1F 62a_100000685392_200025704644 [1,0,0,0,0,0|3,0,0]=4 999 B9R1.15 [13CH3]Sc1ncccc1F 62a_200025704644_100000685392 [1,0,0,0,0,0|3,0,0]=4 1000 B9R1.15 [13CH3]Sc1ncccc1N 62a_100000688686_200025704644 [1,0,0,0,0,0|3,0,0]=4 1001 B9R1.15 [13CH3]Sc1ncccc1N 62a_200025704644_100000688686 [1,0,0,0,0,0|3,0,0]=4 1002 B9R1.15 [13CH3]Sc1ncccc1O 62a_100000034122_200025704644 [1,0,0,0,0,0|2,0,0]=3 1003 B9R1.15 [13CH3]Sc1ncccc1O 62a_200025704644_100000034122 [1,0,0,0,0,0|2,0,0]=3 1004 B11R1.13 C=C=Cc1cccc(c1O)Br 271570a_100015277604_100010084509 [0,1,0,0,0,0|0,0,3]=4 1005 B11R1.13 C=C=Cc1cccc(c1O)C 271570a_100015277604_100009817157 [0,1,0,0,0,0|0,0,3]=4 1006 B11R1.13 C=C=Cc1cccc(c1O)Cl 271570a_100015277604_100010202889 [0,1,0,0,0,0|0,0,3]=4 1007 B11R1.13 C=C=Cc1cccc(c1O)F 271570a_100015277604_100009813666 [0,1,0,0,0,0|0,0,3]=4 1008 B11R1.13 C=C=Cc1cccc(c1O)N 271570a_100015277604_100011934915 [0,1,0,0,0,0|0,0,3]=4 1009 B11R1.13 C=C=Cc1cccc(c1O)O 271570a_100015277604_100009815950 [0,1,0,0,0,0|0,0,3]=4 1010 B11R1.13 CC=Cc1cccc(c1Br)O 271570a_100016259895_100010187914 [0,1,0,0,0,0|1,0,2]=4 1011 B11R1.13 CC=Cc1cccc(c1C)Br 271570a_100016259895_100012353703 [0,1,0,0,0,0|1,0,2]=4 1012 B11R1.13 CC=Cc1cccc(c1C)C 271570a_100016259895_100011214922 [0,1,0,0,0,0|1,0,2]=4 1013 B11R1.13 CC=Cc1cccc(c1C)Cl 271570a_100016259895_100000726075 [0,1,0,0,0,0|1,0,2]=4 1014 B11R1.13 CC=Cc1cccc(c1C)F 271570a_100016259895_100011216893 [0,1,0,0,0,0|1,0,2]=4 1015 B11R1.13 CC=Cc1cccc(c1C)N 271570a_100016259895_100000761887 [0,1,0,0,0,0|1,0,2]=4 1016 B11R1.13 CC=Cc1cccc(c1C)O 271570a_100016259895_100012002258 [0,1,0,0,0,0|1,0,2]=4 1017 B11R1.13 CC=Cc1cccc(c1Cl)Br 271570a_100016259895_100010142854 [0,1,0,0,0,0|1,0,2]=4 1018 B11R1.13 CC=Cc1cccc(c1Cl)C 271570a_100016259895_200012352035 [0,1,0,0,0,0|1,0,2]=4 1019 B11R1.13 CC=Cc1cccc(c1Cl)Cl 271570a_100016259895_100011215384 [0,1,0,0,0,0|1,0,2]=4 1020 B11R1.13 CC=Cc1cccc(c1Cl)F 271570a_100016259895_200010234923 [0,1,0,0,0,0|1,0,2]=4 1021 B11R1.13 CC=Cc1cccc(c1Cl)O 271570a_100016259895_100000049636 [0,1,0,0,0,0|1,0,2]=4 1022 B11R1.13 CC=Cc1cccc(c1F)Br 271570a_100016259895_100000702267 [0,1,0,0,0,0|1,0,2]=4 1023 B11R1.13 CC=Cc1cccc(c1F)C 271570a_100016259895_100000717567 [0,1,0,0,0,0|1,0,2]=4 1024 B11R1.13 CC=Cc1cccc(c1F)Cl 271570a_100016259895_100011217346 [0,1,0,0,0,0|1,0,2]=4 1025 B11R1.13 CC=Cc1cccc(c1F)F 271570a_100016259895_100000694657 [0,1,0,0,0,0|1,0,2]=4 1026 B11R1.13 CC=Cc1cccc(c1F)N 271570a_100016259895_100011935091 [0,1,0,0,0,0|1,0,2]=4 1027 B11R1.13 CC=Cc1cccc(c1F)O 271570a_100016259895_100009817021 [0,1,0,0,0,0|1,0,2]=4 1028 B11R1.13 CC=Cc1cccc(c1N)Br 271570a_100016259895_100010146558 [0,1,0,0,0,0|1,0,2]=4 1029 B11R1.13 CC=Cc1cccc(c1N)C 271570a_100016259895_100011834072 [0,1,0,0,0,0|1,0,2]=4 1030 B11R1.13 CC=Cc1cccc(c1N)Cl 271570a_100016259895_100010190421 [0,1,0,0,0,0|1,0,2]=4 1031 B11R1.13 CC=Cc1cccc(c1N)F 271570a_100016259895_100000042321 [0,1,0,0,0,0|1,0,2]=4 1032 B11R1.13 CC=Cc1cccc(c1N)N 271570a_100016259895_100015191791 [0,1,0,0,0,0|1,0,2]=4 1033 B11R1.13 CC=Cc1cccc(c1N)O 271570a_100016259895_100011934926 [0,1,0,0,0,0|1,0,2]=4 1034 B11R1.13 CC=Cc1cccc(c1O)Br 271570a_100016259895_100010084509 [0,1,0,0,0,0|0,0,2]=3 1035 B11R1.13 CC=Cc1cccc(c1O)C 271570a_100016259895_100009817157 [0,1,0,0,0,0|0,0,2]=3 1036 B11R1.13 CC=Cc1cccc(c1O)Cl 271570a_100016259895_100010202889 [0,1,0,0,0,0|0,0,2]=3 1037 B11R1.13 CC=Cc1cccc(c1O)F 271570a_100016259895_100009813666 [0,1,0,0,0,0|0,0,2]=3 1038 B11R1.13 CC=Cc1cccc(c1O)N 271570a_100016259895_100011934915 [0,1,0,0,0,0|0,0,2]=3 1039 B11R1.13 CC=Cc1cccc(c1O)O 271570a_100016259895_100009815950 [0,1,0,0,0,0|0,0,2]=3 1040 B11R1.13 CC=Cc1nccc(c1O)C 271570a_100016259895_100000696282 [0,1,0,0,0,0|1,0,2]=4 1041 B11R1.13 CC=Cc1nccc(c1O)F 271570a_100016259895_100009867227 [0,1,0,0,0,0|1,0,2]=4 1042 B11R1.13 CCNc1cccc(c1Br)C 34a_100000684715_100000210202 [0,1,0,0,0,0|2,0,0]=3 1043 B11R1.13 CCNc1cccc(c1Br)Cl 34a_100000687072_100000210202 [0,1,0,0,0,0|2,0,0]=3 1044 B11R1.13 CCNc1cccc(c1Br)F 34a_100011934729_100000210202 [0,1,0,0,0,0|2,0,0]=3 1045 B11R1.13 CCNc1cccc(c1Br)O 34a_100012183704_100000210202 [0,1,0,0,0,0|2,0,0]=3 1046 B11R1.13 CCNc1cccc(c1Br)O 7a_100012183704_100000210202 [0,1,0,0,0,0|2,0,0]=3 1047 B11R1.13 CCNc1cccc(c1C)Br 34a_100000750434_100000210202 [0,1,0,0,0,0|2,0,0]=3 1048 B11R1.13 CCNc1cccc(c1C)C 2230a_100000210026_100000210202 [0,1,0,0,0,0|2,0,0]=3 1049 B11R1.13 CCNc1cccc(c1C)C 34a_100000210026_100000210202 [0,1,0,0,0,0|2,0,0]=3 1050 B11R1.13 CCNc1cccc(c1C)C 7a_100000210026_100000210202 [0,1,0,0,0,0|2,0,0]=3 1051 B11R1.13 CCNc1cccc(c1C)Cl 2230a_100000210441_100000210202 [0,1,0,0,0,0|2,0,0]=3 1052 B11R1.13 CCNc1cccc(c1C)Cl 34a_100000210441_100000210202 [0,1,0,0,0,0|2,0,0]=3 1053 B11R1.13 CCNc1cccc(c1C)Cl 7a_100000210441_100000210202 [0,1,0,0,0,0|2,0,0]=3 1054 B11R1.13 CCNc1cccc(c1C)F 34a_100000745574_100000210202 [0,1,0,0,0,0|2,0,0]=3 1055 B11R1.13 CCNc1cccc(c1C)F 7a_100000745574_100000210202 [0,1,0,0,0,0|2,0,0]=3 1056 B11R1.13 CCNc1cccc(c1C)I 34a_100000761887_100000210202 [0,1,0,0,0,0|2,0,0]=3 1057 B11R1.13 CCNc1cccc(c1C)O 34a_100011216573_100000210202 [0,1,0,0,0,0|2,0,0]=3 1058 B11R1.13 CCNc1cccc(c1C)O 7a_100011216573_100000210202 [0,1,0,0,0,0|2,0,0]=3 1059 B11R1.13 CCNc1cccc(c1Cl)Br 34a_100000687075_100000210202 [0,1,0,0,0,0|2,0,0]=3 1060 B11R1.13 CCNc1cccc(c1Cl)C 34a_100000765562_100000210202 [0,1,0,0,0,0|2,0,0]=3 1061 B11R1.13 CCNc1cccc(c1Cl)C 7a_100000765562_100000210202 [0,1,0,0,0,0|2,0,0]=3 1062 B11R1.13 CCNc1cccc(c1Cl)Cl 34a_100000185733_100000210202 [0,1,0,0,0,0|2,0,0]=3 1063 B11R1.13 CCNc1cccc(c1Cl)F 34a_100000692321_100000210202 [0,1,0,0,0,0|2,0,0]=3 1064 B11R1.13 CCNc1cccc(c1Cl)O 34a_100012002038_100000210202 [0,1,0,0,0,0|2,0,0]=3 1065 B11R1.13 CCNc1cccc(c1Cl)O 7a_100012002038_100000210202 [0,1,0,0,0,0|2,0,0]=3 1066 B11R1.13 CCNc1cccc(c1F)Br 2230a_100011935091_100000210202 [0,1,0,0,0,0|2,0,0]=3 1067 B11R1.13 CCNc1cccc(c1F)Br 34a_100011935091_100000210202 [0,1,0,0,0,0|2,0,0]=3 1068 B11R1.13 CCNc1cccc(c1F)C 2230a_100000697159_100000210202 [0,1,0,0,0,0|2,0,0]=3 1069 B11R1.13 CCNc1cccc(c1F)C 34a_100000697159_100000210202 [0,1,0,0,0,0|2,0,0]=3 1070 B11R1.13 CCNc1cccc(c1F)C 7a_100000697159_100000210202 [0,1,0,0,0,0|2,0,0]=3 1071 B11R1.13 CCNc1cccc(c1F)Cl 2230a_100000199060_100000210202 [0,1,0,0,0,0|2,0,0]=3 1072 B11R1.13 CCNc1cccc(c1F)Cl 34a_100000199060_100000210202 [0,1,0,0,0,0|2,0,0]=3 1073 B11R1.13 CCNc1cccc(c1F)F 34a_100000743855_100000210202 [0,1,0,0,0,0|2,0,0]=3 1074 B11R1.13 CCNc1cccc(c1I)Br 34a_100020590159_100000210202 [0,1,0,0,0,0|2,0,0]=3 1075 B11R1.13 CCNc1cccc(c1I)C 34a_100000761888_100000210202 [0,1,0,0,0,0|2,0,0]=3 1076 B11R1.13 CCNc1cccc(c1I)Cl 34a_100000049713_100000210202 [0,1,0,0,0,0|2,0,0]=3 1077 B11R1.13 CCNc1cccc(c1I)F 34a_100000690935_100000210202 [0,1,0,0,0,0|2,0,0]=3 1078 B11R1.13 CCNc1cccc(c1O)Br 34a_100011934915_100000210202 [0,1,0,0,0,0|1,0,0]=2 1079 B11R1.13 CCNc1cccc(c1O)C 34a_100000756359_100000210202 [0,1,0,0,0,0|1,0,0]=2 1080 B11R1.13 CCNc1cccc(c1O)Cl 34a_100000754742_100000210202 [0,1,0,0,0,0|1,0,0]=2 1081 B11R1.13 CCNc1cccc(c1O)F 34a_100011934987_100000210202 [0,1,0,0,0,0|1,0,0]=2 1082 B11R1.13 CCNc1ccnc(c1Br)F 27a_100015525214_100010006599 [0,1,0,0,0,0|3,0,0]=4 1083 B11R1.13 CCNc1ccnc(c1C)F 27a_100015525214_100010006593 [0,1,0,0,0,0|3,0,0]=4 1084 B11R1.13 CCNc1ccnc(c1Cl)C 27a_100015525214_100000698670 [0,1,0,0,0,0|3,0,0]=4 1085 B11R1.13 CCNc1ccnc(c1Cl)F 27a_100015525214_100010067886 [0,1,0,0,0,0|3,0,0]=4 1086 B11R1.13 CCNc1ccnc(c1F)C 27a_100015525214_100009849794 [0,1,0,0,0,0|3,0,0]=4 1087 B11R1.13 CCNc1ccnc(c1F)F 27a_100015525214_100010214882 [0,1,0,0,0,0|3,0,0]=4 1088 B11R1.13 CCNc1nccc(c1C)F 27a_100015525214_100009846374 [0,1,0,0,0,0|3,0,0]=4 1089 B11R1.13 CCOc1cccc(c1Br)Br 34a_100010187966_100000210202 [0,1,0,0,0,0|2,0,0]=3 1090 B11R1.13 CCOc1cccc(c1Br)Br 7a_100010187966_100000210202 [0,1,0,0,0,0|2,0,0]=3 1091 B11R1.13 CCOc1cccc(c1Br)C 34a_100000686692_100000210202 [0,1,0,0,0,0|2,0,0]=3 1092 B11R1.13 CCOc1cccc(c1Br)C 7a_100000686692_100000210202 [0,1,0,0,0,0|2,0,0]=3 1093 B11R1.13 CCOc1cccc(c1Br)Cl 34a_100012348804_100000210202 [0,1,0,0,0,0|2,0,0]=3 1094 B11R1.13 CCOc1cccc(c1Br)Cl 7a_100012348804_100000210202 [0,1,0,0,0,0|2,0,0]=3 1095 B11R1.13 CCOc1cccc(c1Br)F 34a_100009820682_100000210202 [0,1,0,0,0,0|2,0,0]=3 1096 B11R1.13 CCOc1cccc(c1Br)F 7a_100009820682_100000210202 [0,1,0,0,0,0|2,0,0]=3 1097 B11R1.13 CCOc1cccc(c1Br)I 34a_100010187914_100000210202 [0,1,0,0,0,0|2,0,0]=3 1098 B11R1.13 CCOc1cccc(c1Br)I 7a_100010187914_100000210202 [0,1,0,0,0,0|2,0,0]=3 1099 B11R1.13 CCOc1cccc(c1Br)N 34a_100012183704_100000210202 [0,1,0,0,0,0|2,0,0]=3 1100 B11R1.13 CCOc1cccc(c1Br)N 7a_100012183704_100000210202 [0,1,0,0,0,0|2,0,0]=3 1101 B11R1.13 CCOc1cccc(c1C)Br 34a_100012002258_100000210202 [0,1,0,0,0,0|2,0,0]=3 1102 B11R1.13 CCOc1cccc(c1C)Br 7a_100012002258_100000210202 [0,1,0,0,0,0|2,0,0]=3 1103 B11R1.13 CCOc1cccc(c1C)C 34a_100000185855_100000210202 [0,1,0,0,0,0|2,0,0]=3 1104 B11R1.13 CCOc1cccc(c1C)C 7a_100000185855_100000210202 [0,1,0,0,0,0|2,0,0]=3 1105 B11R1.13 CCOc1cccc(c1C)Cl 34a_100011265684_100000210202 [0,1,0,0,0,0|2,0,0]=3 1106 B11R1.13 CCOc1cccc(c1C)Cl 7a_100011265684_100000210202 [0,1,0,0,0,0|2,0,0]=3 1107 B11R1.13 CCOc1cccc(c1C)F 34a_100011217231_100000210202 [0,1,0,0,0,0|2,0,0]=3 1108 B11R1.13 CCOc1cccc(c1C)F 7a_100011217231_100000210202 [0,1,0,0,0,0|2,0,0]=3 1109 B11R1.13 CCOc1cccc(c1C)N 34a_100011216573_100000210202 [0,1,0,0,0,0|2,0,0]=3 1110 B11R1.13 CCOc1cccc(c1C)N 7a_100011216573_100000210202 [0,1,0,0,0,0|2,0,0]=3 1111 B11R1.13 CCOc1cccc(c1Cl)Br 34a_100010187913_100000210202 [0,1,0,0,0,0|2,0,0]=3 1112 B11R1.13 CCOc1cccc(c1Cl)Br 7a_100010187913_100000210202 [0,1,0,0,0,0|2,0,0]=3 1113 B11R1.13 CCOc1cccc(c1Cl)C 34a_100000695629_100000210202 [0,1,0,0,0,0|2,0,0]=3 1114 B11R1.13 CCOc1cccc(c1Cl)C 7a_100000695629_100000210202 [0,1,0,0,0,0|2,0,0]=3 1115 B11R1.13 CCOc1cccc(c1Cl)Cl 34a_100000211076_100000210202 [0,1,0,0,0,0|2,0,0]=3 1116 B11R1.13 CCOc1cccc(c1Cl)Cl 7a_100000211076_100000210202 [0,1,0,0,0,0|2,0,0]=3 1117 B11R1.13 CCOc1cccc(c1Cl)F 34a_100000087408_100000210202 [0,1,0,0,0,0|2,0,0]=3 1118 B11R1.13 CCOc1cccc(c1Cl)F 7a_100000087408_100000210202 [0,1,0,0,0,0|2,0,0]=3 1119 B11R1.13 CCOc1cccc(c1Cl)I 34a_100000049636_100000210202 [0,1,0,0,0,0|2,0,0]=3 1120 B11R1.13 CCOc1cccc(c1Cl)I 7a_100000049636_100000210202 [0,1,0,0,0,0|2,0,0]=3 1121 B11R1.13 CCOc1cccc(c1Cl)N 34a_100012002038_100000210202 [0,1,0,0,0,0|2,0,0]=3 1122 B11R1.13 CCOc1cccc(c1Cl)N 7a_100012002038_100000210202 [0,1,0,0,0,0|2,0,0]=3 1123 B11R1.13 CCOc1cccc(c1F)Br 34a_100009817021_100000210202 [0,1,0,0,0,0|2,0,0]=3 1124 B11R1.13 CCOc1cccc(c1F)Br 7a_100009817021_100000210202 [0,1,0,0,0,0|2,0,0]=3 1125 B11R1.13 CCOc1cccc(c1F)C 34a_100000751311_100000210202 [0,1,0,0,0,0|2,0,0]=3 1126 B11R1.13 CCOc1cccc(c1F)C 7a_100000751311_100000210202 [0,1,0,0,0,0|2,0,0]=3 1127 B11R1.13 CCOc1cccc(c1F)Cl 34a_100000687438_100000210202 [0,1,0,0,0,0|2,0,0]=3 1128 B11R1.13 CCOc1cccc(c1F)Cl 7a_100000687438_100000210202 [0,1,0,0,0,0|2,0,0]=3 1129 B11R1.13 CCOc1cccc(c1F)F 34a_100000751161_100000210202 [0,1,0,0,0,0|2,0,0]=3 1130 B11R1.13 CCOc1cccc(c1F)F 7a_100000751161_100000210202 [0,1,0,0,0,0|2,0,0]=3 1131 B11R1.13 CCOc1cccc(c1I)Br 34a_100010187912_100000210202 [0,1,0,0,0,0|2,0,0]=3 1132 B11R1.13 CCOc1cccc(c1I)Br 7a_100010187912_100000210202 [0,1,0,0,0,0|2,0,0]=3 1133 B11R1.13 CCOc1cccc(c1I)C 34a_100010083724_100000210202 [0,1,0,0,0,0|2,0,0]=3 1134 B11R1.13 CCOc1cccc(c1I)C 7a_100010083724_100000210202 [0,1,0,0,0,0|2,0,0]=3 1135 B11R1.13 CCOc1cccc(c1I)Cl 34a_100000050174_100000210202 [0,1,0,0,0,0|2,0,0]=3 1136 B11R1.13 CCOc1cccc(c1I)Cl 7a_100000050174_100000210202 [0,1,0,0,0,0|2,0,0]=3 1137 B11R1.13 CCOc1cccc(c1I)F 34a_100000690913_100000210202 [0,1,0,0,0,0|2,0,0]=3 1138 B11R1.13 CCOc1cccc(c1I)F 7a_100000690913_100000210202 [0,1,0,0,0,0|2,0,0]=3 1139 B11R1.13 CCOc1cccc(c1N)Br 34a_100011934926_100000210202 [0,1,0,0,0,0|2,0,0]=3 1140 B11R1.13 CCOc1cccc(c1N)Br 7a_100011934926_100000210202 [0,1,0,0,0,0|2,0,0]=3 1141 B11R1.13 CCOc1cccc(c1N)C 34a_100000743429_100000210202 [0,1,0,0,0,0|2,0,0]=3 1142 B11R1.13 CCOc1cccc(c1N)C 7a_100000743429_100000210202 [0,1,0,0,0,0|2,0,0]=3 1143 B11R1.13 CCOc1cccc(c1N)Cl 34a_100012022510_100000210202 [0,1,0,0,0,0|2,0,0]=3 1144 B11R1.13 CCOc1cccc(c1N)Cl 7a_100012022510_100000210202 [0,1,0,0,0,0|2,0,0]=3 1145 B11R1.13 CCOc1cccc(c1N)F 34a_100020591140_100000210202 [0,1,0,0,0,0|2,0,0]=3 1146 B11R1.13 CCOc1cccc(c1N)F 7a_100020591140_100000210202 [0,1,0,0,0,0|2,0,0]=3 1147 B11R1.13 CCOc1cccc(c1N)I 34a_200000049512_100000210202 [0,1,0,0,0,0|2,0,0]=3 1148 B11R1.13 CCOc1cccc(c1N)I 7a_200000049512_100000210202 [0,1,0,0,0,0|2,0,0]=3 1149 B11R1.13 CCOc1cccc(c1N)N 34a_100000033209_100000210202 [0,1,0,0,0,0|2,0,0]=3 1150 B11R1.13 CCOc1cccc(c1N)O 271570a_203496583355_200103155331 [0,1,0,0,0,0|2,0,0]=3 1151 B11R1.13 CCOc1cccn(c1=O)C 34a_100000117616_100000210202 [0,1,0,0,0,0|2,0,1]=4 1152 B11R1.13 CCOc1cccn(c1=O)C 7a_100000117616_100000210202 [0,1,0,0,0,0|2,0,1]=4 1153 B11R1.13 CCOc1ccnc(c1Br)Cl 34a_100010136240_100000210202 [0,1,0,0,0,0|3,0,0]=4 1154 B11R1.13 CCOc1ccnc(c1Cl)Cl 34a_100009860235_100000210202 [0,1,0,0,0,0|3,0,0]=4 1155 B11R1.13 CCOc1ccnc(c1F)Br 34a_100009876375_100000210202 [0,1,0,0,0,0|3,0,0]=4 1156 B11R1.13 CCOc1ccnc(c1F)Cl 34a_100009856406_100000210202 [0,1,0,0,0,0|3,0,0]=4 1157 B11R1.13 CCOc1ccnc(c1N)Cl 34a_100000128729_100000210202 [0,1,0,0,0,0|3,0,0]=4 1158 B11R1.13 CCOc1nccc(c1Br)C 34a_100012000493_100000210202 [0,1,0,0,0,0|3,0,0]=4 1159 B11R1.13 CCOc1nccc(c1C)Br 34a_100009858498_100000210202 [0,1,0,0,0,0|3,0,0]=4 1160 B11R1.13 CCOc1nccc(c1Cl)N 34a_200000093555_100000210202 [0,1,0,0,0,0|3,0,0]=4 1161 B11R1.13 CCSc1cccc(=O)n1C 62a_100000210202_100000726605 [0,1,0,0,0,0|3,0,0]=4 1162 B11R1.13 CCSc1cccc(=O)n1C 62a_100000726605_100000210202 [0,1,0,0,0,0|3,0,0]=4 1163 B11R1.13 CCSc1cccc(c1Br)Br 62a_100000210202_100010175083 [0,1,0,0,0,0|2,0,0]=3 1164 B11R1.13 CCSc1cccc(c1Br)Br 62a_100010175083_100000210202 [0,1,0,0,0,0|2,0,0]=3 1165 B11R1.13 CCSc1cccc(c1Br)C 62a_100000210202_100012362457 [0,1,0,0,0,0|2,0,0]=3 1166 B11R1.13 CCSc1cccc(c1Br)C 62a_100012362457_100000210202 [0,1,0,0,0,0|2,0,0]=3 1167 B11R1.13 CCSc1cccc(c1Br)Cl 62a_100000210202_100014021842 [0,1,0,0,0,0|2,0,0]=3 1168 B11R1.13 CCSc1cccc(c1Br)Cl 62a_100014021842_100000210202 [0,1,0,0,0,0|2,0,0]=3 1169 B11R1.13 CCSc1cccc(c1Br)F 62a_100000210202_100010202630 [0,1,0,0,0,0|2,0,0]=3 1170 B11R1.13 CCSc1cccc(c1Br)F 62a_100010202630_100000210202 [0,1,0,0,0,0|2,0,0]=3 1171 B11R1.13 CCSc1cccc(c1Br)O 62a_100000210202_100010187914 [0,1,0,0,0,0|2,0,0]=3 1172 B11R1.13 CCSc1cccc(c1Br)O 62a_100010187914_100000210202 [0,1,0,0,0,0|2,0,0]=3 1173 B11R1.13 CCSc1cccc(c1C)Br 62a_100000210202_100012353703 [0,1,0,0,0,0|2,0,0]=3 1174 B11R1.13 CCSc1cccc(c1C)Br 62a_100012353703_100000210202 [0,1,0,0,0,0|2,0,0]=3 1175 B11R1.13 CCSc1cccc(c1C)C 62a_100000210202_100011214922 [0,1,0,0,0,0|2,0,0]=3 1176 B11R1.13 CCSc1cccc(c1C)C 62a_100011214922_100000210202 [0,1,0,0,0,0|2,0,0]=3 1177 B11R1.13 CCSc1cccc(c1C)Cl 62a_100000210202_100000726075 [0,1,0,0,0,0|2,0,0]=3 1178 B11R1.13 CCSc1cccc(c1C)Cl 62a_100000726075_100000210202 [0,1,0,0,0,0|2,0,0]=3 1179 B11R1.13 CCSc1cccc(c1C)F 62a_100000210202_100011216893 [0,1,0,0,0,0|2,0,0]=3 1180 B11R1.13 CCSc1cccc(c1C)F 62a_100011216893_100000210202 [0,1,0,0,0,0|2,0,0]=3 1181 B11R1.13 CCSc1cccc(c1C)N 62a_100000210202_100000761887 [0,1,0,0,0,0|2,0,0]=3 1182 B11R1.13 CCSc1cccc(c1C)N 62a_100000761887_100000210202 [0,1,0,0,0,0|2,0,0]=3 1183 B11R1.13 CCSc1cccc(c1C)O 62a_100000210202_100012002258 [0,1,0,0,0,0|2,0,0]=3 1184 B11R1.13 CCSc1cccc(c1C)O 62a_100012002258_100000210202 [0,1,0,0,0,0|2,0,0]=3 1185 B11R1.13 CCSc1cccc(c1Cl)Br 62a_100000210202_100010142854 [0,1,0,0,0,0|2,0,0]=3 1186 B11R1.13 CCSc1cccc(c1Cl)Br 62a_100010142854_100000210202 [0,1,0,0,0,0|2,0,0]=3 1187 B11R1.13 CCSc1cccc(c1Cl)C 62a_100000210202_200012352035 [0,1,0,0,0,0|2,0,0]=3 1188 B11R1.13 CCSc1cccc(c1Cl)C 62a_200012352035_100000210202 [0,1,0,0,0,0|2,0,0]=3 1189 B11R1.13 CCSc1cccc(c1Cl)Cl 62a_100000210202_100011215384 [0,1,0,0,0,0|2,0,0]=3 1190 B11R1.13 CCSc1cccc(c1Cl)Cl 62a_100011215384_100000210202 [0,1,0,0,0,0|2,0,0]=3 1191 B11R1.13 CCSc1cccc(c1Cl)F 62a_100000210202_200010234923 [0,1,0,0,0,0|2,0,0]=3 1192 B11R1.13 CCSc1cccc(c1Cl)F 62a_200010234923_100000210202 [0,1,0,0,0,0|2,0,0]=3 1193 B11R1.13 CCSc1cccc(c1Cl)O 62a_100000210202_100000049636 [0,1,0,0,0,0|2,0,0]=3 1194 B11R1.13 CCSc1cccc(c1F)Br 62a_100000210202_100000702267 [0,1,0,0,0,0|2,0,0]=3 1195 B11R1.13 CCSc1cccc(c1F)Br 62a_100000702267_100000210202 [0,1,0,0,0,0|2,0,0]=3 1196 B11R1.13 CCSc1cccc(c1F)C 62a_100000210202_100000717567 [0,1,0,0,0,0|2,0,0]=3 1197 B11R1.13 CCSc1cccc(c1F)C 62a_100000717567_100000210202 [0,1,0,0,0,0|2,0,0]=3 1198 B11R1.13 CCSc1cccc(c1F)Cl 62a_100000210202_100011217346 [0,1,0,0,0,0|2,0,0]=3 1199 B11R1.13 CCSc1cccc(c1F)Cl 62a_100011217346_100000210202 [0,1,0,0,0,0|2,0,0]=3 1200 B11R1.13 CCSc1cccc(c1F)F 62a_100000210202_100000694657 [0,1,0,0,0,0|2,0,0]=3 1201 B11R1.13 CCSc1cccc(c1F)F 62a_100000694657_100000210202 [0,1,0,0,0,0|2,0,0]=3 1202 B11R1.13 CCSc1cccc(c1F)N 62a_100000210202_100011935091 [0,1,0,0,0,0|2,0,0]=3 1203 B11R1.13 CCSc1cccc(c1F)N 62a_100011935091_100000210202 [0,1,0,0,0,0|2,0,0]=3 1204 B11R1.13 CCSc1cccc(c1F)O 62a_100000210202_100009817021 [0,1,0,0,0,0|2,0,0]=3 1205 B11R1.13 CCSc1cccc(c1F)O 62a_100009817021_100000210202 [0,1,0,0,0,0|2,0,0]=3 1206 B11R1.13 CCSc1cccc(c1N)Br 62a_100000210202_100010146558 [0,1,0,0,0,0|2,0,0]=3 1207 B11R1.13 CCSc1cccc(c1N)Br 62a_100010146558_100000210202 [0,1,0,0,0,0|2,0,0]=3 1208 B11R1.13 CCSc1cccc(c1N)C 62a_100000210202_100011834072 [0,1,0,0,0,0|2,0,0]=3 1209 B11R1.13 CCSc1cccc(c1N)C 62a_100011834072_100000210202 [0,1,0,0,0,0|2,0,0]=3 1210 B11R1.13 CCSc1cccc(c1N)Cl 62a_100000210202_100010190421 [0,1,0,0,0,0|2,0,0]=3 1211 B11R1.13 CCSc1cccc(c1N)Cl 62a_100010190421_100000210202 [0,1,0,0,0,0|2,0,0]=3 1212 B11R1.13 CCSc1cccc(c1N)F 62a_100000042321_100000210202 [0,1,0,0,0,0|2,0,0]=3 1213 B11R1.13 CCSc1cccc(c1N)F 62a_100000210202_100000042321 [0,1,0,0,0,0|2,0,0]=3 1214 B11R1.13 CCSc1cccc(c1N)N 62a_100015191791_100000210202 [0,1,0,0,0,0|2,0,0]=3 1215 B11R1.13 CCSc1cccc(c1N)O 62a_100000210202_100011934926 [0,1,0,0,0,0|2,0,0]=3 1216 B11R1.13 CCSc1cccc(c1O)Br 62a_100000210202_100010084509 [0,1,0,0,0,0|1,0,0]=2 1217 B11R1.13 CCSc1cccc(c1O)Br 62a_100010084509_100000210202 [0,1,0,0,0,0|1,0,0]=2 1218 B11R1.13 CCSc1cccc(c1O)C 62a_100000210202_100009817157 [0,1,0,0,0,0|1,0,0]=2 1219 B11R1.13 CCSc1cccc(c1O)C 62a_100009817157_100000210202 [0,1,0,0,0,0|1,0,0]=2 1220 B11R1.13 CCSc1cccc(c1O)Cl 62a_100000210202_100010202889 [0,1,0,0,0,0|1,0,0]=2 1221 B11R1.13 CCSc1cccc(c1O)Cl 62a_100010202889_100000210202 [0,1,0,0,0,0|1,0,0]=2 1222 B11R1.13 CCSc1cccc(c1O)F 62a_100000210202_100009813666 [0,1,0,0,0,0|1,0,0]=2 1223 B11R1.13 CCSc1cccc(c1O)F 62a_100009813666_100000210202 [0,1,0,0,0,0|1,0,0]=2 1224 B11R1.13 CCSc1cccc(c1O)N 62a_100000210202_100010084371 [0,1,0,0,0,0|1,0,0]=2 1225 B11R1.13 CCSc1cccc(c1O)N 62a_100011934915_100000210202 [0,1,0,0,0,0|1,0,0]=2 1226 B11R1.13 CCSc1cccc(c1O)O 62a_100000210202_100009815950 [0,1,0,0,0,0|1,0,0]=2 1227 B11R1.13 CCSc1cccn(c1=O)C 62a_100000210202_100000687173 [0,1,0,0,0,0|2,0,1]=4 1228 B11R1.13 CCSc1cccn(c1=O)C 62a_100000687173_100000210202 [0,1,0,0,0,0|2,0,1]=4 1229 B11R1.13 CCSc1ccnc(c1Br)F 62a_100000210202_100010006599 [0,1,0,0,0,0|3,0,0]=4 1230 B11R1.13 CCSc1ccnc(c1Br)F 62a_100010006599_100000210202 [0,1,0,0,0,0|3,0,0]=4 1231 B11R1.13 CCSc1ccnc(c1C)C 62a_100000210202_100009846815 [0,1,0,0,0,0|3,0,0]=4 1232 B11R1.13 CCSc1ccnc(c1C)C 62a_100009846815_100000210202 [0,1,0,0,0,0|3,0,0]=4 1233 B11R1.13 CCSc1ccnc(c1C)Cl 62a_100000047055_100000210202 [0,1,0,0,0,0|3,0,0]=4 1234 B11R1.13 CCSc1ccnc(c1C)Cl 62a_100000210202_100000047055 [0,1,0,0,0,0|3,0,0]=4 1235 B11R1.13 CCSc1ccnc(c1C)F 62a_100000210202_100010006593 [0,1,0,0,0,0|3,0,0]=4 1236 B11R1.13 CCSc1ccnc(c1C)F 62a_100010006593_100000210202 [0,1,0,0,0,0|3,0,0]=4 1237 B11R1.13 CCSc1ccnc(c1C)N 62a_100000210202_100009865460 [0,1,0,0,0,0|3,0,0]=4 1238 B11R1.13 CCSc1ccnc(c1C)N 62a_100009865460_100000210202 [0,1,0,0,0,0|3,0,0]=4 1239 B11R1.13 CCSc1ccnc(c1C)O 62a_100000210202_100009858498 [0,1,0,0,0,0|3,0,0]=4 1240 B11R1.13 CCSc1ccnc(c1C)O 62a_100009858498_100000210202 [0,1,0,0,0,0|3,0,0]=4 1241 B11R1.13 CCSc1ccnc(c1Cl)C 62a_100000210202_100000698670 [0,1,0,0,0,0|3,0,0]=4 1242 B11R1.13 CCSc1ccnc(c1Cl)C 62a_100000698670_100000210202 [0,1,0,0,0,0|3,0,0]=4 1243 B11R1.13 CCSc1ccnc(c1Cl)Cl 62a_100000210202_100010246212 [0,1,0,0,0,0|3,0,0]=4 1244 B11R1.13 CCSc1ccnc(c1Cl)Cl 62a_100010246212_100000210202 [0,1,0,0,0,0|3,0,0]=4 1245 B11R1.13 CCSc1ccnc(c1Cl)F 62a_100000210202_100010067886 [0,1,0,0,0,0|3,0,0]=4 1246 B11R1.13 CCSc1ccnc(c1Cl)F 62a_100010067886_100000210202 [0,1,0,0,0,0|3,0,0]=4 1247 B11R1.13 CCSc1ccnc(c1Cl)N 62a_100000210202_100010735111 [0,1,0,0,0,0|3,0,0]=4 1248 B11R1.13 CCSc1ccnc(c1Cl)N 62a_100010735111_100000210202 [0,1,0,0,0,0|3,0,0]=4 1249 B11R1.13 CCSc1ccnc(c1F)Br 62a_100000210202_200015269031 [0,1,0,0,0,0|3,0,0]=4 1250 B11R1.13 CCSc1ccnc(c1F)Br 62a_200015269031_100000210202 [0,1,0,0,0,0|3,0,0]=4 1251 B11R1.13 CCSc1ccnc(c1F)C 62a_100000210202_100009849794 [0,1,0,0,0,0|3,0,0]=4 1252 B11R1.13 CCSc1ccnc(c1F)C 62a_100009849794_100000210202 [0,1,0,0,0,0|3,0,0]=4 1253 B11R1.13 CCSc1ccnc(c1F)Cl 62a_100000210202_100010150473 [0,1,0,0,0,0|3,0,0]=4 1254 B11R1.13 CCSc1ccnc(c1F)Cl 62a_100010150473_100000210202 [0,1,0,0,0,0|3,0,0]=4 1255 B11R1.13 CCSc1ccnc(c1F)F 62a_100000210202_100010214882 [0,1,0,0,0,0|3,0,0]=4 1256 B11R1.13 CCSc1ccnc(c1F)F 62a_100010214882_100000210202 [0,1,0,0,0,0|3,0,0]=4 1257 B11R1.13 CCSc1ccnc(c1F)N 62a_100000210202_100010077785 [0,1,0,0,0,0|3,0,0]=4 1258 B11R1.13 CCSc1ccnc(c1F)N 62a_100010077785_100000210202 [0,1,0,0,0,0|3,0,0]=4 1259 B11R1.13 CCSc1ccnc(c1N)C 62a_100000210202_100009885578 [0,1,0,0,0,0|3,0,0]=4 1260 B11R1.13 CCSc1ccnc(c1N)C 62a_100009885578_100000210202 [0,1,0,0,0,0|3,0,0]=4 1261 B11R1.13 CCSc1ccnc(c1N)N 62a_100000124095_100000210202 [0,1,0,0,0,0|3,0,0]=4 1262 B11R1.13 CCSc1ccnc(c1O)Cl 62a_100000210202_100010067911 [0,1,0,0,0,0|2,0,0]=3 1263 B11R1.13 CCSc1cncc(c1C)Br 62a_100000210202_100010109657 [0,1,0,0,0,0|3,0,0]=4 1264 B11R1.13 CCSc1cncc(c1C)Br 62a_100010109657_100000210202 [0,1,0,0,0,0|3,0,0]=4 1265 B11R1.13 CCSc1cncc(c1C)C 62a_100000210202_100009864703 [0,1,0,0,0,0|3,0,0]=4 1266 B11R1.13 CCSc1cncc(c1C)C 62a_100009864703_100000210202 [0,1,0,0,0,0|3,0,0]=4 1267 B11R1.13 CCSc1cncc(c1C)F 62a_100000210202_100009881546 [0,1,0,0,0,0|3,0,0]=4 1268 B11R1.13 CCSc1cncc(c1C)F 62a_100009881546_100000210202 [0,1,0,0,0,0|3,0,0]=4 1269 B11R1.13 CCSc1cncc(c1C)N 62a_100000210202_100011998293 [0,1,0,0,0,0|3,0,0]=4 1270 B11R1.13 CCSc1cncc(c1C)N 62a_100011998293_100000210202 [0,1,0,0,0,0|3,0,0]=4 1271 B11R1.13 CCSc1cncc(c1N)Br 62a_100000210202_100011290786 [0,1,0,0,0,0|3,0,0]=4 1272 B11R1.13 CCSc1cncc(c1N)Br 62a_100011290786_100000210202 [0,1,0,0,0,0|3,0,0]=4 1273 B11R1.13 CCSc1cncc(c1N)C 62a_100000210202_100009818025 [0,1,0,0,0,0|3,0,0]=4 1274 B11R1.13 CCSc1cncc(c1N)C 62a_100009818025_100000210202 [0,1,0,0,0,0|3,0,0]=4 1275 B11R1.13 CCSc1cncc(c1N)Cl 62a_100000210202_100000684942 [0,1,0,0,0,0|3,0,0]=4 1276 B11R1.13 CCSc1cncc(c1N)Cl 62a_100000684942_100000210202 [0,1,0,0,0,0|3,0,0]=4 1277 B11R1.13 CCSc1cncc(c1N)F 62a_100000210202_100009880649 [0,1,0,0,0,0|3,0,0]=4 1278 B11R1.13 CCSc1cncc(c1N)F 62a_100009880649_100000210202 [0,1,0,0,0,0|3,0,0]=4 1279 B11R1.13 CCSc1cncc(c1N)N 62a_100000210202_100000694774 [0,1,0,0,0,0|3,0,0]=4 1280 B11R1.13 CCSc1cncc(c1N)N 62a_100000694774_100000210202 [0,1,0,0,0,0|3,0,0]=4 1281 B11R1.13 CCSc1cncc(c1O)N 62a_100000210202_100000694263 [0,1,0,0,0,0|2,0,0]=3 1282 B11R1.13 CCSc1cncc(c1O)N 62a_100000694263_100000210202 [0,1,0,0,0,0|2,0,0]=3 1283 B11R1.13 CCSc1nccc(c1C)C 62a_100000210202_100009847204 [0,1,0,0,0,0|3,0,0]=4 1284 B11R1.13 CCSc1nccc(c1C)C 62a_100009847204_100000210202 [0,1,0,0,0,0|3,0,0]=4 1285 B11R1.13 CCSc1nccc(c1C)F 62a_100000210202_100009846374 [0,1,0,0,0,0|3,0,0]=4 1286 B11R1.13 CCSc1nccc(c1C)F 62a_100009846374_100000210202 [0,1,0,0,0,0|3,0,0]=4 1287 B11R1.13 CCSc1nccc(c1C)N 62a_100000210202_100000690622 [0,1,0,0,0,0|3,0,0]=4 1288 B11R1.13 CCSc1nccc(c1C)N 62a_100000690622_100000210202 [0,1,0,0,0,0|3,0,0]=4 1289 B11R1.13 CCSc1nccc(c1F)C 62a_100000210202_100009817629 [0,1,0,0,0,0|3,0,0]=4 1290 B11R1.13 CCSc1nccc(c1F)C 62a_100009817629_100000210202 [0,1,0,0,0,0|3,0,0]=4 1291 B11R1.13 CCSc1nccc(c1F)N 62a_100000210202_100015205195 [0,1,0,0,0,0|3,0,0]=4 1292 B11R1.13 CCSc1nccc(c1F)N 62a_100015205195_100000210202 [0,1,0,0,0,0|3,0,0]=4 1293 B11R1.13 CCSc1nccc(c1F)O 62a_100000210202_100009876375 [0,1,0,0,0,0|3,0,0]=4 1294 B11R1.13 CCSc1nccc(c1F)O 62a_100009876375_100000210202 [0,1,0,0,0,0|3,0,0]=4 1295 B11R1.13 CCSc1nccc(c1N)C 62a_100000210202_100000763560 [0,1,0,0,0,0|3,0,0]=4 1296 B11R1.13 CCSc1nccc(c1N)C 62a_100000763560_100000210202 [0,1,0,0,0,0|3,0,0]=4 1297 B11R1.13 CCSc1nccc(c1N)N 62a_100000085203_100000210202 [0,1,0,0,0,0|3,0,0]=4 1298 B11R1.13 CCSc1nccc(c1N)N 62a_100000210202_100000085203 [0,1,0,0,0,0|3,0,0]=4 1299 B11R1.13 CCSc1nccc(c1O)C 62a_100000210202_100000696282 [0,1,0,0,0,0|2,0,0]=3 1300 B11R1.13 CCSc1nccc(c1O)F 62a_100000210202_100009867227 [0,1,0,0,0,0|2,0,0]=3 1301 B11R1.13 CCSc1nccc(c1O)N 62a_100000210202_100009844647 [0,1,0,0,0,0|2,0,0]=3 1302 B11R1.13 CCSc1ncnc(c1O)N 62a_100000210202_100000124137 [0,1,0,0,0,0|3,0,0]=4 1303 B11R1.13 CNCc1cccc(c1Br)Br 207a_100102657272_100010240334 [0,1,0,0,0,0|2,0,0]=3 1304 B11R1.13 CNCc1cccc(c1Br)Br 26a_100102657272_100010187966 [0,1,0,0,0,0|2,0,0]=3 1305 B11R1.13 CNCc1cccc(c1Br)Br 270004a_106832991635_100010240334 [0,1,0,0,0,0|2,0,0]=3 1306 B11R1.13 CNCc1cccc(c1Br)C 207a_100102657272_100012186367 [0,1,0,0,0,0|2,0,0]=3 1307 B11R1.13 CNCc1cccc(c1Br)C 2230a_106832991635_200012349612 [0,1,0,0,0,0|2,0,0]=3 1308 B11R1.13 CNCc1cccc(c1Br)C 26a_100102657272_100000686692 [0,1,0,0,0,0|2,0,0]=3 1309 B11R1.13 CNCc1cccc(c1Br)C 270004a_106832991635_100012186367 [0,1,0,0,0,0|2,0,0]=3 1310 B11R1.13 CNCc1cccc(c1Br)C 34a_100102657272_200012349612 [0,1,0,0,0,0|2,0,0]=3 1311 B11R1.13 CNCc1cccc(c1Br)C 7a_106832991635_200012349612 [0,1,0,0,0,0|2,0,0]=3 1312 B11R1.13 CNCc1cccc(c1Br)Cl 207a_100102657272_100010232083 [0,1,0,0,0,0|2,0,0]=3 1313 B11R1.13 CNCc1cccc(c1Br)Cl 2230a_106832991635_100010145525 [0,1,0,0,0,0|2,0,0]=3 1314 B11R1.13 CNCc1cccc(c1Br)Cl 26a_100102657272_100012348804 [0,1,0,0,0,0|2,0,0]=3 1315 B11R1.13 CNCc1cccc(c1Br)Cl 270004a_106832991635_100010232083 [0,1,0,0,0,0|2,0,0]=3 1316 B11R1.13 CNCc1cccc(c1Br)Cl 34a_100102657272_100010145525 [0,1,0,0,0,0|2,0,0]=3 1317 B11R1.13 CNCc1cccc(c1Br)Cl 7a_106832991635_100010145525 [0,1,0,0,0,0|2,0,0]=3 1318 B11R1.13 CNCc1cccc(c1Br)F 207a_100102657272_100011934749 [0,1,0,0,0,0|2,0,0]=3 1319 B11R1.13 CNCc1cccc(c1Br)F 2230a_100020638964_200000210301 [0,1,0,0,0,0|2,0,0]=3 1320 B11R1.13 CNCc1cccc(c1Br)F 2230a_106832991635_100012351116 [0,1,0,0,0,0|2,0,0]=3 1321 B11R1.13 CNCc1cccc(c1Br)F 26a_100102657272_100009820682 [0,1,0,0,0,0|2,0,0]=3 1322 B11R1.13 CNCc1cccc(c1Br)F 270004a_106832991635_100011934749 [0,1,0,0,0,0|2,0,0]=3 1323 B11R1.13 CNCc1cccc(c1Br)F 34a_100020638964_200000210301 [0,1,0,0,0,0|2,0,0]=3 1324 B11R1.13 CNCc1cccc(c1Br)F 34a_100102657272_100012351116 [0,1,0,0,0,0|2,0,0]=3 1325 B11R1.13 CNCc1cccc(c1Br)F 7a_106832991635_100012351116 [0,1,0,0,0,0|2,0,0]=3 1326 B11R1.13 CNCc1cccc(c1Br)I 2230a_106832991635_100010254545 [0,1,0,0,0,0|2,0,0]=3 1327 B11R1.13 CNCc1cccc(c1Br)I 26a_100102657272_100010187914 [0,1,0,0,0,0|2,0,0]=3 1328 B11R1.13 CNCc1cccc(c1Br)I 34a_100102657272_100010254545 [0,1,0,0,0,0|2,0,0]=3 1329 B11R1.13 CNCc1cccc(c1Br)I 7a_106832991635_100010254545 [0,1,0,0,0,0|2,0,0]=3 1330 B11R1.13 CNCc1cccc(c1C)Br 207a_100102657272_100012179384 [0,1,0,0,0,0|2,0,0]=3 1331 B11R1.13 CNCc1cccc(c1C)Br 2230a_106832991635_100000694682 [0,1,0,0,0,0|2,0,0]=3 1332 B11R1.13 CNCc1cccc(c1C)Br 26a_100102657272_100012002258 [0,1,0,0,0,0|2,0,0]=3 1333 B11R1.13 CNCc1cccc(c1C)Br 270004a_106832991635_100012179384 [0,1,0,0,0,0|2,0,0]=3 1334 B11R1.13 CNCc1cccc(c1C)Br 34a_100000724210_200000210301 [0,1,0,0,0,0|2,0,0]=3 1335 B11R1.13 CNCc1cccc(c1C)Br 34a_100102657272_100000694682 [0,1,0,0,0,0|2,0,0]=3 1336 B11R1.13 CNCc1cccc(c1C)Br 7a_106832991635_100000694682 [0,1,0,0,0,0|2,0,0]=3 1337 B11R1.13 CNCc1cccc(c1C)C 207a_100102657272_100000229941 [0,1,0,0,0,0|2,0,0]=3 1338 B11R1.13 CNCc1cccc(c1C)C 2230a_100011211637_200000210301 [0,1,0,0,0,0|2,0,0]=3 1339 B11R1.13 CNCc1cccc(c1C)C 2230a_106832991635_100011515928 [0,1,0,0,0,0|2,0,0]=3 1340 B11R1.13 CNCc1cccc(c1C)C 270004a_106832991635_100000229941 [0,1,0,0,0,0|2,0,0]=3 1341 B11R1.13 CNCc1cccc(c1C)C 34a_100011211637_200000210301 [0,1,0,0,0,0|2,0,0]=3 1342 B11R1.13 CNCc1cccc(c1C)C 34a_100102657272_100011273979 [0,1,0,0,0,0|2,0,0]=3 1343 B11R1.13 CNCc1cccc(c1C)C 7a_106832991635_100011515928 [0,1,0,0,0,0|2,0,0]=3 1344 B11R1.13 CNCc1cccc(c1C)Cl 207a_100102657272_100012002129 [0,1,0,0,0,0|2,0,0]=3 1345 B11R1.13 CNCc1cccc(c1C)Cl 2230a_100020639605_200000210301 [0,1,0,0,0,0|2,0,0]=3 1346 B11R1.13 CNCc1cccc(c1C)Cl 2230a_106832991635_100012186920 [0,1,0,0,0,0|2,0,0]=3 1347 B11R1.13 CNCc1cccc(c1C)Cl 270004a_106832991635_100012002129 [0,1,0,0,0,0|2,0,0]=3 1348 B11R1.13 CNCc1cccc(c1C)Cl 34a_100020639605_200000210301 [0,1,0,0,0,0|2,0,0]=3 1349 B11R1.13 CNCc1cccc(c1C)Cl 34a_100102657272_100012186920 [0,1,0,0,0,0|2,0,0]=3 1350 B11R1.13 CNCc1cccc(c1C)Cl 7a_106832991635_100012186920 [0,1,0,0,0,0|2,0,0]=3 1351 B11R1.13 CNCc1cccc(c1C)F 207a_100102657272_100000037668 [0,1,0,0,0,0|2,0,0]=3 1352 B11R1.13 CNCc1cccc(c1C)F 2230a_100132306986_200000210301 [0,1,0,0,0,0|2,0,0]=3 1353 B11R1.13 CNCc1cccc(c1C)F 2230a_106832991635_100009813626 [0,1,0,0,0,0|2,0,0]=3 1354 B11R1.13 CNCc1cccc(c1C)F 270004a_106832991635_100000037668 [0,1,0,0,0,0|2,0,0]=3 1355 B11R1.13 CNCc1cccc(c1C)F 34a_100102657272_100009813626 [0,1,0,0,0,0|2,0,0]=3 1356 B11R1.13 CNCc1cccc(c1C)F 34a_100132306986_200000210301 [0,1,0,0,0,0|2,0,0]=3 1357 B11R1.13 CNCc1cccc(c1C)F 7a_106832991635_100009813626 [0,1,0,0,0,0|2,0,0]=3 1358 B11R1.13 CNCc1cccc(c1C)I 2230a_106832991635_100010150147 [0,1,0,0,0,0|2,0,0]=3 1359 B11R1.13 CNCc1cccc(c1C)I 34a_100102657272_100010150147 [0,1,0,0,0,0|2,0,0]=3 1360 B11R1.13 CNCc1cccc(c1C)I 7a_106832991635_100010150147 [0,1,0,0,0,0|2,0,0]=3 1361 B11R1.13 CNCc1cccc(c1C)O 270004a_106832991635_100009868165 [0,1,0,0,0,0|2,0,0]=3 1362 B11R1.13 CNCc1cccc(c1Cl)Br 207a_100102657272_100012362481 [0,1,0,0,0,0|2,0,0]=3 1363 B11R1.13 CNCc1cccc(c1Cl)Br 2230a_106832991635_100012349491 [0,1,0,0,0,0|2,0,0]=3 1364 B11R1.13 CNCc1cccc(c1Cl)Br 26a_100102657272_100010187913 [0,1,0,0,0,0|2,0,0]=3 1365 B11R1.13 CNCc1cccc(c1Cl)Br 270004a_106832991635_100012362481 [0,1,0,0,0,0|2,0,0]=3 1366 B11R1.13 CNCc1cccc(c1Cl)Br 34a_100102657272_100012349491 [0,1,0,0,0,0|2,0,0]=3 1367 B11R1.13 CNCc1cccc(c1Cl)Br 7a_106832991635_100012349491 [0,1,0,0,0,0|2,0,0]=3 1368 B11R1.13 CNCc1cccc(c1Cl)C 207a_100102657272_100012017286 [0,1,0,0,0,0|2,0,0]=3 1369 B11R1.13 CNCc1cccc(c1Cl)C 2230a_100025705714_200000210301 [0,1,0,0,0,0|2,0,0]=3 1370 B11R1.13 CNCc1cccc(c1Cl)C 26a_100102657272_100000695629 [0,1,0,0,0,0|2,0,0]=3 1371 B11R1.13 CNCc1cccc(c1Cl)C 270004a_106832991635_100012017286 [0,1,0,0,0,0|2,0,0]=3 1372 B11R1.13 CNCc1cccc(c1Cl)C 34a_100025705714_200000210301 [0,1,0,0,0,0|2,0,0]=3 1373 B11R1.13 CNCc1cccc(c1Cl)Cl 207a_100102657272_100000210504 [0,1,0,0,0,0|2,0,0]=3 1374 B11R1.13 CNCc1cccc(c1Cl)Cl 2230a_100011211633_200000210301 [0,1,0,0,0,0|2,0,0]=3 1375 B11R1.13 CNCc1cccc(c1Cl)Cl 2230a_106832991635_100000723366 [0,1,0,0,0,0|2,0,0]=3 1376 B11R1.13 CNCc1cccc(c1Cl)Cl 26a_100102657272_100000211076 [0,1,0,0,0,0|2,0,0]=3 1377 B11R1.13 CNCc1cccc(c1Cl)Cl 270004a_106832991635_100000210504 [0,1,0,0,0,0|2,0,0]=3 1378 B11R1.13 CNCc1cccc(c1Cl)Cl 34a_100011211633_200000210301 [0,1,0,0,0,0|2,0,0]=3 1379 B11R1.13 CNCc1cccc(c1Cl)Cl 34a_100102657272_100000723366 [0,1,0,0,0,0|2,0,0]=3 1380 B11R1.13 CNCc1cccc(c1Cl)Cl 7a_106832991635_100000723366 [0,1,0,0,0,0|2,0,0]=3 1381 B11R1.13 CNCc1cccc(c1Cl)F 207a_100102657272_100011998484 [0,1,0,0,0,0|2,0,0]=3 1382 B11R1.13 CNCc1cccc(c1Cl)F 2230a_100012001614_200000210301 [0,1,0,0,0,0|2,0,0]=3 1383 B11R1.13 CNCc1cccc(c1Cl)F 2230a_106832991635_100000696688 [0,1,0,0,0,0|2,0,0]=3 1384 B11R1.13 CNCc1cccc(c1Cl)F 26a_100102657272_100000087408 [0,1,0,0,0,0|2,0,0]=3 1385 B11R1.13 CNCc1cccc(c1Cl)F 270004a_106832991635_100011998484 [0,1,0,0,0,0|2,0,0]=3 1386 B11R1.13 CNCc1cccc(c1Cl)F 34a_100012001614_200000210301 [0,1,0,0,0,0|2,0,0]=3 1387 B11R1.13 CNCc1cccc(c1Cl)F 34a_100102657272_100000696688 [0,1,0,0,0,0|2,0,0]=3 1388 B11R1.13 CNCc1cccc(c1Cl)F 7a_106832991635_100000696688 [0,1,0,0,0,0|2,0,0]=3 1389 B11R1.13 CNCc1cccc(c1Cl)I 26a_100102657272_100000049636 [0,1,0,0,0,0|2,0,0]=3 1390 B11R1.13 CNCc1cccc(c1Cl)O 270004a_106832991635_100000050521 [0,1,0,0,0,0|2,0,0]=3 1391 B11R1.13 CNCc1cccc(c1F)Br 207a_100102657272_100011361543 [0,1,0,0,0,0|2,0,0]=3 1392 B11R1.13 CNCc1cccc(c1F)Br 2230a_100015189953_200000210301 [0,1,0,0,0,0|2,0,0]=3 1393 B11R1.13 CNCc1cccc(c1F)Br 2230a_106832991635_100012356506 [0,1,0,0,0,0|2,0,0]=3 1394 B11R1.13 CNCc1cccc(c1F)Br 26a_100102657272_100009817021 [0,1,0,0,0,0|2,0,0]=3 1395 B11R1.13 CNCc1cccc(c1F)Br 270004a_106832991635_100011361543 [0,1,0,0,0,0|2,0,0]=3 1396 B11R1.13 CNCc1cccc(c1F)Br 34a_100015189953_200000210301 [0,1,0,0,0,0|2,0,0]=3 1397 B11R1.13 CNCc1cccc(c1F)Br 34a_100102657272_100012356506 [0,1,0,0,0,0|2,0,0]=3 1398 B11R1.13 CNCc1cccc(c1F)Br 7a_106832991635_100012356506 [0,1,0,0,0,0|2,0,0]=3 1399 B11R1.13 CNCc1cccc(c1F)C 207a_100102657272_100011219516 [0,1,0,0,0,0|2,0,0]=3 1400 B11R1.13 CNCc1cccc(c1F)C 2230a_100012002060_200000210301 [0,1,0,0,0,0|2,0,0]=3 1401 B11R1.13 CNCc1cccc(c1F)C 2230a_106832991635_100011216058 [0,1,0,0,0,0|2,0,0]=3 1402 B11R1.13 CNCc1cccc(c1F)C 270004a_106832991635_100011219516 [0,1,0,0,0,0|2,0,0]=3 1403 B11R1.13 CNCc1cccc(c1F)C 34a_100012002060_200000210301 [0,1,0,0,0,0|2,0,0]=3 1404 B11R1.13 CNCc1cccc(c1F)C 34a_100102657272_100011216058 [0,1,0,0,0,0|2,0,0]=3 1405 B11R1.13 CNCc1cccc(c1F)C 7a_106832991635_100011216058 [0,1,0,0,0,0|2,0,0]=3 1406 B11R1.13 CNCc1cccc(c1F)Cl 207a_100102657272_100000766533 [0,1,0,0,0,0|2,0,0]=3 1407 B11R1.13 CNCc1cccc(c1F)Cl 2230a_100000764326_200000210301 [0,1,0,0,0,0|2,0,0]=3 1408 B11R1.13 CNCc1cccc(c1F)Cl 2230a_106832991635_100000716733 [0,1,0,0,0,0|2,0,0]=3 1409 B11R1.13 CNCc1cccc(c1F)Cl 26a_100102657272_100000687438 [0,1,0,0,0,0|2,0,0]=3 1410 B11R1.13 CNCc1cccc(c1F)Cl 270004a_106832991635_100000766533 [0,1,0,0,0,0|2,0,0]=3 1411 B11R1.13 CNCc1cccc(c1F)Cl 34a_100000764326_200000210301 [0,1,0,0,0,0|2,0,0]=3 1412 B11R1.13 CNCc1cccc(c1F)Cl 34a_100102657272_100000716733 [0,1,0,0,0,0|2,0,0]=3 1413 B11R1.13 CNCc1cccc(c1F)Cl 7a_106832991635_100000716733 [0,1,0,0,0,0|2,0,0]=3 1414 B11R1.13 CNCc1cccc(c1F)F 207a_100102657272_100000753312 [0,1,0,0,0,0|2,0,0]=3 1415 B11R1.13 CNCc1cccc(c1F)F 2230a_100011199105_200000210301 [0,1,0,0,0,0|2,0,0]=3 1416 B11R1.13 CNCc1cccc(c1F)F 2230a_106832991635_100000217499 [0,1,0,0,0,0|2,0,0]=3 1417 B11R1.13 CNCc1cccc(c1F)F 270004a_106832991635_100000753312 [0,1,0,0,0,0|2,0,0]=3 1418 B11R1.13 CNCc1cccc(c1F)F 34a_100011199105_200000210301 [0,1,0,0,0,0|2,0,0]=3 1419 B11R1.13 CNCc1cccc(c1F)F 34a_100102657272_100000217499 [0,1,0,0,0,0|2,0,0]=3 1420 B11R1.13 CNCc1cccc(c1F)F 7a_106832991635_100000217499 [0,1,0,0,0,0|2,0,0]=3 1421 B11R1.13 CNCc1cccc(c1F)I 207a_100102657272_100010202174 [0,1,0,0,0,0|2,0,0]=3 1422 B11R1.13 CNCc1cccc(c1F)I 270004a_106832991635_100010202174 [0,1,0,0,0,0|2,0,0]=3 1423 B11R1.13 CNCc1cccc(c1F)O 271570a_203496583355_114873767014 [0,1,0,0,0,0|2,0,0]=3 1424 B11R1.13 CNCc1cccc(c1F)O 34a_100025773512_200000210301 [0,1,0,0,0,0|2,0,0]=3 1425 B11R1.13 CNCc1cccc(c1I)Br 26a_100102657272_100010187912 [0,1,0,0,0,0|2,0,0]=3 1426 B11R1.13 CNCc1cccc(c1I)F 207a_100102657272_100010186293 [0,1,0,0,0,0|2,0,0]=3 1427 B11R1.13 CNCc1cccc(c1I)F 2230a_106832991635_100010149603 [0,1,0,0,0,0|2,0,0]=3 1428 B11R1.13 CNCc1cccc(c1I)F 270004a_106832991635_100010186293 [0,1,0,0,0,0|2,0,0]=3 1429 B11R1.13 CNCc1cccc(c1I)F 34a_100102657272_100010149603 [0,1,0,0,0,0|2,0,0]=3 1430 B11R1.13 CNCc1cccc(c1I)F 7a_106832991635_100010149603 [0,1,0,0,0,0|2,0,0]=3 1431 B11R1.13 CNCc1cccc(c1O)C 34a_100020639391_200000210301 [0,1,0,0,0,0|1,0,0]=2 1432 B11R1.13 CNCc1cccn(c1=O)C 207a_100102657272_100010354164 [0,1,0,0,0,0|2,0,1]=4 1433 B11R1.13 CNCc1cccn(c1=O)C 270004a_106832991635_100010354164 [0,1,0,0,0,0|2,0,1]=4 1434 B11R1.13 CNCc1ccnc(c1Br)Cl 207a_100102657272_200010064870 [0,1,0,0,0,0|3,0,0]=4 1435 B11R1.13 CNCc1ccnc(c1C)Cl 207a_100102657272_100000096011 [0,1,0,0,0,0|3,0,0]=4 1436 B11R1.13 CNCc1ccnc(c1C)Cl 270004a_106832991635_100000096011 [0,1,0,0,0,0|3,0,0]=4 1437 B11R1.13 CNCc1ccnc(c1Cl)Br 270004a_106832991635_100010171661 [0,1,0,0,0,0|3,0,0]=4 1438 B11R1.13 CNCc1ccnc(c1Cl)F 270004a_106832991635_100009856171 [0,1,0,0,0,0|3,0,0]=4 1439 B11R1.13 CNCc1cncc(c1C)Br 207a_100102657272_100010214934 [0,1,0,0,0,0|3,0,0]=4 1440 B11R1.13 CNCc1cncc(c1C)Br 270004a_106832991635_100010214934 [0,1,0,0,0,0|3,0,0]=4 1441 B11R1.13 CNCc1cncc(c1Cl)Br 207a_100102657272_100010173560 [0,1,0,0,0,0|3,0,0]=4 1442 B11R1.13 CNCc1nccc(c1C)Cl 2230a_106832991635_100020614443 [0,1,0,0,0,0|3,0,0]=4 1443 B11R1.13 CNCc1nccc(c1C)Cl 34a_100102657272_100020614443 [0,1,0,0,0,0|3,0,0]=4 1444 B11R1.13 CNCc1nccc(c1C)Cl 7a_106832991635_100020614443 [0,1,0,0,0,0|3,0,0]=4 1445 B11R1.13 CNCc1nccc(c1F)Br 270004a_106832991635_100015713984 [0,1,0,0,0,0|3,0,0]=4 1446 B11R1.13 COCc1cccc(c1Br)C 34a_100011659289_200000210301 [0,1,0,0,0,0|2,0,0]=3 1447 B11R1.13 COCc1cccc(c1Br)C 34a_100138415774_200012349612 [0,1,0,0,0,0|2,0,0]=3 1448 B11R1.13 COCc1cccc(c1Br)C 7a_100011659289_200000210301 [0,1,0,0,0,0|2,0,0]=3 1449 B11R1.13 COCc1cccc(c1Br)Cl 34a_100010168166_200000210301 [0,1,0,0,0,0|2,0,0]=3 1450 B11R1.13 COCc1cccc(c1Br)Cl 34a_100138415774_100010145525 [0,1,0,0,0,0|2,0,0]=3 1451 B11R1.13 COCc1cccc(c1Br)Cl 7a_100010168166_200000210301 [0,1,0,0,0,0|2,0,0]=3 1452 B11R1.13 COCc1cccc(c1Br)F 34a_100012351117_200000210301 [0,1,0,0,0,0|2,0,0]=3 1453 B11R1.13 COCc1cccc(c1Br)F 34a_100138415774_100012351116 [0,1,0,0,0,0|2,0,0]=3 1454 B11R1.13 COCc1cccc(c1Br)F 7a_100012351117_200000210301 [0,1,0,0,0,0|2,0,0]=3 1455 B11R1.13 COCc1cccc(c1Br)I 34a_100010240205_200000210301 [0,1,0,0,0,0|2,0,0]=3 1456 B11R1.13 COCc1cccc(c1Br)I 34a_100138415774_100010254545 [0,1,0,0,0,0|2,0,0]=3 1457 B11R1.13 COCc1cccc(c1Br)I 7a_100010240205_200000210301 [0,1,0,0,0,0|2,0,0]=3 1458 B11R1.13 COCc1cccc(c1C)Br 34a_100000694458_200000210301 [0,1,0,0,0,0|2,0,0]=3 1459 B11R1.13 COCc1cccc(c1C)Br 34a_100138415774_100000694682 [0,1,0,0,0,0|2,0,0]=3 1460 B11R1.13 COCc1cccc(c1C)Br 7a_100000694458_200000210301 [0,1,0,0,0,0|2,0,0]=3 1461 B11R1.13 COCc1cccc(c1C)C 34a_100011219135_200000210301 [0,1,0,0,0,0|2,0,0]=3 1462 B11R1.13 COCc1cccc(c1C)C 34a_100138415774_100011273979 [0,1,0,0,0,0|2,0,0]=3 1463 B11R1.13 COCc1cccc(c1C)C 7a_100011219135_200000210301 [0,1,0,0,0,0|2,0,0]=3 1464 B11R1.13 COCc1cccc(c1C)Cl 34a_100012000165_200000210301 [0,1,0,0,0,0|2,0,0]=3 1465 B11R1.13 COCc1cccc(c1C)Cl 34a_100138415774_100012186920 [0,1,0,0,0,0|2,0,0]=3 1466 B11R1.13 COCc1cccc(c1C)Cl 7a_100012000165_200000210301 [0,1,0,0,0,0|2,0,0]=3 1467 B11R1.13 COCc1cccc(c1C)F 34a_100000042775_200000210301 [0,1,0,0,0,0|2,0,0]=3 1468 B11R1.13 COCc1cccc(c1C)F 34a_100138415774_100009813626 [0,1,0,0,0,0|2,0,0]=3 1469 B11R1.13 COCc1cccc(c1C)F 7a_100000042775_200000210301 [0,1,0,0,0,0|2,0,0]=3 1470 B11R1.13 COCc1cccc(c1C)I 34a_100010150139_200000210301 [0,1,0,0,0,0|2,0,0]=3 1471 B11R1.13 COCc1cccc(c1C)I 34a_100138415774_100010150147 [0,1,0,0,0,0|2,0,0]=3 1472 B11R1.13 COCc1cccc(c1C)I 7a_100010150139_200000210301 [0,1,0,0,0,0|2,0,0]=3 1473 B11R1.13 COCc1cccc(c1C)N 34a_102495339961_200000210301 [0,1,0,0,0,0|2,0,0]=3 1474 B11R1.13 COCc1cccc(c1C)N 7a_102495339961_200000210301 [0,1,0,0,0,0|2,0,0]=3 1475 B11R1.13 COCc1cccc(c1C)O 271570a_203496583355_100102485947 [0,1,0,0,0,0|2,0,0]=3 1476 B11R1.13 COCc1cccc(c1Cl)Br 34a_100012351182_200000210301 [0,1,0,0,0,0|2,0,0]=3 1477 B11R1.13 COCc1cccc(c1Cl)Br 34a_100138415774_100012349491 [0,1,0,0,0,0|2,0,0]=3 1478 B11R1.13 COCc1cccc(c1Cl)Br 7a_100012351182_200000210301 [0,1,0,0,0,0|2,0,0]=3 1479 B11R1.13 COCc1cccc(c1Cl)C 34a_100000710031_200000210301 [0,1,0,0,0,0|2,0,0]=3 1480 B11R1.13 COCc1cccc(c1Cl)C 7a_100000710031_200000210301 [0,1,0,0,0,0|2,0,0]=3 1481 B11R1.13 COCc1cccc(c1Cl)Cl 34a_100000720469_200000210301 [0,1,0,0,0,0|2,0,0]=3 1482 B11R1.13 COCc1cccc(c1Cl)Cl 34a_100138415774_100000723366 [0,1,0,0,0,0|2,0,0]=3 1483 B11R1.13 COCc1cccc(c1Cl)Cl 7a_100000720469_200000210301 [0,1,0,0,0,0|2,0,0]=3 1484 B11R1.13 COCc1cccc(c1Cl)F 34a_100000696319_200000210301 [0,1,0,0,0,0|2,0,0]=3 1485 B11R1.13 COCc1cccc(c1Cl)F 34a_100138415774_100000696688 [0,1,0,0,0,0|2,0,0]=3 1486 B11R1.13 COCc1cccc(c1Cl)F 7a_100000696319_200000210301 [0,1,0,0,0,0|2,0,0]=3 1487 B11R1.13 COCc1cccc(c1F)Br 34a_100011935076_200000210301 [0,1,0,0,0,0|2,0,0]=3 1488 B11R1.13 COCc1cccc(c1F)Br 34a_100138415774_100012356506 [0,1,0,0,0,0|2,0,0]=3 1489 B11R1.13 COCc1cccc(c1F)Br 7a_100011935076_200000210301 [0,1,0,0,0,0|2,0,0]=3 1490 B11R1.13 COCc1cccc(c1F)C 34a_100138415774_100011216058 [0,1,0,0,0,0|2,0,0]=3 1491 B11R1.13 COCc1cccc(c1F)C 34a_200011219517_200000210301 [0,1,0,0,0,0|2,0,0]=3 1492 B11R1.13 COCc1cccc(c1F)C 7a_200011219517_200000210301 [0,1,0,0,0,0|2,0,0]=3 1493 B11R1.13 COCc1cccc(c1F)Cl 34a_100011216988_200000210301 [0,1,0,0,0,0|2,0,0]=3 1494 B11R1.13 COCc1cccc(c1F)Cl 34a_100138415774_100000716733 [0,1,0,0,0,0|2,0,0]=3 1495 B11R1.13 COCc1cccc(c1F)Cl 7a_100011216988_200000210301 [0,1,0,0,0,0|2,0,0]=3 1496 B11R1.13 COCc1cccc(c1F)F 34a_100011218644_200000210301 [0,1,0,0,0,0|2,0,0]=3 1497 B11R1.13 COCc1cccc(c1F)F 34a_100138415774_100000217499 [0,1,0,0,0,0|2,0,0]=3 1498 B11R1.13 COCc1cccc(c1F)F 7a_100011218644_200000210301 [0,1,0,0,0,0|2,0,0]=3 1499 B11R1.13 COCc1cccc(c1F)I 34a_200010235739_200000210301 [0,1,0,0,0,0|2,0,0]=3 1500 B11R1.13 COCc1cccc(c1F)I 7a_200010235739_200000210301 [0,1,0,0,0,0|2,0,0]=3 1501 B11R1.13 COCc1cccc(c1F)N 34a_100012023829_200000210301 [0,1,0,0,0,0|2,0,0]=3 1502 B11R1.13 COCc1cccc(c1I)Br 34a_100010146604_200000210301 [0,1,0,0,0,0|2,0,0]=3 1503 B11R1.13 COCc1cccc(c1I)Br 7a_100010146604_200000210301 [0,1,0,0,0,0|2,0,0]=3 1504 B11R1.13 COCc1cccc(c1I)C 34a_100012349780_200000210301 [0,1,0,0,0,0|2,0,0]=3 1505 B11R1.13 COCc1cccc(c1I)C 7a_100012349780_200000210301 [0,1,0,0,0,0|2,0,0]=3 1506 B11R1.13 COCc1cccc(c1I)F 34a_100000692438_200000210301 [0,1,0,0,0,0|2,0,0]=3 1507 B11R1.13 COCc1cccc(c1I)F 34a_100138415774_100010149603 [0,1,0,0,0,0|2,0,0]=3 1508 B11R1.13 COCc1cccc(c1I)F 7a_100000692438_200000210301 [0,1,0,0,0,0|2,0,0]=3 1509 B11R1.13 COCc1cccc(c1N)Br 34a_100012349457_200000210301 [0,1,0,0,0,0|2,0,0]=3 1510 B11R1.13 COCc1cccc(c1N)C 34a_100011215590_200000210301 [0,1,0,0,0,0|2,0,0]=3 1511 B11R1.13 COCc1cccc(c1N)Cl 34a_100012182729_200000210301 [0,1,0,0,0,0|2,0,0]=3 1512 B11R1.13 COCc1cccc(c1N)F 34a_100000692437_200000210301 [0,1,0,0,0,0|2,0,0]=3 1513 B11R1.13 COCc1ccnc(c1F)Br 34a_100010065242_200000210301 [0,1,0,0,0,0|3,0,0]=4 1514 B11R1.13 COCc1ccnc(c1F)Br 7a_100010065242_200000210301 [0,1,0,0,0,0|3,0,0]=4 1515 B11R1.13 COCc1ccnc(c1F)Cl 34a_100000101314_200000210301 [0,1,0,0,0,0|3,0,0]=4 1516 B11R1.13 COCc1ccnc(c1F)Cl 7a_100000101314_200000210301 [0,1,0,0,0,0|3,0,0]=4 1517 B11R1.13 COCc1nccc(c1C)Cl 34a_100138415774_100020614443 [0,1,0,0,0,0|3,0,0]=4 1518 B11R1.13 CSCc1cccc(c1Br)C 62a_200000210301_200012349612 [0,1,0,0,0,0|2,0,0]=3 1519 B11R1.13 CSCc1cccc(c1Br)C 62a_200012349612_200000210301 [0,1,0,0,0,0|2,0,0]=3 1520 B11R1.13 CSCc1cccc(c1Br)Cl 62a_100010145525_200000210301 [0,1,0,0,0,0|2,0,0]=3 1521 B11R1.13 CSCc1cccc(c1Br)Cl 62a_200000210301_100010145525 [0,1,0,0,0,0|2,0,0]=3 1522 B11R1.13 CSCc1cccc(c1Br)F 62a_100012351116_200000210301 [0,1,0,0,0,0|2,0,0]=3 1523 B11R1.13 CSCc1cccc(c1Br)F 62a_200000210301_100012351116 [0,1,0,0,0,0|2,0,0]=3 1524 B11R1.13 CSCc1cccc(c1Br)I 62a_100010254545_200000210301 [0,1,0,0,0,0|2,0,0]=3 1525 B11R1.13 CSCc1cccc(c1Br)I 62a_200000210301_100010254545 [0,1,0,0,0,0|2,0,0]=3 1526 B11R1.13 CSCc1cccc(c1C)Br 62a_100000694682_200000210301 [0,1,0,0,0,0|2,0,0]=3 1527 B11R1.13 CSCc1cccc(c1C)Br 62a_200000210301_100000694682 [0,1,0,0,0,0|2,0,0]=3 1528 B11R1.13 CSCc1cccc(c1C)C 62a_100011515928_200000210301 [0,1,0,0,0,0|2,0,0]=3 1529 B11R1.13 CSCc1cccc(c1C)C 62a_200000210301_100011515928 [0,1,0,0,0,0|2,0,0]=3 1530 B11R1.13 CSCc1cccc(c1C)Cl 62a_100012186920_200000210301 [0,1,0,0,0,0|2,0,0]=3 1531 B11R1.13 CSCc1cccc(c1C)Cl 62a_200000210301_100012186920 [0,1,0,0,0,0|2,0,0]=3 1532 B11R1.13 CSCc1cccc(c1C)F 62a_100009813626_200000210301 [0,1,0,0,0,0|2,0,0]=3 1533 B11R1.13 CSCc1cccc(c1C)F 62a_200000210301_100009813626 [0,1,0,0,0,0|2,0,0]=3 1534 B11R1.13 CSCc1cccc(c1C)I 62a_100010150147_200000210301 [0,1,0,0,0,0|2,0,0]=3 1535 B11R1.13 CSCc1cccc(c1C)I 62a_200000210301_100010150147 [0,1,0,0,0,0|2,0,0]=3 1536 B11R1.13 CSCc1cccc(c1Cl)Br 62a_100012349491_200000210301 [0,1,0,0,0,0|2,0,0]=3 1537 B11R1.13 CSCc1cccc(c1Cl)Br 62a_200000210301_100012349491 [0,1,0,0,0,0|2,0,0]=3 1538 B11R1.13 CSCc1cccc(c1Cl)Cl 62a_100000720918_200000210301 [0,1,0,0,0,0|2,0,0]=3 1539 B11R1.13 CSCc1cccc(c1Cl)Cl 62a_200000210301_100000723366 [0,1,0,0,0,0|2,0,0]=3 1540 B11R1.13 CSCc1cccc(c1Cl)F 62a_100000696688_200000210301 [0,1,0,0,0,0|2,0,0]=3 1541 B11R1.13 CSCc1cccc(c1Cl)F 62a_200000210301_100000696688 [0,1,0,0,0,0|2,0,0]=3 1542 B11R1.13 CSCc1cccc(c1F)Br 62a_100012356506_200000210301 [0,1,0,0,0,0|2,0,0]=3 1543 B11R1.13 CSCc1cccc(c1F)Br 62a_200000210301_100012356506 [0,1,0,0,0,0|2,0,0]=3 1544 B11R1.13 CSCc1cccc(c1F)C 62a_100011216058_200000210301 [0,1,0,0,0,0|2,0,0]=3 1545 B11R1.13 CSCc1cccc(c1F)C 62a_200000210301_100011216058 [0,1,0,0,0,0|2,0,0]=3 1546 B11R1.13 CSCc1cccc(c1F)Cl 62a_100000716733_200000210301 [0,1,0,0,0,0|2,0,0]=3 1547 B11R1.13 CSCc1cccc(c1F)Cl 62a_200000210301_100000716733 [0,1,0,0,0,0|2,0,0]=3 1548 B11R1.13 CSCc1cccc(c1F)F 62a_100000217499_200000210301 [0,1,0,0,0,0|2,0,0]=3 1549 B11R1.13 CSCc1cccc(c1F)F 62a_200000210301_100000217499 [0,1,0,0,0,0|2,0,0]=3 1550 B11R1.13 CSCc1cccc(c1I)F 62a_100010149603_200000210301 [0,1,0,0,0,0|2,0,0]=3 1551 B11R1.13 CSCc1cccc(c1I)F 62a_200000210301_100010149603 [0,1,0,0,0,0|2,0,0]=3 1552 B11R1.13 CSCc1nccc(c1C)Cl 62a_100020614443_200000210301 [0,1,0,0,0,0|3,0,0]=4 1553 B11R1.13 CSCc1nccc(c1C)Cl 62a_200000210301_100020614443 [0,1,0,0,0,0|3,0,0]=4 1554 B11R1.13 Cc1c(cccc1CC#N)O 271570a_203496583355_100010147028 [0,1,0,0,0,0|2,0,1]=4 1555 B11R1.13 Cc1c(cccc1CCN)O 271570a_203496583355_100161000114 [0,1,0,0,0,0|2,0,0]=3 1556 B11R1.13 Cc1c(cccc1CN[13CH3])Br 34a_100000724210_200025704644 [0,1,0,0,0,0|2,0,0]=3 1557 B11R1.13 Cc1c(cccc1CN[13CH3])Cl 2230a_100020639605_200025704644 [0,1,0,0,0,0|2,0,0]=3 1558 B11R1.13 Cc1c(cccc1CN[13CH3])Cl 34a_100020639605_200025704644 [0,1,0,0,0,0|2,0,0]=3 1559 B11R1.13 Cc1c(cccc1CN[13CH3])F 2230a_100132306986_200025704644 [0,1,0,0,0,0|2,0,0]=3 1560 B11R1.13 Cc1c(cccc1CN[13CH3])F 34a_100132306986_200025704644 [0,1,0,0,0,0|2,0,0]=3 1561 B11R1.13 Cc1c(cccc1CO[13CH3])Br 34a_100000694458_200025704644 [0,1,0,0,0,0|2,0,0]=3 1562 B11R1.13 Cc1c(cccc1CO[13CH3])Br 7a_100000694458_200025704644 [0,1,0,0,0,0|2,0,0]=3 1563 B11R1.13 Cc1c(cccc1CO[13CH3])Cl 34a_100012000165_200025704644 [0,1,0,0,0,0|2,0,0]=3 1564 B11R1.13 Cc1c(cccc1CO[13CH3])Cl 7a_100012000165_200025704644 [0,1,0,0,0,0|2,0,0]=3 1565 B11R1.13 Cc1c(cccc1CO[13CH3])F 34a_100000042775_200025704644 [0,1,0,0,0,0|2,0,0]=3 1566 B11R1.13 Cc1c(cccc1CO[13CH3])F 7a_100000042775_200025704644 [0,1,0,0,0,0|2,0,0]=3 1567 B11R1.13 Cc1c(cccc1CO[13CH3])I 34a_100010150139_200025704644 [0,1,0,0,0,0|2,0,0]=3 1568 B11R1.13 Cc1c(cccc1CO[13CH3])I 7a_100010150139_200025704644 [0,1,0,0,0,0|2,0,0]=3 1569 B11R1.13 Cc1c(cccc1CO[13CH3])N 34a_102495339961_200025704644 [0,1,0,0,0,0|2,0,0]=3 1570 B11R1.13 Cc1c(cccc1CO[13CH3])N 7a_102495339961_200025704644 [0,1,0,0,0,0|2,0,0]=3 1571 B11R1.13 Cc1c(cccc1CS[13CH3])Br 62a_100000694682_200025704644 [0,1,0,0,0,0|2,0,0]=3 1572 B11R1.13 Cc1c(cccc1CS[13CH3])Br 62a_200025704644_100000694682 [0,1,0,0,0,0|2,0,0]=3 1573 B11R1.13 Cc1c(cccc1CS[13CH3])Cl 62a_100012186920_200025704644 [0,1,0,0,0,0|2,0,0]=3 1574 B11R1.13 Cc1c(cccc1CS[13CH3])Cl 62a_200025704644_100012186920 [0,1,0,0,0,0|2,0,0]=3 1575 B11R1.13 Cc1c(cccc1CS[13CH3])F 62a_100009813626_200025704644 [0,1,0,0,0,0|2,0,0]=3 1576 B11R1.13 Cc1c(cccc1CS[13CH3])F 62a_200025704644_100009813626 [0,1,0,0,0,0|2,0,0]=3 1577 B11R1.13 Cc1c(cccc1CS[13CH3])I 62a_100010150147_200025704644 [0,1,0,0,0,0|2,0,0]=3 1578 B11R1.13 Cc1c(cccc1CS[13CH3])I 62a_200025704644_100010150147 [0,1,0,0,0,0|2,0,0]=3 1579 B11R1.13 Cc1c(cccc1NCF)Br 34a_100000750434_100015361967 [0,1,0,0,0,0|3,0,0]=4 1580 B11R1.13 Cc1c(cccc1NCF)Cl 34a_100000210441_100015361967 [0,1,0,0,0,0|3,0,0]=4 1581 B11R1.13 Cc1c(cccc1NCF)Cl 7a_100000210441_100015361967 [0,1,0,0,0,0|3,0,0]=4 1582 B11R1.13 Cc1c(cccc1NCF)F 34a_100000745574_100015361967 [0,1,0,0,0,0|3,0,0]=4 1583 B11R1.13 Cc1c(cccc1NCF)F 7a_100000745574_100015361967 [0,1,0,0,0,0|3,0,0]=4 1584 B11R1.13 Cc1c(cccc1NCF)I 34a_100000761887_100015361967 [0,1,0,0,0,0|3,0,0]=4 1585 B11R1.13 Cc1c(cccc1NCF)O 34a_100011216573_100015361967 [0,1,0,0,0,0|3,0,0]=4 1586 B11R1.13 Cc1c(cccc1NCF)O 7a_100011216573_100015361967 [0,1,0,0,0,0|3,0,0]=4 1587 B11R1.13 Cc1c(cccc1OCF)Br 34a_100012002258_100015361967 [0,1,0,0,0,0|3,0,0]=4 1588 B11R1.13 Cc1c(cccc1OCF)Br 7a_100012002258_100015361967 [0,1,0,0,0,0|3,0,0]=4 1589 B11R1.13 Cc1c(cccc1OCF)Cl 34a_100011265684_100015361967 [0,1,0,0,0,0|3,0,0]=4 1590 B11R1.13 Cc1c(cccc1OCF)Cl 7a_100011265684_100015361967 [0,1,0,0,0,0|3,0,0]=4 1591 B11R1.13 Cc1c(cccc1OCF)F 34a_100011217231_100015361967 [0,1,0,0,0,0|3,0,0]=4 1592 B11R1.13 Cc1c(cccc1OCF)F 7a_100011217231_100015361967 [0,1,0,0,0,0|3,0,0]=4 1593 B11R1.13 Cc1c(cccc1OCF)N 34a_100011216573_100015361967 [0,1,0,0,0,0|3,0,0]=4 1594 B11R1.13 Cc1c(cccc1OCF)N 7a_100011216573_100015361967 [0,1,0,0,0,0|3,0,0]=4 1595 B11R1.13 Cc1c(cccc1SCF)Br 62a_100012353703_100015361967 [0,1,0,0,0,0|3,0,0]=4 1596 B11R1.13 Cc1c(cccc1SCF)Br 62a_100015361967_100012353703 [0,1,0,0,0,0|3,0,0]=4 1597 B11R1.13 Cc1c(cccc1SCF)Cl 62a_100000726075_100015361967 [0,1,0,0,0,0|3,0,0]=4 1598 B11R1.13 Cc1c(cccc1SCF)Cl 62a_100015361967_100000726075 [0,1,0,0,0,0|3,0,0]=4 1599 B11R1.13 Cc1c(cccc1SCF)F 62a_100011216893_100015361967 [0,1,0,0,0,0|3,0,0]=4 1600 B11R1.13 Cc1c(cccc1SCF)F 62a_100015361967_100011216893 [0,1,0,0,0,0|3,0,0]=4 1601 B11R1.13 Cc1c(cccc1SCF)N 62a_100000761887_100015361967 [0,1,0,0,0,0|3,0,0]=4 1602 B11R1.13 Cc1c(cccc1SCF)N 62a_100015361967_100000761887 [0,1,0,0,0,0|3,0,0]=4 1603 B11R1.13 Cc1c(cccc1SCF)O 62a_100012002258_100015361967 [0,1,0,0,0,0|3,0,0]=4 1604 B11R1.13 Cc1c(cccc1SCF)O 62a_100015361967_100012002258 [0,1,0,0,0,0|3,0,0]=4 1605 B11R1.13 Cc1c(ccnc1CS[13CH3])Cl 62a_100020614443_200025704644 [0,1,0,0,0,0|3,0,0]=4 1606 B11R1.13 Cc1c(ccnc1CS[13CH3])Cl 62a_200025704644_100020614443 [0,1,0,0,0,0|3,0,0]=4 1607 B11R1.13 Cc1cccc(c1Br)CO[13CH3] 34a_100011659289_200025704644 [0,1,0,0,0,0|2,0,0]=3 1608 B11R1.13 Cc1cccc(c1Br)CO[13CH3] 7a_100011659289_200025704644 [0,1,0,0,0,0|2,0,0]=3 1609 B11R1.13 Cc1cccc(c1Br)CS[13CH3] 62a_200012349612_200025704644 [0,1,0,0,0,0|2,0,0]=3 1610 B11R1.13 Cc1cccc(c1Br)CS[13CH3] 62a_200025704644_200012349612 [0,1,0,0,0,0|2,0,0]=3 1611 B11R1.13 Cc1cccc(c1Br)NCF 34a_100000684715_100015361967 [0,1,0,0,0,0|3,0,0]=4 1612 B11R1.13 Cc1cccc(c1Br)OCF 34a_100000686692_100015361967 [0,1,0,0,0,0|3,0,0]=4 1613 B11R1.13 Cc1cccc(c1Br)OCF 7a_100000686692_100015361967 [0,1,0,0,0,0|3,0,0]=4 1614 B11R1.13 Cc1cccc(c1Br)SCF 62a_100012362457_100015361967 [0,1,0,0,0,0|3,0,0]=4 1615 B11R1.13 Cc1cccc(c1Br)SCF 62a_100015361967_100012362457 [0,1,0,0,0,0|3,0,0]=4 1616 B11R1.13 Cc1cccc(c1C)CN[13CH3] 2230a_100011211637_200025704644 [0,1,0,0,0,0|2,0,0]=3 1617 B11R1.13 Cc1cccc(c1C)CN[13CH3] 34a_100011211637_200025704644 [0,1,0,0,0,0|2,0,0]=3 1618 B11R1.13 Cc1cccc(c1C)CO[13CH3] 34a_100011219135_200025704644 [0,1,0,0,0,0|2,0,0]=3 1619 B11R1.13 Cc1cccc(c1C)CO[13CH3] 7a_100011219135_200025704644 [0,1,0,0,0,0|2,0,0]=3 1620 B11R1.13 Cc1cccc(c1C)CS[13CH3] 62a_100011515928_200025704644 [0,1,0,0,0,0|2,0,0]=3 1621 B11R1.13 Cc1cccc(c1C)CS[13CH3] 62a_200025704644_100011515928 [0,1,0,0,0,0|2,0,0]=3 1622 B11R1.13 Cc1cccc(c1C)NCF 34a_100000210026_100015361967 [0,1,0,0,0,0|3,0,0]=4 1623 B11R1.13 Cc1cccc(c1C)NCF 7a_100000210026_100015361967 [0,1,0,0,0,0|3,0,0]=4 1624 B11R1.13 Cc1cccc(c1C)OCF 34a_100000185855_100015361967 [0,1,0,0,0,0|3,0,0]=4 1625 B11R1.13 Cc1cccc(c1C)OCF 7a_100000185855_100015361967 [0,1,0,0,0,0|3,0,0]=4 1626 B11R1.13 Cc1cccc(c1C)SCF 62a_100011214922_100015361967 [0,1,0,0,0,0|3,0,0]=4 1627 B11R1.13 Cc1cccc(c1C)SCF 62a_100015361967_100011214922 [0,1,0,0,0,0|3,0,0]=4 1628 B11R1.13 Cc1cccc(c1Cl)CN[13CH3] 2230a_100025705714_200025704644 [0,1,0,0,0,0|2,0,0]=3 1629 B11R1.13 Cc1cccc(c1Cl)CN[13CH3] 34a_100025705714_200025704644 [0,1,0,0,0,0|2,0,0]=3 1630 B11R1.13 Cc1cccc(c1Cl)CO[13CH3] 34a_100000710031_200025704644 [0,1,0,0,0,0|2,0,0]=3 1631 B11R1.13 Cc1cccc(c1Cl)CO[13CH3] 7a_100000710031_200025704644 [0,1,0,0,0,0|2,0,0]=3 1632 B11R1.13 Cc1cccc(c1Cl)NCF 34a_100000765562_100015361967 [0,1,0,0,0,0|3,0,0]=4 1633 B11R1.13 Cc1cccc(c1Cl)NCF 7a_100000765562_100015361967 [0,1,0,0,0,0|3,0,0]=4 1634 B11R1.13 Cc1cccc(c1Cl)OCF 34a_100000695629_100015361967 [0,1,0,0,0,0|3,0,0]=4 1635 B11R1.13 Cc1cccc(c1Cl)OCF 7a_100000695629_100015361967 [0,1,0,0,0,0|3,0,0]=4 1636 B11R1.13 Cc1cccc(c1Cl)SCF 62a_100015361967_200012352035 [0,1,0,0,0,0|3,0,0]=4 1637 B11R1.13 Cc1cccc(c1Cl)SCF 62a_200012352035_100015361967 [0,1,0,0,0,0|3,0,0]=4 1638 B11R1.13 Cc1cccc(c1F)CN[13CH3] 2230a_100012002060_200025704644 [0,1,0,0,0,0|2,0,0]=3 1639 B11R1.13 Cc1cccc(c1F)CN[13CH3] 34a_100012002060_200025704644 [0,1,0,0,0,0|2,0,0]=3 1640 B11R1.13 Cc1cccc(c1F)CO[13CH3] 34a_200011219517_200025704644 [0,1,0,0,0,0|2,0,0]=3 1641 B11R1.13 Cc1cccc(c1F)CO[13CH3] 7a_200011219517_200025704644 [0,1,0,0,0,0|2,0,0]=3 1642 B11R1.13 Cc1cccc(c1F)CS[13CH3] 62a_100011216058_200025704644 [0,1,0,0,0,0|2,0,0]=3 1643 B11R1.13 Cc1cccc(c1F)CS[13CH3] 62a_200025704644_100011216058 [0,1,0,0,0,0|2,0,0]=3 1644 B11R1.13 Cc1cccc(c1F)NCF 34a_100000697159_100015361967 [0,1,0,0,0,0|3,0,0]=4 1645 B11R1.13 Cc1cccc(c1F)NCF 7a_100000697159_100015361967 [0,1,0,0,0,0|3,0,0]=4 1646 B11R1.13 Cc1cccc(c1F)OCF 34a_100000751311_100015361967 [0,1,0,0,0,0|3,0,0]=4 1647 B11R1.13 Cc1cccc(c1F)OCF 7a_100000751311_100015361967 [0,1,0,0,0,0|3,0,0]=4 1648 B11R1.13 Cc1cccc(c1F)SCF 62a_100000717567_100015361967 [0,1,0,0,0,0|3,0,0]=4 1649 B11R1.13 Cc1cccc(c1F)SCF 62a_100015361967_100000717567 [0,1,0,0,0,0|3,0,0]=4 1650 B11R1.13 Cc1cccc(c1I)CO[13CH3] 34a_100012349780_200025704644 [0,1,0,0,0,0|2,0,0]=3 1651 B11R1.13 Cc1cccc(c1I)CO[13CH3] 7a_100012349780_200025704644 [0,1,0,0,0,0|2,0,0]=3 1652 B11R1.13 Cc1cccc(c1I)NCF 34a_100000761888_100015361967 [0,1,0,0,0,0|3,0,0]=4 1653 B11R1.13 Cc1cccc(c1I)OCF 34a_100010083724_100015361967 [0,1,0,0,0,0|3,0,0]=4 1654 B11R1.13 Cc1cccc(c1I)OCF 7a_100010083724_100015361967 [0,1,0,0,0,0|3,0,0]=4 1655 B11R1.13 Cc1cccc(c1N)CO[13CH3] 34a_100011215590_200025704644 [0,1,0,0,0,0|2,0,0]=3 1656 B11R1.13 Cc1cccc(c1N)OCF 34a_100000743429_100015361967 [0,1,0,0,0,0|3,0,0]=4 1657 B11R1.13 Cc1cccc(c1N)OCF 7a_100000743429_100015361967 [0,1,0,0,0,0|3,0,0]=4 1658 B11R1.13 Cc1cccc(c1N)SCF 62a_100011834072_100015361967 [0,1,0,0,0,0|3,0,0]=4 1659 B11R1.13 Cc1cccc(c1N)SCF 62a_100015361967_100011834072 [0,1,0,0,0,0|3,0,0]=4 1660 B11R1.13 Cc1cccc(c1O)CC#N 271570a_203496583355_100010147024 [0,1,0,0,0,0|1,0,1]=3 1661 B11R1.13 Cc1cccc(c1O)CN[13CH3] 34a_100020639391_200025704644 [0,1,0,0,0,0|1,0,0]=2 1662 B11R1.13 Cc1cccc(c1O)NCF 34a_100000756359_100015361967 [0,1,0,0,0,0|2,0,0]=3 1663 B11R1.13 Cc1cccc(c1O)SCF 62a_100009817157_100015361967 [0,1,0,0,0,0|2,0,0]=3 1664 B11R1.13 Cc1cccc(c1O)SCF 62a_100015361967_100009817157 [0,1,0,0,0,0|2,0,0]=3 1665 B11R1.13 Cc1ccnc(c1O)SCF 62a_100015361967_100000696282 [0,1,0,0,0,0|3,0,0]=4 1666 B11R1.13 FCNc1cccc(c1Br)Cl 34a_100000687072_100015361967 [0,1,0,0,0,0|3,0,0]=4 1667 B11R1.13 FCNc1cccc(c1Br)F 34a_100011934729_100015361967 [0,1,0,0,0,0|3,0,0]=4 1668 B11R1.13 FCNc1cccc(c1Cl)Br 34a_100000687075_100015361967 [0,1,0,0,0,0|3,0,0]=4 1669 B11R1.13 FCNc1cccc(c1Cl)Cl 34a_100000185733_100015361967 [0,1,0,0,0,0|3,0,0]=4 1670 B11R1.13 FCNc1cccc(c1Cl)F 34a_100000692321_100015361967 [0,1,0,0,0,0|3,0,0]=4 1671 B11R1.13 FCNc1cccc(c1F)Br 34a_100011935091_100015361967 [0,1,0,0,0,0|3,0,0]=4 1672 B11R1.13 FCNc1cccc(c1F)Cl 34a_100000199060_100015361967 [0,1,0,0,0,0|3,0,0]=4 1673 B11R1.13 FCNc1cccc(c1F)F 34a_100000743855_100015361967 [0,1,0,0,0,0|3,0,0]=4 1674 B11R1.13 FCNc1cccc(c1I)Br 34a_100020590159_100015361967 [0,1,0,0,0,0|3,0,0]=4 1675 B11R1.13 FCNc1cccc(c1I)Cl 34a_100000049713_100015361967 [0,1,0,0,0,0|3,0,0]=4 1676 B11R1.13 FCNc1cccc(c1I)F 34a_100000690935_100015361967 [0,1,0,0,0,0|3,0,0]=4 1677 B11R1.13 FCOc1cccc(c1Br)Br 34a_100010187966_100015361967 [0,1,0,0,0,0|3,0,0]=4 1678 B11R1.13 FCOc1cccc(c1Br)Br 7a_100010187966_100015361967 [0,1,0,0,0,0|3,0,0]=4 1679 B11R1.13 FCOc1cccc(c1Br)Cl 34a_100012348804_100015361967 [0,1,0,0,0,0|3,0,0]=4 1680 B11R1.13 FCOc1cccc(c1Br)Cl 7a_100012348804_100015361967 [0,1,0,0,0,0|3,0,0]=4 1681 B11R1.13 FCOc1cccc(c1Br)F 34a_100009820682_100015361967 [0,1,0,0,0,0|3,0,0]=4 1682 B11R1.13 FCOc1cccc(c1Br)F 7a_100009820682_100015361967 [0,1,0,0,0,0|3,0,0]=4 1683 B11R1.13 FCOc1cccc(c1Br)I 34a_100010187914_100015361967 [0,1,0,0,0,0|3,0,0]=4 1684 B11R1.13 FCOc1cccc(c1Br)I 7a_100010187914_100015361967 [0,1,0,0,0,0|3,0,0]=4 1685 B11R1.13 FCOc1cccc(c1Cl)Br 34a_100010187913_100015361967 [0,1,0,0,0,0|3,0,0]=4 1686 B11R1.13 FCOc1cccc(c1Cl)Br 7a_100010187913_100015361967 [0,1,0,0,0,0|3,0,0]=4 1687 B11R1.13 FCOc1cccc(c1Cl)Cl 34a_100000211076_100015361967 [0,1,0,0,0,0|3,0,0]=4 1688 B11R1.13 FCOc1cccc(c1Cl)Cl 7a_100000211076_100015361967 [0,1,0,0,0,0|3,0,0]=4 1689 B11R1.13 FCOc1cccc(c1Cl)F 34a_100000087408_100015361967 [0,1,0,0,0,0|3,0,0]=4 1690 B11R1.13 FCOc1cccc(c1Cl)F 7a_100000087408_100015361967 [0,1,0,0,0,0|3,0,0]=4 1691 B11R1.13 FCOc1cccc(c1Cl)I 34a_100000049636_100015361967 [0,1,0,0,0,0|3,0,0]=4 1692 B11R1.13 FCOc1cccc(c1Cl)I 7a_100000049636_100015361967 [0,1,0,0,0,0|3,0,0]=4 1693 B11R1.13 FCOc1cccc(c1F)Br 34a_100009817021_100015361967 [0,1,0,0,0,0|3,0,0]=4 1694 B11R1.13 FCOc1cccc(c1F)Br 7a_100009817021_100015361967 [0,1,0,0,0,0|3,0,0]=4 1695 B11R1.13 FCOc1cccc(c1F)Cl 34a_100000687438_100015361967 [0,1,0,0,0,0|3,0,0]=4 1696 B11R1.13 FCOc1cccc(c1F)Cl 7a_100000687438_100015361967 [0,1,0,0,0,0|3,0,0]=4 1697 B11R1.13 FCOc1cccc(c1F)F 34a_100000751161_100015361967 [0,1,0,0,0,0|3,0,0]=4 1698 B11R1.13 FCOc1cccc(c1F)F 7a_100000751161_100015361967 [0,1,0,0,0,0|3,0,0]=4 1699 B11R1.13 FCOc1cccc(c1I)Br 34a_100010187912_100015361967 [0,1,0,0,0,0|3,0,0]=4 1700 B11R1.13 FCOc1cccc(c1I)Br 7a_100010187912_100015361967 [0,1,0,0,0,0|3,0,0]=4 1701 B11R1.13 FCOc1cccc(c1I)Cl 34a_100000050174_100015361967 [0,1,0,0,0,0|3,0,0]=4 1702 B11R1.13 FCOc1cccc(c1I)Cl 7a_100000050174_100015361967 [0,1,0,0,0,0|3,0,0]=4 1703 B11R1.13 FCOc1cccc(c1I)F 34a_100000690913_100015361967 [0,1,0,0,0,0|3,0,0]=4 1704 B11R1.13 FCOc1cccc(c1I)F 7a_100000690913_100015361967 [0,1,0,0,0,0|3,0,0]=4 1705 B11R1.13 FCSc1cccc(c1Br)Br 62a_100010175083_100015361967 [0,1,0,0,0,0|3,0,0]=4 1706 B11R1.13 FCSc1cccc(c1Br)Br 62a_100015361967_100010175083 [0,1,0,0,0,0|3,0,0]=4 1707 B11R1.13 FCSc1cccc(c1Br)Cl 62a_100014021842_100015361967 [0,1,0,0,0,0|3,0,0]=4 1708 B11R1.13 FCSc1cccc(c1Br)Cl 62a_100015361967_100014021842 [0,1,0,0,0,0|3,0,0]=4 1709 B11R1.13 FCSc1cccc(c1Br)F 62a_100010202630_100015361967 [0,1,0,0,0,0|3,0,0]=4 1710 B11R1.13 FCSc1cccc(c1Br)F 62a_100015361967_100010202630 [0,1,0,0,0,0|3,0,0]=4 1711 B11R1.13 FCSc1cccc(c1Cl)Br 62a_100010142854_100015361967 [0,1,0,0,0,0|3,0,0]=4 1712 B11R1.13 FCSc1cccc(c1Cl)Br 62a_100015361967_100010142854 [0,1,0,0,0,0|3,0,0]=4 1713 B11R1.13 FCSc1cccc(c1Cl)Cl 62a_100011215384_100015361967 [0,1,0,0,0,0|3,0,0]=4 1714 B11R1.13 FCSc1cccc(c1Cl)Cl 62a_100015361967_100011215384 [0,1,0,0,0,0|3,0,0]=4 1715 B11R1.13 FCSc1cccc(c1Cl)F 62a_100015361967_200010234923 [0,1,0,0,0,0|3,0,0]=4 1716 B11R1.13 FCSc1cccc(c1Cl)F 62a_200010234923_100015361967 [0,1,0,0,0,0|3,0,0]=4 1717 B11R1.13 FCSc1cccc(c1F)Br 62a_100000702267_100015361967 [0,1,0,0,0,0|3,0,0]=4 1718 B11R1.13 FCSc1cccc(c1F)Br 62a_100015361967_100000702267 [0,1,0,0,0,0|3,0,0]=4 1719 B11R1.13 FCSc1cccc(c1F)Cl 62a_100011217346_100015361967 [0,1,0,0,0,0|3,0,0]=4 1720 B11R1.13 FCSc1cccc(c1F)Cl 62a_100015361967_100011217346 [0,1,0,0,0,0|3,0,0]=4 1721 B11R1.13 FCSc1cccc(c1F)F 62a_100000694657_100015361967 [0,1,0,0,0,0|3,0,0]=4 1722 B11R1.13 FCSc1cccc(c1F)F 62a_100015361967_100000694657 [0,1,0,0,0,0|3,0,0]=4 1723 B11R1.13 N#CCc1cccc(c1F)O 271570a_203496583355_100009817020 [0,1,0,0,0,0|2,0,1]=4 1724 B11R1.13 Nc1c(cccc1OCF)Br 34a_100011934926_100015361967 [0,1,0,0,0,0|3,0,0]=4 1725 B11R1.13 Nc1c(cccc1OCF)Br 7a_100011934926_100015361967 [0,1,0,0,0,0|3,0,0]=4 1726 B11R1.13 Nc1c(cccc1OCF)Cl 34a_100012022510_100015361967 [0,1,0,0,0,0|3,0,0]=4 1727 B11R1.13 Nc1c(cccc1OCF)Cl 7a_100012022510_100015361967 [0,1,0,0,0,0|3,0,0]=4 1728 B11R1.13 Nc1c(cccc1OCF)F 34a_100020591140_100015361967 [0,1,0,0,0,0|3,0,0]=4 1729 B11R1.13 Nc1c(cccc1OCF)F 7a_100020591140_100015361967 [0,1,0,0,0,0|3,0,0]=4 1730 B11R1.13 Nc1c(cccc1OCF)I 34a_200000049512_100015361967 [0,1,0,0,0,0|3,0,0]=4 1731 B11R1.13 Nc1c(cccc1OCF)I 7a_200000049512_100015361967 [0,1,0,0,0,0|3,0,0]=4 1732 B11R1.13 Nc1c(cccc1SCF)Br 62a_100010146558_100015361967 [0,1,0,0,0,0|3,0,0]=4 1733 B11R1.13 Nc1c(cccc1SCF)Br 62a_100015361967_100010146558 [0,1,0,0,0,0|3,0,0]=4 1734 B11R1.13 Nc1c(cccc1SCF)Cl 62a_100010190421_100015361967 [0,1,0,0,0,0|3,0,0]=4 1735 B11R1.13 Nc1c(cccc1SCF)Cl 62a_100015361967_100010190421 [0,1,0,0,0,0|3,0,0]=4 1736 B11R1.13 Nc1c(cccc1SCF)F 62a_100000042321_100015361967 [0,1,0,0,0,0|3,0,0]=4 1737 B11R1.13 Nc1c(cccc1SCF)F 62a_100015361967_100000042321 [0,1,0,0,0,0|3,0,0]=4 1738 B11R1.13 Nc1c(cccc1SCF)O 62a_100015361967_100011934926 [0,1,0,0,0,0|3,0,0]=4 1739 B11R1.13 Nc1cccc(c1Br)OCF 34a_100012183704_100015361967 [0,1,0,0,0,0|3,0,0]=4 1740 B11R1.13 Nc1cccc(c1Br)OCF 7a_100012183704_100015361967 [0,1,0,0,0,0|3,0,0]=4 1741 B11R1.13 Nc1cccc(c1Cl)OCF 34a_100012002038_100015361967 [0,1,0,0,0,0|3,0,0]=4 1742 B11R1.13 Nc1cccc(c1Cl)OCF 7a_100012002038_100015361967 [0,1,0,0,0,0|3,0,0]=4 1743 B11R1.13 Nc1cccc(c1F)SCF 62a_100011935091_100015361967 [0,1,0,0,0,0|3,0,0]=4 1744 B11R1.13 Nc1cccc(c1F)SCF 62a_100015361967_100011935091 [0,1,0,0,0,0|3,0,0]=4 1745 B11R1.13 Nc1cccc(c1N)OCF 34a_100000033209_100015361967 [0,1,0,0,0,0|3,0,0]=4 1746 B11R1.13 Nc1cccc(c1N)SCF 62a_100015191791_100015361967 [0,1,0,0,0,0|3,0,0]=4 1747 B11R1.13 Nc1cccc(c1O)SCF 62a_100011934915_100015361967 [0,1,0,0,0,0|2,0,0]=3 1748 B11R1.13 Nc1cccc(c1O)SCF 62a_100015361967_100010084371 [0,1,0,0,0,0|2,0,0]=3 1749 B11R1.13 Nc1ccnc(c1O)SCF 62a_100015361967_100009844647 [0,1,0,0,0,0|3,0,0]=4 1750 B11R1.13 Nc1cncc(c1O)SCF 62a_100000694263_100015361967 [0,1,0,0,0,0|3,0,0]=4 1751 B11R1.13 Nc1cncc(c1O)SCF 62a_100015361967_100000694263 [0,1,0,0,0,0|3,0,0]=4 1752 B11R1.13 Oc1c(cccc1NCF)Br 34a_100011934915_100015361967 [0,1,0,0,0,0|2,0,0]=3 1753 B11R1.13 Oc1c(cccc1NCF)Cl 34a_100000754742_100015361967 [0,1,0,0,0,0|2,0,0]=3 1754 B11R1.13 Oc1c(cccc1NCF)F 34a_100011934987_100015361967 [0,1,0,0,0,0|2,0,0]=3 1755 B11R1.13 Oc1c(cccc1SCF)Br 62a_100010084509_100015361967 [0,1,0,0,0,0|2,0,0]=3 1756 B11R1.13 Oc1c(cccc1SCF)Br 62a_100015361967_100010084509 [0,1,0,0,0,0|2,0,0]=3 1757 B11R1.13 Oc1c(cccc1SCF)Cl 62a_100010202889_100015361967 [0,1,0,0,0,0|2,0,0]=3 1758 B11R1.13 Oc1c(cccc1SCF)Cl 62a_100015361967_100010202889 [0,1,0,0,0,0|2,0,0]=3 1759 B11R1.13 Oc1c(cccc1SCF)F 62a_100009813666_100015361967 [0,1,0,0,0,0|2,0,0]=3 1760 B11R1.13 Oc1c(cccc1SCF)F 62a_100015361967_100009813666 [0,1,0,0,0,0|2,0,0]=3 1761 B11R1.13 Oc1c(ccnc1Cl)SCF 62a_100015361967_100010067911 [0,1,0,0,0,0|3,0,0]=4 1762 B11R1.13 Oc1c(ccnc1SCF)F 62a_100015361967_100009867227 [0,1,0,0,0,0|3,0,0]=4 1763 B11R1.13 Oc1cccc(c1Br)NCF 34a_100012183704_100015361967 [0,1,0,0,0,0|3,0,0]=4 1764 B11R1.13 Oc1cccc(c1Br)NCF 7a_100012183704_100015361967 [0,1,0,0,0,0|3,0,0]=4 1765 B11R1.13 Oc1cccc(c1Br)SCF 62a_100010187914_100015361967 [0,1,0,0,0,0|3,0,0]=4 1766 B11R1.13 Oc1cccc(c1Br)SCF 62a_100015361967_100010187914 [0,1,0,0,0,0|3,0,0]=4 1767 B11R1.13 Oc1cccc(c1Cl)NCF 34a_100012002038_100015361967 [0,1,0,0,0,0|3,0,0]=4 1768 B11R1.13 Oc1cccc(c1Cl)NCF 7a_100012002038_100015361967 [0,1,0,0,0,0|3,0,0]=4 1769 B11R1.13 Oc1cccc(c1Cl)SCF 62a_100015361967_100000049636 [0,1,0,0,0,0|3,0,0]=4 1770 B11R1.13 Oc1cccc(c1F)SCF 62a_100009817021_100015361967 [0,1,0,0,0,0|3,0,0]=4 1771 B11R1.13 Oc1cccc(c1F)SCF 62a_100015361967_100009817021 [0,1,0,0,0,0|3,0,0]=4 1772 B11R1.13 Oc1cccc(c1O)SCF 62a_100015361967_100009815950 [0,1,0,0,0,0|2,0,0]=3 1773 B11R1.13 [13CH3]NCc1cccc(c1Br)F 2230a_100020638964_200025704644 [0,1,0,0,0,0|2,0,0]=3 1774 B11R1.13 [13CH3]NCc1cccc(c1Br)F 34a_100020638964_200025704644 [0,1,0,0,0,0|2,0,0]=3 1775 B11R1.13 [13CH3]NCc1cccc(c1Cl)Cl 2230a_100011211633_200025704644 [0,1,0,0,0,0|2,0,0]=3 1776 B11R1.13 [13CH3]NCc1cccc(c1Cl)Cl 34a_100011211633_200025704644 [0,1,0,0,0,0|2,0,0]=3 1777 B11R1.13 [13CH3]NCc1cccc(c1Cl)F 2230a_100012001614_200025704644 [0,1,0,0,0,0|2,0,0]=3 1778 B11R1.13 [13CH3]NCc1cccc(c1Cl)F 34a_100012001614_200025704644 [0,1,0,0,0,0|2,0,0]=3 1779 B11R1.13 [13CH3]NCc1cccc(c1F)Br 2230a_100015189953_200025704644 [0,1,0,0,0,0|2,0,0]=3 1780 B11R1.13 [13CH3]NCc1cccc(c1F)Br 34a_100015189953_200025704644 [0,1,0,0,0,0|2,0,0]=3 1781 B11R1.13 [13CH3]NCc1cccc(c1F)Cl 2230a_100000764326_200025704644 [0,1,0,0,0,0|2,0,0]=3 1782 B11R1.13 [13CH3]NCc1cccc(c1F)Cl 34a_100000764326_200025704644 [0,1,0,0,0,0|2,0,0]=3 1783 B11R1.13 [13CH3]NCc1cccc(c1F)F 2230a_100011199105_200025704644 [0,1,0,0,0,0|2,0,0]=3 1784 B11R1.13 [13CH3]NCc1cccc(c1F)F 34a_100011199105_200025704644 [0,1,0,0,0,0|2,0,0]=3 1785 B11R1.13 [13CH3]NCc1cccc(c1F)O 34a_100025773512_200025704644 [0,1,0,0,0,0|2,0,0]=3 1786 B11R1.13 [13CH3]OCc1cccc(c1Br)Cl 34a_100010168166_200025704644 [0,1,0,0,0,0|2,0,0]=3 1787 B11R1.13 [13CH3]OCc1cccc(c1Br)Cl 7a_100010168166_200025704644 [0,1,0,0,0,0|2,0,0]=3 1788 B11R1.13 [13CH3]OCc1cccc(c1Br)F 34a_100012351117_200025704644 [0,1,0,0,0,0|2,0,0]=3 1789 B11R1.13 [13CH3]OCc1cccc(c1Br)F 7a_100012351117_200025704644 [0,1,0,0,0,0|2,0,0]=3 1790 B11R1.13 [13CH3]OCc1cccc(c1Br)I 34a_100010240205_200025704644 [0,1,0,0,0,0|2,0,0]=3 1791 B11R1.13 [13CH3]OCc1cccc(c1Br)I 7a_100010240205_200025704644 [0,1,0,0,0,0|2,0,0]=3 1792 B11R1.13 [13CH3]OCc1cccc(c1Cl)Br 34a_100012351182_200025704644 [0,1,0,0,0,0|2,0,0]=3 1793 B11R1.13 [13CH3]OCc1cccc(c1Cl)Br 7a_100012351182_200025704644 [0,1,0,0,0,0|2,0,0]=3 1794 B11R1.13 [13CH3]OCc1cccc(c1Cl)Cl 34a_100000720469_200025704644 [0,1,0,0,0,0|2,0,0]=3 1795 B11R1.13 [13CH3]OCc1cccc(c1Cl)Cl 7a_100000720469_200025704644 [0,1,0,0,0,0|2,0,0]=3 1796 B11R1.13 [13CH3]OCc1cccc(c1Cl)F 34a_100000696319_200025704644 [0,1,0,0,0,0|2,0,0]=3 1797 B11R1.13 [13CH3]OCc1cccc(c1Cl)F 7a_100000696319_200025704644 [0,1,0,0,0,0|2,0,0]=3 1798 B11R1.13 [13CH3]OCc1cccc(c1F)Br 34a_100011935076_200025704644 [0,1,0,0,0,0|2,0,0]=3 1799 B11R1.13 [13CH3]OCc1cccc(c1F)Br 7a_100011935076_200025704644 [0,1,0,0,0,0|2,0,0]=3 1800 B11R1.13 [13CH3]OCc1cccc(c1F)Cl 34a_100011216988_200025704644 [0,1,0,0,0,0|2,0,0]=3 1801 B11R1.13 [13CH3]OCc1cccc(c1F)Cl 7a_100011216988_200025704644 [0,1,0,0,0,0|2,0,0]=3 1802 B11R1.13 [13CH3]OCc1cccc(c1F)F 34a_100011218644_200025704644 [0,1,0,0,0,0|2,0,0]=3 1803 B11R1.13 [13CH3]OCc1cccc(c1F)F 7a_100011218644_200025704644 [0,1,0,0,0,0|2,0,0]=3 1804 B11R1.13 [13CH3]OCc1cccc(c1F)I 34a_200010235739_200025704644 [0,1,0,0,0,0|2,0,0]=3 1805 B11R1.13 [13CH3]OCc1cccc(c1F)I 7a_200010235739_200025704644 [0,1,0,0,0,0|2,0,0]=3 1806 B11R1.13 [13CH3]OCc1cccc(c1F)N 34a_100012023829_200025704644 [0,1,0,0,0,0|2,0,0]=3 1807 B11R1.13 [13CH3]OCc1cccc(c1I)Br 34a_100010146604_200025704644 [0,1,0,0,0,0|2,0,0]=3 1808 B11R1.13 [13CH3]OCc1cccc(c1I)Br 7a_100010146604_200025704644 [0,1,0,0,0,0|2,0,0]=3 1809 B11R1.13 [13CH3]OCc1cccc(c1I)F 34a_100000692438_200025704644 [0,1,0,0,0,0|2,0,0]=3 1810 B11R1.13 [13CH3]OCc1cccc(c1I)F 7a_100000692438_200025704644 [0,1,0,0,0,0|2,0,0]=3 1811 B11R1.13 [13CH3]OCc1cccc(c1N)Br 34a_100012349457_200025704644 [0,1,0,0,0,0|2,0,0]=3 1812 B11R1.13 [13CH3]OCc1cccc(c1N)Cl 34a_100012182729_200025704644 [0,1,0,0,0,0|2,0,0]=3 1813 B11R1.13 [13CH3]OCc1cccc(c1N)F 34a_100000692437_200025704644 [0,1,0,0,0,0|2,0,0]=3 1814 B11R1.13 [13CH3]OCc1ccnc(c1F)Br 34a_100010065242_200025704644 [0,1,0,0,0,0|3,0,0]=4 1815 B11R1.13 [13CH3]OCc1ccnc(c1F)Br 7a_100010065242_200025704644 [0,1,0,0,0,0|3,0,0]=4 1816 B11R1.13 [13CH3]OCc1ccnc(c1F)Cl 34a_100000101314_200025704644 [0,1,0,0,0,0|3,0,0]=4 1817 B11R1.13 [13CH3]OCc1ccnc(c1F)Cl 7a_100000101314_200025704644 [0,1,0,0,0,0|3,0,0]=4 1818 B11R1.13 [13CH3]SCc1cccc(c1Br)Cl 62a_100010145525_200025704644 [0,1,0,0,0,0|2,0,0]=3 1819 B11R1.13 [13CH3]SCc1cccc(c1Br)Cl 62a_200025704644_100010145525 [0,1,0,0,0,0|2,0,0]=3 1820 B11R1.13 [13CH3]SCc1cccc(c1Br)F 62a_100012351116_200025704644 [0,1,0,0,0,0|2,0,0]=3 1821 B11R1.13 [13CH3]SCc1cccc(c1Br)F 62a_200025704644_100012351116 [0,1,0,0,0,0|2,0,0]=3 1822 B11R1.13 [13CH3]SCc1cccc(c1Br)I 62a_100010254545_200025704644 [0,1,0,0,0,0|2,0,0]=3 1823 B11R1.13 [13CH3]SCc1cccc(c1Br)I 62a_200025704644_100010254545 [0,1,0,0,0,0|2,0,0]=3 1824 B11R1.13 [13CH3]SCc1cccc(c1Cl)Br 62a_100012349491_200025704644 [0,1,0,0,0,0|2,0,0]=3 1825 B11R1.13 [13CH3]SCc1cccc(c1Cl)Br 62a_200025704644_100012349491 [0,1,0,0,0,0|2,0,0]=3 1826 B11R1.13 [13CH3]SCc1cccc(c1Cl)Cl 62a_100000720918_200025704644 [0,1,0,0,0,0|2,0,0]=3 1827 B11R1.13 [13CH3]SCc1cccc(c1Cl)Cl 62a_200025704644_100000723366 [0,1,0,0,0,0|2,0,0]=3 1828 B11R1.13 [13CH3]SCc1cccc(c1Cl)F 62a_100000696688_200025704644 [0,1,0,0,0,0|2,0,0]=3 1829 B11R1.13 [13CH3]SCc1cccc(c1Cl)F 62a_200025704644_100000696688 [0,1,0,0,0,0|2,0,0]=3 1830 B11R1.13 [13CH3]SCc1cccc(c1F)Br 62a_100012356506_200025704644 [0,1,0,0,0,0|2,0,0]=3 1831 B11R1.13 [13CH3]SCc1cccc(c1F)Br 62a_200025704644_100012356506 [0,1,0,0,0,0|2,0,0]=3 1832 B11R1.13 [13CH3]SCc1cccc(c1F)Cl 62a_100000716733_200025704644 [0,1,0,0,0,0|2,0,0]=3 1833 B11R1.13 [13CH3]SCc1cccc(c1F)Cl 62a_200025704644_100000716733 [0,1,0,0,0,0|2,0,0]=3 1834 B11R1.13 [13CH3]SCc1cccc(c1F)F 62a_100000217499_200025704644 [0,1,0,0,0,0|2,0,0]=3 1835 B11R1.13 [13CH3]SCc1cccc(c1F)F 62a_200025704644_100000217499 [0,1,0,0,0,0|2,0,0]=3 1836 B11R1.13 [13CH3]SCc1cccc(c1I)F 62a_100010149603_200025704644 [0,1,0,0,0,0|2,0,0]=3 1837 B11R1.13 [13CH3]SCc1cccc(c1I)F 62a_200025704644_100010149603 [0,1,0,0,0,0|2,0,0]=3 1838 B11R1.17 C#CCNc1ccccc1Br 34a_100000210017_100000184674 [0,1,0,0,0,0|1,0,2]=4 1839 B11R1.17 C#CCNc1ccccc1C 34a_100015192222_100000184674 [0,1,0,0,0,0|1,0,2]=4 1840 B11R1.17 C#CCNc1ccccc1Cl 34a_100000185783_100000184674 [0,1,0,0,0,0|1,0,2]=4 1841 B11R1.17 C#CCNc1ccccc1F 34a_100000210422_100000184674 [0,1,0,0,0,0|1,0,2]=4 1842 B11R1.17 C#CCNc1ccccc1I 34a_100000210053_100000184674 [0,1,0,0,0,0|1,0,2]=4 1843 B11R1.17 C#CCNc1ccccc1O 34a_100000185747_100000184674 [0,1,0,0,0,0|0,0,2]=3 1844 B11R1.17 C#CCOc1ccccc1Br 34a_100000181306_100000184674 [0,1,0,0,0,0|1,0,2]=4 1845 B11R1.17 C#CCOc1ccccc1Br 7a_100000181306_100000038162 [0,1,0,0,0,0|1,0,2]=4 1846 B11R1.17 C#CCOc1ccccc1C 34a_100000210338_100000184674 [0,1,0,0,0,0|1,0,2]=4 1847 B11R1.17 C#CCOc1ccccc1C 7a_100000210338_100000038162 [0,1,0,0,0,0|1,0,2]=4 1848 B11R1.17 C#CCOc1ccccc1Cl 34a_100000210172_100000184674 [0,1,0,0,0,0|1,0,2]=4 1849 B11R1.17 C#CCOc1ccccc1Cl 7a_100000210172_100000038162 [0,1,0,0,0,0|1,0,2]=4 1850 B11R1.17 C#CCOc1ccccc1F 34a_100000210171_100000184674 [0,1,0,0,0,0|1,0,2]=4 1851 B11R1.17 C#CCOc1ccccc1F 7a_100000210171_100000038162 [0,1,0,0,0,0|1,0,2]=4 1852 B11R1.17 C#CCOc1ccccc1I 34a_100000739446_100000184674 [0,1,0,0,0,0|1,0,2]=4 1853 B11R1.17 C#CCOc1ccccc1I 7a_100000739446_100000038162 [0,1,0,0,0,0|1,0,2]=4 1854 B11R1.17 C#CCOc1ccccc1N 34a_100000185747_100000184674 [0,1,0,0,0,0|1,0,2]=4 1855 B11R1.17 C#CCOc1ccccc1N 7a_100000185747_100000038162 [0,1,0,0,0,0|1,0,2]=4 1856 B11R1.17 C#CCSc1ccccc1Br 62a_100000038162_100000695589 [0,1,0,0,0,0|1,0,2]=4 1857 B11R1.17 C#CCSc1ccccc1C 62a_100000038162_100000210755 [0,1,0,0,0,0|1,0,2]=4 1858 B11R1.17 C#CCSc1ccccc1Cl 62a_100000038162_100000764095 [0,1,0,0,0,0|1,0,2]=4 1859 B11R1.17 C#CCSc1ccccc1F 62a_100000038162_100011215700 [0,1,0,0,0,0|1,0,2]=4 1860 B11R1.17 C#CCSc1ccccc1N 62a_100000038162_100000210017 [0,1,0,0,0,0|1,0,2]=4 1861 B11R1.17 C#CCSc1ccccc1O 62a_100000038162_100000739446 [0,1,0,0,0,0|0,0,2]=3 1862 B11R1.17 C#CCSc1cccnc1O 62a_100000038162_100000760158 [0,1,0,0,0,0|1,0,2]=4 1863 B11R1.17 C#CCSc1ccncc1O 62a_100000038162_100009817591 [0,1,0,0,0,0|1,0,2]=4 1864 B11R1.17 C#CCSc1ncccc1O 62a_100000038162_100000034122 [0,1,0,0,0,0|1,0,2]=4 1865 B11R1.17 C=CCNc1ccccc1Br 34a_100000210017_100015514636 [0,1,0,0,0,0|1,0,2]=4 1866 B11R1.17 C=CCNc1ccccc1C 34a_100015192222_100015514636 [0,1,0,0,0,0|1,0,2]=4 1867 B11R1.17 C=CCNc1ccccc1Cl 34a_100000185783_100015514636 [0,1,0,0,0,0|1,0,2]=4 1868 B11R1.17 C=CCNc1ccccc1F 34a_100000210422_100015514636 [0,1,0,0,0,0|1,0,2]=4 1869 B11R1.17 C=CCNc1ccccc1I 34a_100000210053_100015514636 [0,1,0,0,0,0|1,0,2]=4 1870 B11R1.17 C=CCNc1ccccc1O 34a_100000185747_100015514636 [0,1,0,0,0,0|0,0,2]=3 1871 B11R1.17 C=CCOc1ccccc1Br 34a_100000181306_100015514636 [0,1,0,0,0,0|1,0,2]=4 1872 B11R1.17 C=CCOc1ccccc1Br 7a_100000181306_100015514636 [0,1,0,0,0,0|1,0,2]=4 1873 B11R1.17 C=CCOc1ccccc1C 34a_100000210338_100015514636 [0,1,0,0,0,0|1,0,2]=4 1874 B11R1.17 C=CCOc1ccccc1C 7a_100000210338_100015514636 [0,1,0,0,0,0|1,0,2]=4 1875 B11R1.17 C=CCOc1ccccc1Cl 34a_100000210172_100015514636 [0,1,0,0,0,0|1,0,2]=4 1876 B11R1.17 C=CCOc1ccccc1Cl 7a_100000210172_100015514636 [0,1,0,0,0,0|1,0,2]=4 1877 B11R1.17 C=CCOc1ccccc1F 34a_100000210171_100015514636 [0,1,0,0,0,0|1,0,2]=4 1878 B11R1.17 C=CCOc1ccccc1F 7a_100000210171_100015514636 [0,1,0,0,0,0|1,0,2]=4 1879 B11R1.17 C=CCOc1ccccc1I 34a_100000739446_100015514636 [0,1,0,0,0,0|1,0,2]=4 1880 B11R1.17 C=CCOc1ccccc1I 7a_100000739446_100015514636 [0,1,0,0,0,0|1,0,2]=4 1881 B11R1.17 C=CCOc1ccccc1N 34a_100000185747_100015514636 [0,1,0,0,0,0|1,0,2]=4 1882 B11R1.17 C=CCOc1ccccc1N 7a_100000185747_100015514636 [0,1,0,0,0,0|1,0,2]=4 1883 B11R1.17 C=CCSc1ccccc1Br 62a_100000210623_100000695589 [0,1,0,0,0,0|1,0,2]=4 1884 B11R1.17 C=CCSc1ccccc1Br 62a_100000695589_100000210623 [0,1,0,0,0,0|1,0,2]=4 1885 B11R1.17 C=CCSc1ccccc1C 62a_100000210623_100000210755 [0,1,0,0,0,0|1,0,2]=4 1886 B11R1.17 C=CCSc1ccccc1C 62a_100000210755_100000210623 [0,1,0,0,0,0|1,0,2]=4 1887 B11R1.17 C=CCSc1ccccc1Cl 62a_100000210623_100000764095 [0,1,0,0,0,0|1,0,2]=4 1888 B11R1.17 C=CCSc1ccccc1Cl 62a_100000764095_100000210623 [0,1,0,0,0,0|1,0,2]=4 1889 B11R1.17 C=CCSc1ccccc1F 62a_100000210623_100011215700 [0,1,0,0,0,0|1,0,2]=4 1890 B11R1.17 C=CCSc1ccccc1F 62a_100011215700_100000210623 [0,1,0,0,0,0|1,0,2]=4 1891 B11R1.17 C=CCSc1ccccc1N 62a_100000210017_100000210623 [0,1,0,0,0,0|1,0,2]=4 1892 B11R1.17 C=CCSc1ccccc1N 62a_100000210623_100000210017 [0,1,0,0,0,0|1,0,2]=4 1893 B11R1.17 C=CCSc1ccccc1O 62a_100000210623_100000739446 [0,1,0,0,0,0|0,0,2]=3 1894 B11R1.17 C=CCSc1ccccc1O 62a_100000739446_100000210623 [0,1,0,0,0,0|0,0,2]=3 1895 B11R1.17 C=CCSc1cccnc1O 62a_100000210623_100000760158 [0,1,0,0,0,0|1,0,2]=4 1896 B11R1.17 C=CCSc1cccnc1O 62a_100000760158_100000210623 [0,1,0,0,0,0|1,0,2]=4 1897 B11R1.17 C=CCSc1ccncc1O 62a_100000210623_100009817591 [0,1,0,0,0,0|1,0,2]=4 1898 B11R1.17 C=CCSc1ccncc1O 62a_100009817591_100000210623 [0,1,0,0,0,0|1,0,2]=4 1899 B11R1.17 C=CCSc1ncccc1O 62a_100000034122_100000210623 [0,1,0,0,0,0|1,0,2]=4 1900 B11R1.17 C=CCSc1ncccc1O 62a_100000210623_100000034122 [0,1,0,0,0,0|1,0,2]=4 1901 B11R1.17 CC=NNc1ccccc1Br 4a_100000241748_200000210099 [0,1,0,0,0,0|2,0,1]=4 1902 B11R1.17 CC=NNc1ccccc1C 4a_100000184220_200000210099 [0,1,0,0,0,0|2,0,1]=4 1903 B11R1.17 CC=NNc1ccccc1Cl 4a_100000683529_200000210099 [0,1,0,0,0,0|2,0,1]=4 1904 B11R1.17 CC=NNc1ccccc1F 4a_100000239246_200000210099 [0,1,0,0,0,0|2,0,1]=4 1905 B11R1.17 CC=NNc1ccccc1I 4a_100011218156_200000210099 [0,1,0,0,0,0|2,0,1]=4 1906 B11R1.17 CCCCc1c[nH]ccc1=O 271570a_100020621405_100009998708 [0,1,0,0,0,0|1,0,1]=3 1907 B11R1.17 CCCCc1c[nH]ccc1=S 271570a_100020621405_200012280681 [0,1,0,0,0,0|1,1,0]=3 1908 B11R1.17 CCCCc1ccc[nH]c1=O 271570a_100020621405_100000050042 [0,1,0,0,0,0|1,0,1]=3 1909 B11R1.17 CCCCc1cccc[n+]1C 271570a_100020621405_100000212160 [0,1,0,0,0,0|2,0,0]=3 1910 B11R1.17 CCCCc1cccc[n+]1[O-] 271570a_100020621405_200000042595 [0,1,0,0,0,0|1,0,1]=3 1911 B11R1.17 CCCCc1ccccc1Br 271570a_100020621405_100000695589 [0,1,0,0,0,0|1,0,0]=2 1912 B11R1.17 CCCCc1ccccc1C 271570a_100020621405_100000210755 [0,1,0,0,0,0|1,0,0]=2 1913 B11R1.17 CCCCc1ccccc1Cl 271570a_100020621405_100000764095 [0,1,0,0,0,0|1,0,0]=2 1914 B11R1.17 CCCCc1ccccc1F 271570a_100020621405_100011215700 [0,1,0,0,0,0|1,0,0]=2 1915 B11R1.17 CCCCc1ccccc1N 271570a_100020621405_100000210017 [0,1,0,0,0,0|1,0,0]=2 1916 B11R1.17 CCCCc1ccccc1O 271570a_100020621405_100000739446 [0,1,0,0,0,0|0,0,0]=1 1917 B11R1.17 CCCCc1cccnc1Br 271570a_100020621405_100010202626 [0,1,0,0,0,0|2,0,0]=3 1918 B11R1.17 CCCCc1cccnc1C 271570a_100020621405_100000751574 [0,1,0,0,0,0|2,0,0]=3 1919 B11R1.17 CCCCc1cccnc1Cl 271570a_100020621405_100000036424 [0,1,0,0,0,0|2,0,0]=3 1920 B11R1.17 CCCCc1cccnc1F 271570a_100020621405_100009816115 [0,1,0,0,0,0|2,0,0]=3 1921 B11R1.17 CCCCc1cccnc1N 271570a_100020621405_100000045569 [0,1,0,0,0,0|2,0,0]=3 1922 B11R1.17 CCCCc1ccn[nH]c1=O 271570a_100020621405_100000087129 [0,1,0,0,0,0|2,0,1]=4 1923 B11R1.17 CCCCc1ccncc1Br 271570a_100020621405_100000726257 [0,1,0,0,0,0|2,0,0]=3 1924 B11R1.17 CCCCc1ccncc1C 271570a_100020621405_100015191297 [0,1,0,0,0,0|2,0,0]=3 1925 B11R1.17 CCCCc1ccncc1Cl 271570a_100020621405_100000708259 [0,1,0,0,0,0|2,0,0]=3 1926 B11R1.17 CCCCc1ccncc1F 271570a_100020621405_100000047030 [0,1,0,0,0,0|2,0,0]=3 1927 B11R1.17 CCCCc1ccncc1N 271570a_100020621405_100009815883 [0,1,0,0,0,0|2,0,0]=3 1928 B11R1.17 CCCCc1ccncc1O 271570a_100020621405_100009817591 [0,1,0,0,0,0|1,0,0]=2 1929 B11R1.17 CCCCc1cnccc1Br 271570a_100020621405_100010138639 [0,1,0,0,0,0|2,0,0]=3 1930 B11R1.17 CCCCc1cnccc1C 271570a_100020621405_100000761580 [0,1,0,0,0,0|2,0,0]=3 1931 B11R1.17 CCCCc1cnccc1Cl 271570a_100020621405_100009995489 [0,1,0,0,0,0|2,0,0]=3 1932 B11R1.17 CCCCc1cnccc1F 271570a_100020621405_100009820683 [0,1,0,0,0,0|2,0,0]=3 1933 B11R1.17 CCCCc1cnccc1N 271570a_100020621405_100000047001 [0,1,0,0,0,0|2,0,0]=3 1934 B11R1.17 CCCCc1cncnc1Br 271570a_100020621405_200012461658 [0,1,0,0,0,0|3,0,0]=4 1935 B11R1.17 CCCCc1cncnc1C 271570a_100020621405_100009819671 [0,1,0,0,0,0|3,0,0]=4 1936 B11R1.17 CCCCc1cncnc1Cl 271570a_100020621405_100000758962 [0,1,0,0,0,0|3,0,0]=4 1937 B11R1.17 CCCCc1cncnc1N 271570a_100020621405_100011996079 [0,1,0,0,0,0|3,0,0]=4 1938 B11R1.17 CCCCc1cncnc1O 271570a_100020621405_100000751107 [0,1,0,0,0,0|2,0,0]=3 1939 B11R1.17 CCCCc1cnncc1N 271570a_100020621405_100009829405 [0,1,0,0,0,0|3,0,0]=4 1940 B11R1.17 CCCCc1ncc[nH]c1=O 271570a_100020621405_100000763361 [0,1,0,0,0,0|2,0,1]=4 1941 B11R1.17 CCCCc1ncccc1Br 271570a_100020621405_100000696092 [0,1,0,0,0,0|2,0,0]=3 1942 B11R1.17 CCCCc1ncccc1C 271570a_100020621405_100000751373 [0,1,0,0,0,0|2,0,0]=3 1943 B11R1.17 CCCCc1ncccc1Cl 271570a_100020621405_100011356963 [0,1,0,0,0,0|2,0,0]=3 1944 B11R1.17 CCCCc1ncccc1F 271570a_100020621405_100000685392 [0,1,0,0,0,0|2,0,0]=3 1945 B11R1.17 CCCCc1ncccc1N 271570a_100020621405_100000688686 [0,1,0,0,0,0|2,0,0]=3 1946 B11R1.17 CCCCc1ncccc1O 271570a_100020621405_100000034122 [0,1,0,0,0,0|1,0,0]=2 1947 B11R1.17 CCCCc1nccnc1C 271570a_100020621405_100011999405 [0,1,0,0,0,0|3,0,0]=4 1948 B11R1.17 CCCCc1nccnc1F 271570a_100020621405_200010125657 [0,1,0,0,0,0|3,0,0]=4 1949 B11R1.17 CCCCc1nccnc1N 271570a_100020621405_100000747729 [0,1,0,0,0,0|3,0,0]=4 1950 B11R1.17 CCCCc1ncncc1C 271570a_100020621405_100011998708 [0,1,0,0,0,0|3,0,0]=4 1951 B11R1.17 CCCCc1ncncc1F 271570a_100020621405_100000069762 [0,1,0,0,0,0|3,0,0]=4 1952 B11R1.17 CCCCc1ncncc1N 271570a_100020621405_100000709731 [0,1,0,0,0,0|3,0,0]=4 1953 B11R1.17 CCCCc1ncncc1O 271570a_203496583355_200009816989 [0,1,0,0,0,0|2,0,0]=3 1954 B11R1.17 CCCCc1nnccc1C 271570a_100020621405_100000089043 [0,1,0,0,0,0|3,0,0]=4 1955 B11R1.17 CCCNc1ccccc1Br 34a_100000210017_100000210303 [0,1,0,0,0,0|1,0,0]=2 1956 B11R1.17 CCCNc1ccccc1C 34a_100015192222_100000210303 [0,1,0,0,0,0|1,0,0]=2 1957 B11R1.17 CCCNc1ccccc1Cl 34a_100000185783_100000210303 [0,1,0,0,0,0|1,0,0]=2 1958 B11R1.17 CCCNc1ccccc1F 34a_100000210422_100000210303 [0,1,0,0,0,0|1,0,0]=2 1959 B11R1.17 CCCNc1ccccc1I 34a_100000210053_100000210303 [0,1,0,0,0,0|1,0,0]=2 1960 B11R1.17 CCCNc1ccccc1O 34a_100000185747_100000210303 [0,1,0,0,0,0|0,0,0]=1 1961 B11R1.17 CCCOc1cccc[n+]1[O-] 7a_100000211761_100000210303 [0,1,0,0,0,0|1,0,1]=3 1962 B11R1.17 CCCOc1ccccc1Br 34a_100000181306_100000210303 [0,1,0,0,0,0|1,0,0]=2 1963 B11R1.17 CCCOc1ccccc1Br 7a_100000181306_100000210303 [0,1,0,0,0,0|1,0,0]=2 1964 B11R1.17 CCCOc1ccccc1C 34a_100000210338_100000210303 [0,1,0,0,0,0|1,0,0]=2 1965 B11R1.17 CCCOc1ccccc1C 7a_100000210338_100000210303 [0,1,0,0,0,0|1,0,0]=2 1966 B11R1.17 CCCOc1ccccc1Cl 34a_100000210172_100000210303 [0,1,0,0,0,0|1,0,0]=2 1967 B11R1.17 CCCOc1ccccc1Cl 7a_100000210172_100000210303 [0,1,0,0,0,0|1,0,0]=2 1968 B11R1.17 CCCOc1ccccc1F 34a_100000210171_100000210303 [0,1,0,0,0,0|1,0,0]=2 1969 B11R1.17 CCCOc1ccccc1F 7a_100000210171_100000210303 [0,1,0,0,0,0|1,0,0]=2 1970 B11R1.17 CCCOc1ccccc1I 34a_100000739446_100000210303 [0,1,0,0,0,0|1,0,0]=2 1971 B11R1.17 CCCOc1ccccc1I 7a_100000739446_100000210303 [0,1,0,0,0,0|1,0,0]=2 1972 B11R1.17 CCCOc1ccccc1N 34a_100000185747_100000210303 [0,1,0,0,0,0|1,0,0]=2 1973 B11R1.17 CCCOc1ccccc1N 7a_100000185747_100000210303 [0,1,0,0,0,0|1,0,0]=2 1974 B11R1.17 CCCOc1ccccc1O 271570a_203496583355_100000174042 [0,1,0,0,0,0|0,0,0]=1 1975 B11R1.17 CCCOc1cccnc1Br 34a_100000744436_100000210303 [0,1,0,0,0,0|2,0,0]=3 1976 B11R1.17 CCCOc1cccnc1Br 7a_100000744436_100000210303 [0,1,0,0,0,0|2,0,0]=3 1977 B11R1.17 CCCOc1cccnc1C 34a_100000745507_100000210303 [0,1,0,0,0,0|2,0,0]=3 1978 B11R1.17 CCCOc1cccnc1C 7a_100000745507_100000210303 [0,1,0,0,0,0|2,0,0]=3 1979 B11R1.17 CCCOc1cccnc1Cl 34a_100000757616_100000210303 [0,1,0,0,0,0|2,0,0]=3 1980 B11R1.17 CCCOc1cccnc1Cl 7a_100000757616_100000210303 [0,1,0,0,0,0|2,0,0]=3 1981 B11R1.17 CCCOc1cccnc1F 34a_100000061740_100000210303 [0,1,0,0,0,0|2,0,0]=3 1982 B11R1.17 CCCOc1cccnc1F 7a_100000061740_100000210303 [0,1,0,0,0,0|2,0,0]=3 1983 B11R1.17 CCCOc1cccnc1I 34a_100000034122_100000210303 [0,1,0,0,0,0|2,0,0]=3 1984 B11R1.17 CCCOc1cccnc1I 7a_100000034122_100000210303 [0,1,0,0,0,0|2,0,0]=3 1985 B11R1.17 CCCOc1cccnc1N 34a_100000211975_100000210303 [0,1,0,0,0,0|2,0,0]=3 1986 B11R1.17 CCCOc1cccnc1N 7a_100000211975_100000210303 [0,1,0,0,0,0|2,0,0]=3 1987 B11R1.17 CCCOc1cccoc1=O 34a_100000077404_100000210303 [0,1,0,0,0,0|1,0,1]=3 1988 B11R1.17 CCCOc1cccoc1=O 7a_100000077404_100000210303 [0,1,0,0,0,0|1,0,1]=3 1989 B11R1.17 CCCOc1ccncc1Br 34a_100011996408_100000210303 [0,1,0,0,0,0|2,0,0]=3 1990 B11R1.17 CCCOc1ccncc1C 34a_100000694293_100000210303 [0,1,0,0,0,0|2,0,0]=3 1991 B11R1.17 CCCOc1ccncc1Cl 34a_100011997054_100000210303 [0,1,0,0,0,0|2,0,0]=3 1992 B11R1.17 CCCOc1ccncc1F 34a_200000081243_100000210303 [0,1,0,0,0,0|2,0,0]=3 1993 B11R1.17 CCCOc1cnccc1C 34a_100011997053_100000210303 [0,1,0,0,0,0|2,0,0]=3 1994 B11R1.17 CCCOc1cnccc1C 7a_100011997053_100000210303 [0,1,0,0,0,0|2,0,0]=3 1995 B11R1.17 CCCOc1cnccc1Cl 34a_100011996695_100000210303 [0,1,0,0,0,0|2,0,0]=3 1996 B11R1.17 CCCOc1cnccc1I 34a_100000050107_100000210303 [0,1,0,0,0,0|2,0,0]=3 1997 B11R1.17 CCCOc1cnccc1N 34a_100000753702_100000210303 [0,1,0,0,0,0|2,0,0]=3 1998 B11R1.17 CCCOc1cncnc1N 7a_100000112926_100000210303 [0,1,0,0,0,0|3,0,0]=4 1999 B11R1.17 CCCOc1coccc1=O 34a_100000060831_100000210303 [0,1,0,0,0,0|1,0,1]=3 2000 B11R1.17 CCCOc1ncccc1Cl 34a_100011290957_100000210303 [0,1,0,0,0,0|2,0,0]=3 2001 B11R1.17 CCCOc1ncccc1F 34a_100011219419_100000210303 [0,1,0,0,0,0|2,0,0]=3 2002 B11R1.17 CCCOc1ncccc1N 34a_100000746358_100000210303 [0,1,0,0,0,0|2,0,0]=3 2003 B11R1.17 CCCOc1ncccc1O 271570a_203496583355_200011465209 [0,1,0,0,0,0|1,0,0]=2 2004 B11R1.17 CCCOc1nccnc1C 34a_100000766352_100000210303 [0,1,0,0,0,0|3,0,0]=4 2005 B11R1.17 CCCSc1c[nH]ccc1=O 62a_100000210303_100009998708 [0,1,0,0,0,0|1,0,1]=3 2006 B11R1.17 CCCSc1c[nH]ccc1=O 62a_100009998708_100000210303 [0,1,0,0,0,0|1,0,1]=3 2007 B11R1.17 CCCSc1c[nH]ccc1=S 62a_100000210303_200012280681 [0,1,0,0,0,0|1,1,0]=3 2008 B11R1.17 CCCSc1c[nH]ccc1=S 62a_200012280681_100000210303 [0,1,0,0,0,0|1,1,0]=3 2009 B11R1.17 CCCSc1cccc[n+]1C 62a_100000210303_100000212160 [0,1,0,0,0,0|2,0,0]=3 2010 B11R1.17 CCCSc1cccc[n+]1[O-] 62a_100000210303_200000042595 [0,1,0,0,0,0|1,0,1]=3 2011 B11R1.17 CCCSc1ccccc1Br 62a_100000210303_100000695589 [0,1,0,0,0,0|1,0,0]=2 2012 B11R1.17 CCCSc1ccccc1Br 62a_100000695589_100000210303 [0,1,0,0,0,0|1,0,0]=2 2013 B11R1.17 CCCSc1ccccc1C 62a_100000210303_100000210755 [0,1,0,0,0,0|1,0,0]=2 2014 B11R1.17 CCCSc1ccccc1C 62a_100000210755_100000210303 [0,1,0,0,0,0|1,0,0]=2 2015 B11R1.17 CCCSc1ccccc1Cl 62a_100000210303_100000764095 [0,1,0,0,0,0|1,0,0]=2 2016 B11R1.17 CCCSc1ccccc1Cl 62a_100000764095_100000210303 [0,1,0,0,0,0|1,0,0]=2 2017 B11R1.17 CCCSc1ccccc1F 62a_100000210303_100011215700 [0,1,0,0,0,0|1,0,0]=2 2018 B11R1.17 CCCSc1ccccc1F 62a_100011215700_100000210303 [0,1,0,0,0,0|1,0,0]=2 2019 B11R1.17 CCCSc1ccccc1N 62a_100000210017_100000210303 [0,1,0,0,0,0|1,0,0]=2 2020 B11R1.17 CCCSc1ccccc1N 62a_100000210303_100000210017 [0,1,0,0,0,0|1,0,0]=2 2021 B11R1.17 CCCSc1ccccc1O 62a_100000210303_100000739446 [0,1,0,0,0,0|0,0,0]=1 2022 B11R1.17 CCCSc1ccccc1O 62a_100000739446_100000210303 [0,1,0,0,0,0|0,0,0]=1 2023 B11R1.17 CCCSc1cccnc1Br 62a_100000210303_100010202626 [0,1,0,0,0,0|2,0,0]=3 2024 B11R1.17 CCCSc1cccnc1Br 62a_100010202626_100000210303 [0,1,0,0,0,0|2,0,0]=3 2025 B11R1.17 CCCSc1cccnc1C 62a_100000210303_100000751574 [0,1,0,0,0,0|2,0,0]=3 2026 B11R1.17 CCCSc1cccnc1C 62a_100000751574_100000210303 [0,1,0,0,0,0|2,0,0]=3 2027 B11R1.17 CCCSc1cccnc1Cl 62a_100000036424_100000210303 [0,1,0,0,0,0|2,0,0]=3 2028 B11R1.17 CCCSc1cccnc1Cl 62a_100000210303_100000036424 [0,1,0,0,0,0|2,0,0]=3 2029 B11R1.17 CCCSc1cccnc1F 62a_100000210303_100009816115 [0,1,0,0,0,0|2,0,0]=3 2030 B11R1.17 CCCSc1cccnc1F 62a_100009816115_100000210303 [0,1,0,0,0,0|2,0,0]=3 2031 B11R1.17 CCCSc1cccnc1N 62a_100000045569_100000210303 [0,1,0,0,0,0|2,0,0]=3 2032 B11R1.17 CCCSc1cccnc1N 62a_100000210303_100000045569 [0,1,0,0,0,0|2,0,0]=3 2033 B11R1.17 CCCSc1cccnc1O 62a_100000210303_100000760158 [0,1,0,0,0,0|1,0,0]=2 2034 B11R1.17 CCCSc1cccnc1O 62a_100000760158_100000210303 [0,1,0,0,0,0|1,0,0]=2 2035 B11R1.17 CCCSc1ccn[nH]c1=O 62a_100000210303_100000087129 [0,1,0,0,0,0|2,0,1]=4 2036 B11R1.17 CCCSc1ccncc1Br 62a_100000210303_100000726257 [0,1,0,0,0,0|2,0,0]=3 2037 B11R1.17 CCCSc1ccncc1Br 62a_100000726257_100000210303 [0,1,0,0,0,0|2,0,0]=3 2038 B11R1.17 CCCSc1ccncc1C 62a_100000210303_100000765111 [0,1,0,0,0,0|2,0,0]=3 2039 B11R1.17 CCCSc1ccncc1C 62a_100000765111_100000210303 [0,1,0,0,0,0|2,0,0]=3 2040 B11R1.17 CCCSc1ccncc1Cl 62a_100000210303_100000708259 [0,1,0,0,0,0|2,0,0]=3 2041 B11R1.17 CCCSc1ccncc1Cl 62a_100000708259_100000210303 [0,1,0,0,0,0|2,0,0]=3 2042 B11R1.17 CCCSc1ccncc1F 62a_100000047030_100000210303 [0,1,0,0,0,0|2,0,0]=3 2043 B11R1.17 CCCSc1ccncc1F 62a_100000210303_100000047030 [0,1,0,0,0,0|2,0,0]=3 2044 B11R1.17 CCCSc1ccncc1N 62a_100000210303_100000756074 [0,1,0,0,0,0|2,0,0]=3 2045 B11R1.17 CCCSc1ccncc1N 62a_100000756074_100000210303 [0,1,0,0,0,0|2,0,0]=3 2046 B11R1.17 CCCSc1ccncc1O 62a_100000210303_100009817591 [0,1,0,0,0,0|1,0,0]=2 2047 B11R1.17 CCCSc1ccncc1O 62a_100009817591_100000210303 [0,1,0,0,0,0|1,0,0]=2 2048 B11R1.17 CCCSc1cnccc1Br 62a_100000210303_100010138639 [0,1,0,0,0,0|2,0,0]=3 2049 B11R1.17 CCCSc1cnccc1Br 62a_100010138639_100000210303 [0,1,0,0,0,0|2,0,0]=3 2050 B11R1.17 CCCSc1cnccc1C 62a_100000210303_100000761580 [0,1,0,0,0,0|2,0,0]=3 2051 B11R1.17 CCCSc1cnccc1C 62a_100000761580_100000210303 [0,1,0,0,0,0|2,0,0]=3 2052 B11R1.17 CCCSc1cnccc1Cl 62a_100000210303_100009995489 [0,1,0,0,0,0|2,0,0]=3 2053 B11R1.17 CCCSc1cnccc1Cl 62a_100009995489_100000210303 [0,1,0,0,0,0|2,0,0]=3 2054 B11R1.17 CCCSc1cnccc1F 62a_100000210303_100009820683 [0,1,0,0,0,0|2,0,0]=3 2055 B11R1.17 CCCSc1cnccc1F 62a_100009820683_100000210303 [0,1,0,0,0,0|2,0,0]=3 2056 B11R1.17 CCCSc1cnccc1N 62a_100000047001_100000210303 [0,1,0,0,0,0|2,0,0]=3 2057 B11R1.17 CCCSc1cnccc1N 62a_100000210303_100000047001 [0,1,0,0,0,0|2,0,0]=3 2058 B11R1.17 CCCSc1cncnc1Br 62a_100000210303_200012461658 [0,1,0,0,0,0|3,0,0]=4 2059 B11R1.17 CCCSc1cncnc1Br 62a_200012461658_100000210303 [0,1,0,0,0,0|3,0,0]=4 2060 B11R1.17 CCCSc1cncnc1C 62a_100000210303_100009819671 [0,1,0,0,0,0|3,0,0]=4 2061 B11R1.17 CCCSc1cncnc1C 62a_100009819671_100000210303 [0,1,0,0,0,0|3,0,0]=4 2062 B11R1.17 CCCSc1cncnc1Cl 62a_100000210303_100000758962 [0,1,0,0,0,0|3,0,0]=4 2063 B11R1.17 CCCSc1cncnc1Cl 62a_100000758962_100000210303 [0,1,0,0,0,0|3,0,0]=4 2064 B11R1.17 CCCSc1cncnc1N 62a_100000210303_100011996079 [0,1,0,0,0,0|3,0,0]=4 2065 B11R1.17 CCCSc1cncnc1N 62a_100011996079_100000210303 [0,1,0,0,0,0|3,0,0]=4 2066 B11R1.17 CCCSc1cncnc1O 62a_100000210303_100000751107 [0,1,0,0,0,0|2,0,0]=3 2067 B11R1.17 CCCSc1cncnc1O 62a_100000751107_100000210303 [0,1,0,0,0,0|2,0,0]=3 2068 B11R1.17 CCCSc1cnncc1N 62a_100000210303_100009829405 [0,1,0,0,0,0|3,0,0]=4 2069 B11R1.17 CCCSc1cnncc1N 62a_100009829405_100000210303 [0,1,0,0,0,0|3,0,0]=4 2070 B11R1.17 CCCSc1ncc[nH]c1=O 62a_100000210303_100000763361 [0,1,0,0,0,0|2,0,1]=4 2071 B11R1.17 CCCSc1ncccc1Br 62a_100000210303_100000696092 [0,1,0,0,0,0|2,0,0]=3 2072 B11R1.17 CCCSc1ncccc1Br 62a_100000696092_100000210303 [0,1,0,0,0,0|2,0,0]=3 2073 B11R1.17 CCCSc1ncccc1C 62a_100000210303_100000751373 [0,1,0,0,0,0|2,0,0]=3 2074 B11R1.17 CCCSc1ncccc1C 62a_100000751373_100000210303 [0,1,0,0,0,0|2,0,0]=3 2075 B11R1.17 CCCSc1ncccc1Cl 62a_100000210303_100011356963 [0,1,0,0,0,0|2,0,0]=3 2076 B11R1.17 CCCSc1ncccc1Cl 62a_100011356963_100000210303 [0,1,0,0,0,0|2,0,0]=3 2077 B11R1.17 CCCSc1ncccc1F 62a_100000210303_100000685392 [0,1,0,0,0,0|2,0,0]=3 2078 B11R1.17 CCCSc1ncccc1F 62a_100000685392_100000210303 [0,1,0,0,0,0|2,0,0]=3 2079 B11R1.17 CCCSc1ncccc1N 62a_100000210303_100000688686 [0,1,0,0,0,0|2,0,0]=3 2080 B11R1.17 CCCSc1ncccc1N 62a_100000688686_100000210303 [0,1,0,0,0,0|2,0,0]=3 2081 B11R1.17 CCCSc1ncccc1O 62a_100000034122_100000210303 [0,1,0,0,0,0|1,0,0]=2 2082 B11R1.17 CCCSc1ncccc1O 62a_100000210303_100000034122 [0,1,0,0,0,0|1,0,0]=2 2083 B11R1.17 CCCSc1nccnc1C 62a_100000210303_100011999405 [0,1,0,0,0,0|3,0,0]=4 2084 B11R1.17 CCCSc1nccnc1C 62a_100011999405_100000210303 [0,1,0,0,0,0|3,0,0]=4 2085 B11R1.17 CCCSc1nccnc1Cl 62a_100000210303_100010886584 [0,1,0,0,0,0|3,0,0]=4 2086 B11R1.17 CCCSc1nccnc1Cl 62a_100010886584_100000210303 [0,1,0,0,0,0|3,0,0]=4 2087 B11R1.17 CCCSc1nccnc1F 62a_100000210303_200010125657 [0,1,0,0,0,0|3,0,0]=4 2088 B11R1.17 CCCSc1nccnc1F 62a_200010125657_100000210303 [0,1,0,0,0,0|3,0,0]=4 2089 B11R1.17 CCCSc1nccnc1N 62a_100000210303_100000747729 [0,1,0,0,0,0|3,0,0]=4 2090 B11R1.17 CCCSc1nccnc1N 62a_100000747729_100000210303 [0,1,0,0,0,0|3,0,0]=4 2091 B11R1.17 CCCSc1ncncc1C 62a_100000210303_100011998708 [0,1,0,0,0,0|3,0,0]=4 2092 B11R1.17 CCCSc1ncncc1C 62a_100011998708_100000210303 [0,1,0,0,0,0|3,0,0]=4 2093 B11R1.17 CCCSc1ncncc1F 62a_100000069762_100000210303 [0,1,0,0,0,0|3,0,0]=4 2094 B11R1.17 CCCSc1ncncc1F 62a_100000210303_100000069762 [0,1,0,0,0,0|3,0,0]=4 2095 B11R1.17 CCCSc1ncncc1N 62a_100000210303_100000709731 [0,1,0,0,0,0|3,0,0]=4 2096 B11R1.17 CCCSc1ncncc1N 62a_100000709731_100000210303 [0,1,0,0,0,0|3,0,0]=4 2097 B11R1.17 CCCSc1nnccc1C 62a_100000210303_100000089043 [0,1,0,0,0,0|3,0,0]=4 2098 B11R1.17 CCNCc1ccccc1Br 207a_100015525214_100000211189 [0,1,0,0,0,0|1,0,0]=2 2099 B11R1.17 CCNCc1ccccc1Br 2230a_100000689332_100000210202 [0,1,0,0,0,0|1,0,0]=2 2100 B11R1.17 CCNCc1ccccc1Br 2230a_100015525214_100000184730 [0,1,0,0,0,0|1,0,0]=2 2101 B11R1.17 CCNCc1ccccc1Br 270004a_100015525214_100000211189 [0,1,0,0,0,0|1,0,0]=2 2102 B11R1.17 CCNCc1ccccc1Br 34a_100000689332_100000210202 [0,1,0,0,0,0|1,0,0]=2 2103 B11R1.17 CCNCc1ccccc1C 207a_100015525214_100000211143 [0,1,0,0,0,0|1,0,0]=2 2104 B11R1.17 CCNCc1ccccc1C 2230a_100015525214_100000211839 [0,1,0,0,0,0|1,0,0]=2 2105 B11R1.17 CCNCc1ccccc1C 270004a_100015525214_100000211143 [0,1,0,0,0,0|1,0,0]=2 2106 B11R1.17 CCNCc1ccccc1C 34a_100000174972_100000210202 [0,1,0,0,0,0|1,0,0]=2 2107 B11R1.17 CCNCc1ccccc1Cl 207a_100015525214_100000210073 [0,1,0,0,0,0|1,0,0]=2 2108 B11R1.17 CCNCc1ccccc1Cl 2230a_100000174879_100000210202 [0,1,0,0,0,0|1,0,0]=2 2109 B11R1.17 CCNCc1ccccc1Cl 2230a_100015525214_100000187162 [0,1,0,0,0,0|1,0,0]=2 2110 B11R1.17 CCNCc1ccccc1Cl 270004a_100015525214_100000210073 [0,1,0,0,0,0|1,0,0]=2 2111 B11R1.17 CCNCc1ccccc1Cl 34a_100000174879_100000210202 [0,1,0,0,0,0|1,0,0]=2 2112 B11R1.17 CCNCc1ccccc1F 207a_100015525214_100000210811 [0,1,0,0,0,0|1,0,0]=2 2113 B11R1.17 CCNCc1ccccc1F 2230a_100015525214_100000211605 [0,1,0,0,0,0|1,0,0]=2 2114 B11R1.17 CCNCc1ccccc1F 270004a_100015525214_100000210811 [0,1,0,0,0,0|1,0,0]=2 2115 B11R1.17 CCNCc1ccccc1F 34a_100000174869_100000210202 [0,1,0,0,0,0|1,0,0]=2 2116 B11R1.17 CCNCc1ccccc1I 207a_100015525214_100000010305 [0,1,0,0,0,0|1,0,0]=2 2117 B11R1.17 CCNCc1ccccc1I 2230a_100015525214_100011215278 [0,1,0,0,0,0|1,0,0]=2 2118 B11R1.17 CCNCc1ccccc1I 270004a_100015525214_100000010305 [0,1,0,0,0,0|1,0,0]=2 2119 B11R1.17 CCNCc1ccccc1O 34a_100000185550_100000210202 [0,1,0,0,0,0|0,0,0]=1 2120 B11R1.17 CCNCc1cccnc1Br 2230a_100009818023_100000210202 [0,1,0,0,0,0|2,0,0]=3 2121 B11R1.17 CCNCc1cccnc1Br 2230a_100015525214_100010140945 [0,1,0,0,0,0|2,0,0]=3 2122 B11R1.17 CCNCc1cccnc1Br 34a_100009818023_100000210202 [0,1,0,0,0,0|2,0,0]=3 2123 B11R1.17 CCNCc1cccnc1C 207a_100015525214_100000751968 [0,1,0,0,0,0|2,0,0]=3 2124 B11R1.17 CCNCc1cccnc1C 2230a_100015525214_100000732876 [0,1,0,0,0,0|2,0,0]=3 2125 B11R1.17 CCNCc1cccnc1C 270004a_100015525214_100000751968 [0,1,0,0,0,0|2,0,0]=3 2126 B11R1.17 CCNCc1cccnc1Cl 2230a_100015189234_100000210202 [0,1,0,0,0,0|2,0,0]=3 2127 B11R1.17 CCNCc1cccnc1Cl 2230a_100015525214_100000045678 [0,1,0,0,0,0|2,0,0]=3 2128 B11R1.17 CCNCc1cccnc1Cl 34a_100015189234_100000210202 [0,1,0,0,0,0|2,0,0]=3 2129 B11R1.17 CCNCc1cccnc1F 2230a_100015525214_100000099810 [0,1,0,0,0,0|2,0,0]=3 2130 B11R1.17 CCNCc1cccnc1F 34a_100000724633_100000210202 [0,1,0,0,0,0|2,0,0]=3 2131 B11R1.17 CCNCc1cccnc1O 207a_100015525214_100011998315 [0,1,0,0,0,0|1,0,0]=2 2132 B11R1.17 CCNCc1cccnc1O 270004a_100015525214_100011998315 [0,1,0,0,0,0|1,0,0]=2 2133 B11R1.17 CCNCc1ccncc1Br 270004a_100015525214_100000755692 [0,1,0,0,0,0|2,0,0]=3 2134 B11R1.17 CCNCc1ccncc1C 2230a_100015525214_100020672808 [0,1,0,0,0,0|2,0,0]=3 2135 B11R1.17 CCNCc1ccncc1Cl 207a_100015525214_100011934409 [0,1,0,0,0,0|2,0,0]=3 2136 B11R1.17 CCNCc1ccncc1Cl 2230a_100015525214_100000763264 [0,1,0,0,0,0|2,0,0]=3 2137 B11R1.17 CCNCc1ccncc1Cl 270004a_100015525214_100011934409 [0,1,0,0,0,0|2,0,0]=3 2138 B11R1.17 CCNCc1ccncc1F 34a_100011935246_100000210202 [0,1,0,0,0,0|2,0,0]=3 2139 B11R1.17 CCNCc1cnccc1Br 270004a_100015525214_100009816821 [0,1,0,0,0,0|2,0,0]=3 2140 B11R1.17 CCNCc1cnccc1C 207a_100015525214_100000685662 [0,1,0,0,0,0|2,0,0]=3 2141 B11R1.17 CCNCc1cnccc1C 2230a_100015525214_100000690890 [0,1,0,0,0,0|2,0,0]=3 2142 B11R1.17 CCNCc1cnccc1C 270004a_100015525214_100000685662 [0,1,0,0,0,0|2,0,0]=3 2143 B11R1.17 CCNCc1cnccc1Cl 270004a_100015525214_100000050567 [0,1,0,0,0,0|2,0,0]=3 2144 B11R1.17 CCNCc1ncccc1Br 207a_100015525214_100011934733 [0,1,0,0,0,0|2,0,0]=3 2145 B11R1.17 CCNCc1ncccc1Br 2230a_100015525214_100025702911 [0,1,0,0,0,0|2,0,0]=3 2146 B11R1.17 CCNCc1ncccc1Br 270004a_100015525214_100011934733 [0,1,0,0,0,0|2,0,0]=3 2147 B11R1.17 CCNCc1ncccc1C 207a_100015525214_100000698913 [0,1,0,0,0,0|2,0,0]=3 2148 B11R1.17 CCNCc1ncccc1C 2230a_100015525214_100000696600 [0,1,0,0,0,0|2,0,0]=3 2149 B11R1.17 CCNCc1ncccc1C 270004a_100015525214_100000698913 [0,1,0,0,0,0|2,0,0]=3 2150 B11R1.17 CCNCc1ncccc1C 34a_100011223789_100000210202 [0,1,0,0,0,0|2,0,0]=3 2151 B11R1.17 CCNCc1ncccc1Cl 207a_100015525214_100012001307 [0,1,0,0,0,0|2,0,0]=3 2152 B11R1.17 CCNCc1ncccc1Cl 2230a_100015189233_100000210202 [0,1,0,0,0,0|2,0,0]=3 2153 B11R1.17 CCNCc1ncccc1Cl 2230a_100015525214_100000099807 [0,1,0,0,0,0|2,0,0]=3 2154 B11R1.17 CCNCc1ncccc1Cl 270004a_100015525214_100012001307 [0,1,0,0,0,0|2,0,0]=3 2155 B11R1.17 CCNCc1ncccc1F 207a_100015525214_100011934734 [0,1,0,0,0,0|2,0,0]=3 2156 B11R1.17 CCNCc1ncccc1F 2230a_100015525214_100000104219 [0,1,0,0,0,0|2,0,0]=3 2157 B11R1.17 CCNCc1ncccc1F 270004a_100015525214_100011934734 [0,1,0,0,0,0|2,0,0]=3 2158 B11R1.17 CCNCc1ncccc1F 34a_100000690088_100000210202 [0,1,0,0,0,0|2,0,0]=3 2159 B11R1.17 CCNCc1nccnc1C 2230a_100020641712_100000210202 [0,1,0,0,0,0|3,0,0]=4 2160 B11R1.17 CCNCc1nccnc1C 270004a_100015525214_100000050726 [0,1,0,0,0,0|3,0,0]=4 2161 B11R1.17 CCNCc1nccnc1C 34a_100020641712_100000210202 [0,1,0,0,0,0|3,0,0]=4 2162 B11R1.17 CCNCc1nccnc1Cl 2230a_100000729963_100000210202 [0,1,0,0,0,0|3,0,0]=4 2163 B11R1.17 CCOCc1ccccc1Br 34a_100000756307_100000210202 [0,1,0,0,0,0|1,0,0]=2 2164 B11R1.17 CCOCc1ccccc1Br 34a_100121572206_100000184730 [0,1,0,0,0,0|1,0,0]=2 2165 B11R1.17 CCOCc1ccccc1Br 7a_100000756307_100000210202 [0,1,0,0,0,0|1,0,0]=2 2166 B11R1.17 CCOCc1ccccc1C 34a_100000698903_100000210202 [0,1,0,0,0,0|1,0,0]=2 2167 B11R1.17 CCOCc1ccccc1C 34a_100121572206_100000211839 [0,1,0,0,0,0|1,0,0]=2 2168 B11R1.17 CCOCc1ccccc1C 7a_100000698903_100000210202 [0,1,0,0,0,0|1,0,0]=2 2169 B11R1.17 CCOCc1ccccc1Cl 34a_100000210847_100000210202 [0,1,0,0,0,0|1,0,0]=2 2170 B11R1.17 CCOCc1ccccc1Cl 34a_100121572206_100000187162 [0,1,0,0,0,0|1,0,0]=2 2171 B11R1.17 CCOCc1ccccc1Cl 7a_100000210847_100000210202 [0,1,0,0,0,0|1,0,0]=2 2172 B11R1.17 CCOCc1ccccc1F 34a_100000211962_100000210202 [0,1,0,0,0,0|1,0,0]=2 2173 B11R1.17 CCOCc1ccccc1F 34a_100121572206_100000211605 [0,1,0,0,0,0|1,0,0]=2 2174 B11R1.17 CCOCc1ccccc1F 7a_100000211962_100000210202 [0,1,0,0,0,0|1,0,0]=2 2175 B11R1.17 CCOCc1ccccc1I 34a_100000187465_100000210202 [0,1,0,0,0,0|1,0,0]=2 2176 B11R1.17 CCOCc1ccccc1I 34a_100121572206_100011215278 [0,1,0,0,0,0|1,0,0]=2 2177 B11R1.17 CCOCc1ccccc1I 7a_100000187465_100000210202 [0,1,0,0,0,0|1,0,0]=2 2178 B11R1.17 CCOCc1ccccc1N 34a_100000212039_100000210202 [0,1,0,0,0,0|1,0,0]=2 2179 B11R1.17 CCOCc1ccccc1O 271570a_203496583355_200011493690 [0,1,0,0,0,0|0,0,0]=1 2180 B11R1.17 CCOCc1cccnc1Br 34a_100000719692_100000210202 [0,1,0,0,0,0|2,0,0]=3 2181 B11R1.17 CCOCc1cccnc1Br 34a_100121572206_100010140945 [0,1,0,0,0,0|2,0,0]=3 2182 B11R1.17 CCOCc1cccnc1Br 7a_100000719692_100000210202 [0,1,0,0,0,0|2,0,0]=3 2183 B11R1.17 CCOCc1cccnc1C 34a_100000729262_100000210202 [0,1,0,0,0,0|2,0,0]=3 2184 B11R1.17 CCOCc1cccnc1C 34a_100121572206_100000732876 [0,1,0,0,0,0|2,0,0]=3 2185 B11R1.17 CCOCc1cccnc1C 7a_100000729262_100000210202 [0,1,0,0,0,0|2,0,0]=3 2186 B11R1.17 CCOCc1cccnc1Cl 34a_100000748726_100000210202 [0,1,0,0,0,0|2,0,0]=3 2187 B11R1.17 CCOCc1cccnc1Cl 34a_100121572206_100000045678 [0,1,0,0,0,0|2,0,0]=3 2188 B11R1.17 CCOCc1cccnc1Cl 7a_100000748726_100000210202 [0,1,0,0,0,0|2,0,0]=3 2189 B11R1.17 CCOCc1cccnc1F 34a_100000079888_100000210202 [0,1,0,0,0,0|2,0,0]=3 2190 B11R1.17 CCOCc1cccnc1F 34a_100121572206_100000099810 [0,1,0,0,0,0|2,0,0]=3 2191 B11R1.17 CCOCc1cccnc1F 7a_100000079888_100000210202 [0,1,0,0,0,0|2,0,0]=3 2192 B11R1.17 CCOCc1ccncc1C 34a_100011997032_100000210202 [0,1,0,0,0,0|2,0,0]=3 2193 B11R1.17 CCOCc1ccncc1C 34a_100121572206_100020672809 [0,1,0,0,0,0|2,0,0]=3 2194 B11R1.17 CCOCc1ccncc1F 34a_100012172863_100000210202 [0,1,0,0,0,0|2,0,0]=3 2195 B11R1.17 CCOCc1cnccc1C 34a_100011996381_100000210202 [0,1,0,0,0,0|2,0,0]=3 2196 B11R1.17 CCOCc1cnccc1C 34a_100121572206_100000690890 [0,1,0,0,0,0|2,0,0]=3 2197 B11R1.17 CCOCc1cnccc1Cl 34a_100000117392_100000210202 [0,1,0,0,0,0|2,0,0]=3 2198 B11R1.17 CCOCc1ncccc1Br 34a_100011996772_100000210202 [0,1,0,0,0,0|2,0,0]=3 2199 B11R1.17 CCOCc1ncccc1Br 34a_100121572206_100025702911 [0,1,0,0,0,0|2,0,0]=3 2200 B11R1.17 CCOCc1ncccc1C 34a_100000698912_100000210202 [0,1,0,0,0,0|2,0,0]=3 2201 B11R1.17 CCOCc1ncccc1C 34a_100121572206_100000696600 [0,1,0,0,0,0|2,0,0]=3 2202 B11R1.17 CCOCc1ncccc1Cl 34a_100012002383_100000210202 [0,1,0,0,0,0|2,0,0]=3 2203 B11R1.17 CCOCc1ncccc1F 34a_100011934865_100000210202 [0,1,0,0,0,0|2,0,0]=3 2204 B11R1.17 CCOCc1ncccc1F 34a_100121572206_100000104219 [0,1,0,0,0,0|2,0,0]=3 2205 B11R1.17 CCOCc1ncccc1N 34a_114873767017_100000210202 [0,1,0,0,0,0|2,0,0]=3 2206 B11R1.17 CCOCc1ncccc1O 34a_100121572206_200020655725 [0,1,0,0,0,0|1,0,0]=2 2207 B11R1.17 CCOCc1nccnc1Cl 34a_100000057004_100000210202 [0,1,0,0,0,0|3,0,0]=4 2208 B11R1.17 CCSCc1ccccc1Br 62a_100000184730_100000210202 [0,1,0,0,0,0|1,0,0]=2 2209 B11R1.17 CCSCc1ccccc1Br 62a_100000210202_100000184730 [0,1,0,0,0,0|1,0,0]=2 2210 B11R1.17 CCSCc1ccccc1C 62a_100000210202_100000211839 [0,1,0,0,0,0|1,0,0]=2 2211 B11R1.17 CCSCc1ccccc1C 62a_100000211839_100000210202 [0,1,0,0,0,0|1,0,0]=2 2212 B11R1.17 CCSCc1ccccc1Cl 62a_100000187162_100000210202 [0,1,0,0,0,0|1,0,0]=2 2213 B11R1.17 CCSCc1ccccc1Cl 62a_100000210202_100000187162 [0,1,0,0,0,0|1,0,0]=2 2214 B11R1.17 CCSCc1ccccc1F 62a_100000210202_100000211605 [0,1,0,0,0,0|1,0,0]=2 2215 B11R1.17 CCSCc1ccccc1F 62a_100000211605_100000210202 [0,1,0,0,0,0|1,0,0]=2 2216 B11R1.17 CCSCc1ccccc1I 62a_100000210202_100011216222 [0,1,0,0,0,0|1,0,0]=2 2217 B11R1.17 CCSCc1ccccc1I 62a_100011216222_100000210202 [0,1,0,0,0,0|1,0,0]=2 2218 B11R1.17 CCSCc1ccccc1O 271570a_203496583355_200000173030 [0,1,0,0,0,0|0,0,0]=1 2219 B11R1.17 CCSCc1cccnc1Br 62a_100000210202_100010140945 [0,1,0,0,0,0|2,0,0]=3 2220 B11R1.17 CCSCc1cccnc1Br 62a_100010140945_100000210202 [0,1,0,0,0,0|2,0,0]=3 2221 B11R1.17 CCSCc1cccnc1C 62a_100000210202_100000732876 [0,1,0,0,0,0|2,0,0]=3 2222 B11R1.17 CCSCc1cccnc1C 62a_100000732876_100000210202 [0,1,0,0,0,0|2,0,0]=3 2223 B11R1.17 CCSCc1cccnc1Cl 62a_100000045678_100000210202 [0,1,0,0,0,0|2,0,0]=3 2224 B11R1.17 CCSCc1cccnc1Cl 62a_100000210202_100000045678 [0,1,0,0,0,0|2,0,0]=3 2225 B11R1.17 CCSCc1cccnc1F 62a_100000099810_100000210202 [0,1,0,0,0,0|2,0,0]=3 2226 B11R1.17 CCSCc1cccnc1F 62a_100000210202_100000099810 [0,1,0,0,0,0|2,0,0]=3 2227 B11R1.17 CCSCc1ccncc1C 62a_100000210202_100020672808 [0,1,0,0,0,0|2,0,0]=3 2228 B11R1.17 CCSCc1ccncc1C 62a_100020672808_100000210202 [0,1,0,0,0,0|2,0,0]=3 2229 B11R1.17 CCSCc1ccncc1Cl 62a_100000210202_100000763264 [0,1,0,0,0,0|2,0,0]=3 2230 B11R1.17 CCSCc1ccncc1Cl 62a_100000763264_100000210202 [0,1,0,0,0,0|2,0,0]=3 2231 B11R1.17 CCSCc1cnccc1C 62a_100000210202_100000690890 [0,1,0,0,0,0|2,0,0]=3 2232 B11R1.17 CCSCc1cnccc1C 62a_100000690890_100000210202 [0,1,0,0,0,0|2,0,0]=3 2233 B11R1.17 CCSCc1ncccc1Br 62a_100000210202_100025702911 [0,1,0,0,0,0|2,0,0]=3 2234 B11R1.17 CCSCc1ncccc1Br 62a_100025702911_100000210202 [0,1,0,0,0,0|2,0,0]=3 2235 B11R1.17 CCSCc1ncccc1C 62a_100000210202_100000696600 [0,1,0,0,0,0|2,0,0]=3 2236 B11R1.17 CCSCc1ncccc1C 62a_100000696600_100000210202 [0,1,0,0,0,0|2,0,0]=3 2237 B11R1.17 CCSCc1ncccc1Cl 62a_100000099807_100000210202 [0,1,0,0,0,0|2,0,0]=3 2238 B11R1.17 CCSCc1ncccc1Cl 62a_100000210202_100000099807 [0,1,0,0,0,0|2,0,0]=3 2239 B11R1.17 CCSCc1ncccc1F 62a_100000104219_100000210202 [0,1,0,0,0,0|2,0,0]=3 2240 B11R1.17 CCSCc1ncccc1F 62a_100000210202_100000104219 [0,1,0,0,0,0|2,0,0]=3 2241 B11R1.17 CCSCc1ncccc1O 62a_100000210202_200020655725 [0,1,0,0,0,0|1,0,0]=2 2242 B11R1.17 CCSCc1ncccc1O 62a_200020655725_100000210202 [0,1,0,0,0,0|1,0,0]=2 2243 B11R1.17 CNCCc1ccccc1Br 2230a_100000747383_200000210301 [0,1,0,0,0,0|1,0,0]=2 2244 B11R1.17 CNCCc1ccccc1Br 2230a_106832991635_100012161201 [0,1,0,0,0,0|1,0,0]=2 2245 B11R1.17 CNCCc1ccccc1Br 34a_100000747383_200000210301 [0,1,0,0,0,0|1,0,0]=2 2246 B11R1.17 CNCCc1ccccc1Br 34a_100102657272_100012161201 [0,1,0,0,0,0|1,0,0]=2 2247 B11R1.17 CNCCc1ccccc1Br 7a_106832991635_100012161201 [0,1,0,0,0,0|1,0,0]=2 2248 B11R1.17 CNCCc1ccccc1C 2230a_100000685071_200000210301 [0,1,0,0,0,0|1,0,0]=2 2249 B11R1.17 CNCCc1ccccc1C 2230a_106832991635_100011713688 [0,1,0,0,0,0|1,0,0]=2 2250 B11R1.17 CNCCc1ccccc1C 34a_100000685071_200000210301 [0,1,0,0,0,0|1,0,0]=2 2251 B11R1.17 CNCCc1ccccc1C 34a_100102657272_100011713688 [0,1,0,0,0,0|1,0,0]=2 2252 B11R1.17 CNCCc1ccccc1C 7a_106832991635_100011713688 [0,1,0,0,0,0|1,0,0]=2 2253 B11R1.17 CNCCc1ccccc1Cl 2230a_100011207228_200000210301 [0,1,0,0,0,0|1,0,0]=2 2254 B11R1.17 CNCCc1ccccc1Cl 2230a_106832991635_100011713703 [0,1,0,0,0,0|1,0,0]=2 2255 B11R1.17 CNCCc1ccccc1Cl 270004a_106832991635_200011713468 [0,1,0,0,0,0|1,0,0]=2 2256 B11R1.17 CNCCc1ccccc1Cl 34a_100011207228_200000210301 [0,1,0,0,0,0|1,0,0]=2 2257 B11R1.17 CNCCc1ccccc1Cl 34a_100102657272_100011713703 [0,1,0,0,0,0|1,0,0]=2 2258 B11R1.17 CNCCc1ccccc1Cl 7a_106832991635_100011713703 [0,1,0,0,0,0|1,0,0]=2 2259 B11R1.17 CNCCc1ccccc1F 2230a_100000185272_200000210301 [0,1,0,0,0,0|1,0,0]=2 2260 B11R1.17 CNCCc1ccccc1F 2230a_106832991635_100011713696 [0,1,0,0,0,0|1,0,0]=2 2261 B11R1.17 CNCCc1ccccc1F 34a_100000185272_200000210301 [0,1,0,0,0,0|1,0,0]=2 2262 B11R1.17 CNCCc1ccccc1F 34a_100102657272_100000720011 [0,1,0,0,0,0|1,0,0]=2 2263 B11R1.17 CNCCc1ccccc1F 7a_106832991635_100000720011 [0,1,0,0,0,0|1,0,0]=2 2264 B11R1.17 CNCCc1ccccc1O 34a_100011207237_200000210301 [0,1,0,0,0,0|0,0,0]=1 2265 B11R1.17 CNCCc1ccccc1O 34a_100102657272_100000722297 [0,1,0,0,0,0|0,0,0]=1 2266 B11R1.17 CNCCc1ccccc1O 7a_106832991635_100000722297 [0,1,0,0,0,0|0,0,0]=1 2267 B11R1.17 CNCCn1ccccc1=O 2230a_100000687133_200000210301 [0,1,0,0,0,0|1,0,1]=3 2268 B11R1.17 COCCc1ccccc1Br 34a_100000731337_200000210301 [0,1,0,0,0,0|1,0,0]=2 2269 B11R1.17 COCCc1ccccc1Br 34a_100138415774_100012161201 [0,1,0,0,0,0|1,0,0]=2 2270 B11R1.17 COCCc1ccccc1Br 7a_100000731337_200000210301 [0,1,0,0,0,0|1,0,0]=2 2271 B11R1.17 COCCc1ccccc1C 34a_100011220023_200000210301 [0,1,0,0,0,0|1,0,0]=2 2272 B11R1.17 COCCc1ccccc1C 34a_100138415774_100011713688 [0,1,0,0,0,0|1,0,0]=2 2273 B11R1.17 COCCc1ccccc1C 7a_100011220023_200000210301 [0,1,0,0,0,0|1,0,0]=2 2274 B11R1.17 COCCc1ccccc1Cl 34a_100011215284_200000210301 [0,1,0,0,0,0|1,0,0]=2 2275 B11R1.17 COCCc1ccccc1Cl 34a_100138415774_100011713703 [0,1,0,0,0,0|1,0,0]=2 2276 B11R1.17 COCCc1ccccc1Cl 7a_100011215284_200000210301 [0,1,0,0,0,0|1,0,0]=2 2277 B11R1.17 COCCc1ccccc1F 34a_100000753711_200000210301 [0,1,0,0,0,0|1,0,0]=2 2278 B11R1.17 COCCc1ccccc1F 34a_100138415774_100000720011 [0,1,0,0,0,0|1,0,0]=2 2279 B11R1.17 COCCc1ccccc1F 7a_100000753711_200000210301 [0,1,0,0,0,0|1,0,0]=2 2280 B11R1.17 COCCc1ccccc1I 34a_100010255290_200000210301 [0,1,0,0,0,0|1,0,0]=2 2281 B11R1.17 COCCc1ccccc1I 7a_100010255290_200000210301 [0,1,0,0,0,0|1,0,0]=2 2282 B11R1.17 COCCc1ccccc1N 34a_100011215289_200000210301 [0,1,0,0,0,0|1,0,0]=2 2283 B11R1.17 COCCc1ccccc1O 34a_100138415774_100000722297 [0,1,0,0,0,0|0,0,0]=1 2284 B11R1.17 COCCc1ncccc1C 34a_100011997706_200000210301 [0,1,0,0,0,0|2,0,0]=3 2285 B11R1.17 COCCc1ncccc1C 7a_100011997706_200000210301 [0,1,0,0,0,0|2,0,0]=3 2286 B11R1.17 COCOc1ccccc1O 271570a_203496583355_200000230759 [0,1,0,0,0,0|1,0,0]=2 2287 B11R1.17 COCOc1cccnc1O 271570a_203496583355_100011935308 [0,1,0,0,0,0|2,0,0]=3 2288 B11R1.17 COCSc1c[nH]ccc1=O 62a_100000766300_100009998708 [0,1,0,0,0,0|2,0,1]=4 2289 B11R1.17 COCSc1c[nH]ccc1=O 62a_100009998708_100000766300 [0,1,0,0,0,0|2,0,1]=4 2290 B11R1.17 COCSc1c[nH]ccc1=S 62a_100000766300_200012280681 [0,1,0,0,0,0|2,1,0]=4 2291 B11R1.17 COCSc1c[nH]ccc1=S 62a_200012280681_100000766300 [0,1,0,0,0,0|2,1,0]=4 2292 B11R1.17 COCSc1cccc[n+]1C 62a_100000766300_100000212160 [0,1,0,0,0,0|3,0,0]=4 2293 B11R1.17 COCSc1cccc[n+]1[O-] 62a_100000766300_200000042595 [0,1,0,0,0,0|2,0,1]=4 2294 B11R1.17 COCSc1ccccc1Br 62a_100000695589_100000766300 [0,1,0,0,0,0|2,0,0]=3 2295 B11R1.17 COCSc1ccccc1Br 62a_100000766300_100000695589 [0,1,0,0,0,0|2,0,0]=3 2296 B11R1.17 COCSc1ccccc1C 62a_100000210755_100000766300 [0,1,0,0,0,0|2,0,0]=3 2297 B11R1.17 COCSc1ccccc1C 62a_100000766300_100000210755 [0,1,0,0,0,0|2,0,0]=3 2298 B11R1.17 COCSc1ccccc1Cl 62a_100000764095_100000766300 [0,1,0,0,0,0|2,0,0]=3 2299 B11R1.17 COCSc1ccccc1Cl 62a_100000766300_100000764095 [0,1,0,0,0,0|2,0,0]=3 2300 B11R1.17 COCSc1ccccc1F 62a_100000766300_100011215700 [0,1,0,0,0,0|2,0,0]=3 2301 B11R1.17 COCSc1ccccc1F 62a_100011215700_100000766300 [0,1,0,0,0,0|2,0,0]=3 2302 B11R1.17 COCSc1ccccc1N 62a_100000210017_100000766300 [0,1,0,0,0,0|2,0,0]=3 2303 B11R1.17 COCSc1ccccc1N 62a_100000766300_100000210017 [0,1,0,0,0,0|2,0,0]=3 2304 B11R1.17 COCSc1ccccc1O 62a_100000739446_100000766300 [0,1,0,0,0,0|1,0,0]=2 2305 B11R1.17 COCSc1ccccc1O 62a_100000766300_100000739446 [0,1,0,0,0,0|1,0,0]=2 2306 B11R1.17 COCSc1cccnc1Br 62a_100000766300_100010202626 [0,1,0,0,0,0|3,0,0]=4 2307 B11R1.17 COCSc1cccnc1Br 62a_100010202626_100000766300 [0,1,0,0,0,0|3,0,0]=4 2308 B11R1.17 COCSc1cccnc1C 62a_100000751574_100000766300 [0,1,0,0,0,0|3,0,0]=4 2309 B11R1.17 COCSc1cccnc1C 62a_100000766300_100000751574 [0,1,0,0,0,0|3,0,0]=4 2310 B11R1.17 COCSc1cccnc1Cl 62a_100000036424_100000766300 [0,1,0,0,0,0|3,0,0]=4 2311 B11R1.17 COCSc1cccnc1Cl 62a_100000766300_100000036424 [0,1,0,0,0,0|3,0,0]=4 2312 B11R1.17 COCSc1cccnc1F 62a_100000766300_100009816115 [0,1,0,0,0,0|3,0,0]=4 2313 B11R1.17 COCSc1cccnc1F 62a_100009816115_100000766300 [0,1,0,0,0,0|3,0,0]=4 2314 B11R1.17 COCSc1cccnc1N 62a_100000045569_100000766300 [0,1,0,0,0,0|3,0,0]=4 2315 B11R1.17 COCSc1cccnc1N 62a_100000766300_100000045569 [0,1,0,0,0,0|3,0,0]=4 2316 B11R1.17 COCSc1cccnc1O 62a_100000760158_100000766300 [0,1,0,0,0,0|2,0,0]=3 2317 B11R1.17 COCSc1cccnc1O 62a_100000766300_100000760158 [0,1,0,0,0,0|2,0,0]=3 2318 B11R1.17 COCSc1ccncc1Br 62a_100000726257_100000766300 [0,1,0,0,0,0|3,0,0]=4 2319 B11R1.17 COCSc1ccncc1Br 62a_100000766300_100000726257 [0,1,0,0,0,0|3,0,0]=4 2320 B11R1.17 COCSc1ccncc1C 62a_100000765111_100000766300 [0,1,0,0,0,0|3,0,0]=4 2321 B11R1.17 COCSc1ccncc1C 62a_100000766300_100000765111 [0,1,0,0,0,0|3,0,0]=4 2322 B11R1.17 COCSc1ccncc1Cl 62a_100000708259_100000766300 [0,1,0,0,0,0|3,0,0]=4 2323 B11R1.17 COCSc1ccncc1Cl 62a_100000766300_100000708259 [0,1,0,0,0,0|3,0,0]=4 2324 B11R1.17 COCSc1ccncc1F 62a_100000047030_100000766300 [0,1,0,0,0,0|3,0,0]=4 2325 B11R1.17 COCSc1ccncc1F 62a_100000766300_100000047030 [0,1,0,0,0,0|3,0,0]=4 2326 B11R1.17 COCSc1ccncc1N 62a_100000756074_100000766300 [0,1,0,0,0,0|3,0,0]=4 2327 B11R1.17 COCSc1ccncc1N 62a_100000766300_100000756074 [0,1,0,0,0,0|3,0,0]=4 2328 B11R1.17 COCSc1ccncc1O 62a_100000766300_100009817591 [0,1,0,0,0,0|2,0,0]=3 2329 B11R1.17 COCSc1ccncc1O 62a_100009817591_100000766300 [0,1,0,0,0,0|2,0,0]=3 2330 B11R1.17 COCSc1cnccc1Br 62a_100000766300_100010138639 [0,1,0,0,0,0|3,0,0]=4 2331 B11R1.17 COCSc1cnccc1Br 62a_100010138639_100000766300 [0,1,0,0,0,0|3,0,0]=4 2332 B11R1.17 COCSc1cnccc1C 62a_100000761580_100000766300 [0,1,0,0,0,0|3,0,0]=4 2333 B11R1.17 COCSc1cnccc1C 62a_100000766300_100000761580 [0,1,0,0,0,0|3,0,0]=4 2334 B11R1.17 COCSc1cnccc1Cl 62a_100000766300_100009995489 [0,1,0,0,0,0|3,0,0]=4 2335 B11R1.17 COCSc1cnccc1Cl 62a_100009995489_100000766300 [0,1,0,0,0,0|3,0,0]=4 2336 B11R1.17 COCSc1cnccc1F 62a_100000766300_100009820683 [0,1,0,0,0,0|3,0,0]=4 2337 B11R1.17 COCSc1cnccc1F 62a_100009820683_100000766300 [0,1,0,0,0,0|3,0,0]=4 2338 B11R1.17 COCSc1cnccc1N 62a_100000047001_100000766300 [0,1,0,0,0,0|3,0,0]=4 2339 B11R1.17 COCSc1cnccc1N 62a_100000766300_100000047001 [0,1,0,0,0,0|3,0,0]=4 2340 B11R1.17 COCSc1cncnc1O 62a_100000751107_100000766300 [0,1,0,0,0,0|3,0,0]=4 2341 B11R1.17 COCSc1cncnc1O 62a_100000766300_100000751107 [0,1,0,0,0,0|3,0,0]=4 2342 B11R1.17 COCSc1ncccc1Br 62a_100000696092_100000766300 [0,1,0,0,0,0|3,0,0]=4 2343 B11R1.17 COCSc1ncccc1Br 62a_100000766300_100000696092 [0,1,0,0,0,0|3,0,0]=4 2344 B11R1.17 COCSc1ncccc1C 62a_100000751373_100000766300 [0,1,0,0,0,0|3,0,0]=4 2345 B11R1.17 COCSc1ncccc1C 62a_100000766300_100000751373 [0,1,0,0,0,0|3,0,0]=4 2346 B11R1.17 COCSc1ncccc1Cl 62a_100000766300_100011356963 [0,1,0,0,0,0|3,0,0]=4 2347 B11R1.17 COCSc1ncccc1Cl 62a_100011356963_100000766300 [0,1,0,0,0,0|3,0,0]=4 2348 B11R1.17 COCSc1ncccc1F 62a_100000685392_100000766300 [0,1,0,0,0,0|3,0,0]=4 2349 B11R1.17 COCSc1ncccc1F 62a_100000766300_100000685392 [0,1,0,0,0,0|3,0,0]=4 2350 B11R1.17 COCSc1ncccc1N 62a_100000688686_100000766300 [0,1,0,0,0,0|3,0,0]=4 2351 B11R1.17 COCSc1ncccc1N 62a_100000766300_100000688686 [0,1,0,0,0,0|3,0,0]=4 2352 B11R1.17 COCSc1ncccc1O 62a_100000034122_100000766300 [0,1,0,0,0,0|2,0,0]=3 2353 B11R1.17 COCSc1ncccc1O 62a_100000766300_100000034122 [0,1,0,0,0,0|2,0,0]=3 2354 B11R1.17 CSCCc1ccccc1Br 62a_100012161201_200000210301 [0,1,0,0,0,0|1,0,0]=2 2355 B11R1.17 CSCCc1ccccc1Br 62a_200000210301_100012161201 [0,1,0,0,0,0|1,0,0]=2 2356 B11R1.17 CSCCc1ccccc1C 62a_100011713688_200000210301 [0,1,0,0,0,0|1,0,0]=2 2357 B11R1.17 CSCCc1ccccc1C 62a_200000210301_100011713688 [0,1,0,0,0,0|1,0,0]=2 2358 B11R1.17 CSCCc1ccccc1Cl 62a_100011713703_200000210301 [0,1,0,0,0,0|1,0,0]=2 2359 B11R1.17 CSCCc1ccccc1Cl 62a_200000210301_100011713703 [0,1,0,0,0,0|1,0,0]=2 2360 B11R1.17 CSCCc1ccccc1F 62a_100011713696_200000210301 [0,1,0,0,0,0|1,0,0]=2 2361 B11R1.17 CSCCc1ccccc1F 62a_200000210301_100011713696 [0,1,0,0,0,0|1,0,0]=2 2362 B11R1.17 CSCCc1ccccc1O 62a_100000722297_200000210301 [0,1,0,0,0,0|0,0,0]=1 2363 B11R1.17 CSCCc1ccccc1O 62a_200000210301_100000722297 [0,1,0,0,0,0|0,0,0]=1 2364 B11R1.17 CSCNc1ccccc1Br 34a_100000210017_100011218213 [0,1,0,0,0,0|2,0,0]=3 2365 B11R1.17 CSCNc1ccccc1C 34a_100015192222_100011218213 [0,1,0,0,0,0|2,0,0]=3 2366 B11R1.17 CSCNc1ccccc1Cl 34a_100000185783_100011218213 [0,1,0,0,0,0|2,0,0]=3 2367 B11R1.17 CSCNc1ccccc1F 34a_100000210422_100011218213 [0,1,0,0,0,0|2,0,0]=3 2368 B11R1.17 CSCNc1ccccc1I 34a_100000210053_100011218213 [0,1,0,0,0,0|2,0,0]=3 2369 B11R1.17 CSCNc1ccccc1O 34a_100000185747_100011218213 [0,1,0,0,0,0|1,0,0]=2 2370 B11R1.17 CSCOc1ccccc1Br 34a_100000181306_100011218213 [0,1,0,0,0,0|2,0,0]=3 2371 B11R1.17 CSCOc1ccccc1C 34a_100000210338_100011218213 [0,1,0,0,0,0|2,0,0]=3 2372 B11R1.17 CSCOc1ccccc1Cl 34a_100000210172_100011218213 [0,1,0,0,0,0|2,0,0]=3 2373 B11R1.17 CSCOc1ccccc1F 34a_100000210171_100011218213 [0,1,0,0,0,0|2,0,0]=3 2374 B11R1.17 CSCOc1ccccc1I 34a_100000739446_100011218213 [0,1,0,0,0,0|2,0,0]=3 2375 B11R1.17 CSCOc1ccccc1N 34a_100000185747_100011218213 [0,1,0,0,0,0|2,0,0]=3 2376 B11R1.17 CSCOc1cccnc1Br 34a_100000744436_100011218213 [0,1,0,0,0,0|3,0,0]=4 2377 B11R1.17 CSCOc1cccnc1C 34a_100000745507_100011218213 [0,1,0,0,0,0|3,0,0]=4 2378 B11R1.17 CSCOc1cccnc1Cl 34a_100000757616_100011218213 [0,1,0,0,0,0|3,0,0]=4 2379 B11R1.17 CSCOc1cccnc1F 34a_100000061740_100011218213 [0,1,0,0,0,0|3,0,0]=4 2380 B11R1.17 CSCOc1cccnc1I 34a_100000034122_100011218213 [0,1,0,0,0,0|3,0,0]=4 2381 B11R1.17 CSCOc1cccnc1N 34a_100000211975_100011218213 [0,1,0,0,0,0|3,0,0]=4 2382 B11R1.17 CSCOc1cccoc1=O 34a_100000077404_100011218213 [0,1,0,0,0,0|2,0,1]=4 2383 B11R1.17 CSCOc1ccncc1Br 34a_100011996408_100011218213 [0,1,0,0,0,0|3,0,0]=4 2384 B11R1.17 CSCOc1ccncc1C 34a_100000694293_100011218213 [0,1,0,0,0,0|3,0,0]=4 2385 B11R1.17 CSCOc1ccncc1Cl 34a_100011997054_100011218213 [0,1,0,0,0,0|3,0,0]=4 2386 B11R1.17 CSCOc1ccncc1F 34a_200000081243_100011218213 [0,1,0,0,0,0|3,0,0]=4 2387 B11R1.17 CSCOc1cnccc1C 34a_100011997053_100011218213 [0,1,0,0,0,0|3,0,0]=4 2388 B11R1.17 CSCOc1cnccc1Cl 34a_100011996695_100011218213 [0,1,0,0,0,0|3,0,0]=4 2389 B11R1.17 CSCOc1cnccc1I 34a_100000050107_100011218213 [0,1,0,0,0,0|3,0,0]=4 2390 B11R1.17 CSCOc1cnccc1N 34a_100000753702_100011218213 [0,1,0,0,0,0|3,0,0]=4 2391 B11R1.17 CSCOc1coccc1=O 34a_100000060831_100011218213 [0,1,0,0,0,0|2,0,1]=4 2392 B11R1.17 CSCOc1ncccc1Cl 34a_100011290957_100011218213 [0,1,0,0,0,0|3,0,0]=4 2393 B11R1.17 CSCOc1ncccc1F 34a_100011219419_100011218213 [0,1,0,0,0,0|3,0,0]=4 2394 B11R1.17 CSCOc1ncccc1N 34a_100000746358_100011218213 [0,1,0,0,0,0|3,0,0]=4 2395 B11R1.17 CSCSc1c[nH]ccc1=O 62a_100009998708_100011218213 [0,1,0,0,0,0|2,0,1]=4 2396 B11R1.17 CSCSc1c[nH]ccc1=O 62a_100011218213_100009998708 [0,1,0,0,0,0|2,0,1]=4 2397 B11R1.17 CSCSc1c[nH]ccc1=S 62a_100011218213_200012280681 [0,1,0,0,0,0|2,1,0]=4 2398 B11R1.17 CSCSc1c[nH]ccc1=S 62a_200012280681_100011218213 [0,1,0,0,0,0|2,1,0]=4 2399 B11R1.17 CSCSc1cccc[n+]1C 62a_100011218213_100000212160 [0,1,0,0,0,0|3,0,0]=4 2400 B11R1.17 CSCSc1cccc[n+]1[O-] 62a_100011218213_200000042595 [0,1,0,0,0,0|2,0,1]=4 2401 B11R1.17 CSCSc1ccccc1Br 62a_100000695589_100011218213 [0,1,0,0,0,0|2,0,0]=3 2402 B11R1.17 CSCSc1ccccc1Br 62a_100011218213_100000695589 [0,1,0,0,0,0|2,0,0]=3 2403 B11R1.17 CSCSc1ccccc1C 62a_100000210755_100011218213 [0,1,0,0,0,0|2,0,0]=3 2404 B11R1.17 CSCSc1ccccc1C 62a_100011218213_100000210755 [0,1,0,0,0,0|2,0,0]=3 2405 B11R1.17 CSCSc1ccccc1Cl 62a_100000764095_100011218213 [0,1,0,0,0,0|2,0,0]=3 2406 B11R1.17 CSCSc1ccccc1Cl 62a_100011218213_100000764095 [0,1,0,0,0,0|2,0,0]=3 2407 B11R1.17 CSCSc1ccccc1F 62a_100011215700_100011218213 [0,1,0,0,0,0|2,0,0]=3 2408 B11R1.17 CSCSc1ccccc1F 62a_100011218213_100011215700 [0,1,0,0,0,0|2,0,0]=3 2409 B11R1.17 CSCSc1ccccc1N 62a_100000210017_100011218213 [0,1,0,0,0,0|2,0,0]=3 2410 B11R1.17 CSCSc1ccccc1N 62a_100011218213_100000210017 [0,1,0,0,0,0|2,0,0]=3 2411 B11R1.17 CSCSc1ccccc1O 62a_100000739446_100011218213 [0,1,0,0,0,0|1,0,0]=2 2412 B11R1.17 CSCSc1ccccc1O 62a_100011218213_100000739446 [0,1,0,0,0,0|1,0,0]=2 2413 B11R1.17 CSCSc1cccnc1Br 62a_100010202626_100011218213 [0,1,0,0,0,0|3,0,0]=4 2414 B11R1.17 CSCSc1cccnc1Br 62a_100011218213_100010202626 [0,1,0,0,0,0|3,0,0]=4 2415 B11R1.17 CSCSc1cccnc1C 62a_100000751574_100011218213 [0,1,0,0,0,0|3,0,0]=4 2416 B11R1.17 CSCSc1cccnc1C 62a_100011218213_100000751574 [0,1,0,0,0,0|3,0,0]=4 2417 B11R1.17 CSCSc1cccnc1Cl 62a_100000036424_100011218213 [0,1,0,0,0,0|3,0,0]=4 2418 B11R1.17 CSCSc1cccnc1Cl 62a_100011218213_100000036424 [0,1,0,0,0,0|3,0,0]=4 2419 B11R1.17 CSCSc1cccnc1F 62a_100009816115_100011218213 [0,1,0,0,0,0|3,0,0]=4 2420 B11R1.17 CSCSc1cccnc1F 62a_100011218213_100009816115 [0,1,0,0,0,0|3,0,0]=4 2421 B11R1.17 CSCSc1cccnc1N 62a_100000045569_100011218213 [0,1,0,0,0,0|3,0,0]=4 2422 B11R1.17 CSCSc1cccnc1N 62a_100011218213_100000045569 [0,1,0,0,0,0|3,0,0]=4 2423 B11R1.17 CSCSc1cccnc1O 62a_100000760158_100011218213 [0,1,0,0,0,0|2,0,0]=3 2424 B11R1.17 CSCSc1cccnc1O 62a_100011218213_100000760158 [0,1,0,0,0,0|2,0,0]=3 2425 B11R1.17 CSCSc1ccncc1Br 62a_100000726257_100011218213 [0,1,0,0,0,0|3,0,0]=4 2426 B11R1.17 CSCSc1ccncc1Br 62a_100011218213_100000726257 [0,1,0,0,0,0|3,0,0]=4 2427 B11R1.17 CSCSc1ccncc1C 62a_100000765111_100011218213 [0,1,0,0,0,0|3,0,0]=4 2428 B11R1.17 CSCSc1ccncc1C 62a_100011218213_100000765111 [0,1,0,0,0,0|3,0,0]=4 2429 B11R1.17 CSCSc1ccncc1Cl 62a_100000708259_100011218213 [0,1,0,0,0,0|3,0,0]=4 2430 B11R1.17 CSCSc1ccncc1Cl 62a_100011218213_100000708259 [0,1,0,0,0,0|3,0,0]=4 2431 B11R1.17 CSCSc1ccncc1F 62a_100000047030_100011218213 [0,1,0,0,0,0|3,0,0]=4 2432 B11R1.17 CSCSc1ccncc1F 62a_100011218213_100000047030 [0,1,0,0,0,0|3,0,0]=4 2433 B11R1.17 CSCSc1ccncc1N 62a_100000756074_100011218213 [0,1,0,0,0,0|3,0,0]=4 2434 B11R1.17 CSCSc1ccncc1N 62a_100011218213_100000756074 [0,1,0,0,0,0|3,0,0]=4 2435 B11R1.17 CSCSc1ccncc1O 62a_100009817591_100011218213 [0,1,0,0,0,0|2,0,0]=3 2436 B11R1.17 CSCSc1ccncc1O 62a_100011218213_100009817591 [0,1,0,0,0,0|2,0,0]=3 2437 B11R1.17 CSCSc1cnccc1Br 62a_100010138639_100011218213 [0,1,0,0,0,0|3,0,0]=4 2438 B11R1.17 CSCSc1cnccc1Br 62a_100011218213_100010138639 [0,1,0,0,0,0|3,0,0]=4 2439 B11R1.17 CSCSc1cnccc1C 62a_100000761580_100011218213 [0,1,0,0,0,0|3,0,0]=4 2440 B11R1.17 CSCSc1cnccc1C 62a_100011218213_100000761580 [0,1,0,0,0,0|3,0,0]=4 2441 B11R1.17 CSCSc1cnccc1Cl 62a_100009995489_100011218213 [0,1,0,0,0,0|3,0,0]=4 2442 B11R1.17 CSCSc1cnccc1Cl 62a_100011218213_100009995489 [0,1,0,0,0,0|3,0,0]=4 2443 B11R1.17 CSCSc1cnccc1F 62a_100009820683_100011218213 [0,1,0,0,0,0|3,0,0]=4 2444 B11R1.17 CSCSc1cnccc1F 62a_100011218213_100009820683 [0,1,0,0,0,0|3,0,0]=4 2445 B11R1.17 CSCSc1cnccc1N 62a_100000047001_100011218213 [0,1,0,0,0,0|3,0,0]=4 2446 B11R1.17 CSCSc1cnccc1N 62a_100011218213_100000047001 [0,1,0,0,0,0|3,0,0]=4 2447 B11R1.17 CSCSc1cncnc1O 62a_100000751107_100011218213 [0,1,0,0,0,0|3,0,0]=4 2448 B11R1.17 CSCSc1cncnc1O 62a_100011218213_100000751107 [0,1,0,0,0,0|3,0,0]=4 2449 B11R1.17 CSCSc1ncccc1Br 62a_100000696092_100011218213 [0,1,0,0,0,0|3,0,0]=4 2450 B11R1.17 CSCSc1ncccc1Br 62a_100011218213_100000696092 [0,1,0,0,0,0|3,0,0]=4 2451 B11R1.17 CSCSc1ncccc1C 62a_100000751373_100011218213 [0,1,0,0,0,0|3,0,0]=4 2452 B11R1.17 CSCSc1ncccc1C 62a_100011218213_100000751373 [0,1,0,0,0,0|3,0,0]=4 2453 B11R1.17 CSCSc1ncccc1Cl 62a_100011218213_100011356963 [0,1,0,0,0,0|3,0,0]=4 2454 B11R1.17 CSCSc1ncccc1Cl 62a_100011356963_100011218213 [0,1,0,0,0,0|3,0,0]=4 2455 B11R1.17 CSCSc1ncccc1F 62a_100000685392_100011218213 [0,1,0,0,0,0|3,0,0]=4 2456 B11R1.17 CSCSc1ncccc1F 62a_100011218213_100000685392 [0,1,0,0,0,0|3,0,0]=4 2457 B11R1.17 CSCSc1ncccc1N 62a_100000688686_100011218213 [0,1,0,0,0,0|3,0,0]=4 2458 B11R1.17 CSCSc1ncccc1N 62a_100011218213_100000688686 [0,1,0,0,0,0|3,0,0]=4 2459 B11R1.17 CSCSc1ncccc1O 62a_100000034122_100011218213 [0,1,0,0,0,0|2,0,0]=3 2460 B11R1.17 CSCSc1ncccc1O 62a_100011218213_100000034122 [0,1,0,0,0,0|2,0,0]=3 2461 B11R1.17 C[n+]1ccccc1SCCF 62a_100011217306_100000212160 [0,1,0,0,0,0|3,0,0]=4 2462 B11R1.17 C[n+]1ccccc1SCCO 62a_100000211926_100000212160 [0,1,0,0,0,0|3,0,0]=4 2463 B11R1.17 Cc1ccccc1CCN[13CH3] 2230a_100000685071_200025704644 [0,1,0,0,0,0|1,0,0]=2 2464 B11R1.17 Cc1ccccc1CCN[13CH3] 34a_100000685071_200025704644 [0,1,0,0,0,0|1,0,0]=2 2465 B11R1.17 Cc1ccccc1CCO[13CH3] 34a_100011220023_200025704644 [0,1,0,0,0,0|1,0,0]=2 2466 B11R1.17 Cc1ccccc1CCO[13CH3] 7a_100011220023_200025704644 [0,1,0,0,0,0|1,0,0]=2 2467 B11R1.17 Cc1ccccc1CCS[13CH3] 62a_100011713688_200025704644 [0,1,0,0,0,0|1,0,0]=2 2468 B11R1.17 Cc1ccccc1CCS[13CH3] 62a_200025704644_100011713688 [0,1,0,0,0,0|1,0,0]=2 2469 B11R1.17 Cc1ccccc1CNCF 34a_100000174972_100015361967 [0,1,0,0,0,0|2,0,0]=3 2470 B11R1.17 Cc1ccccc1COCF 34a_100000698903_100015361967 [0,1,0,0,0,0|2,0,0]=3 2471 B11R1.17 Cc1ccccc1COCF 7a_100000698903_100015361967 [0,1,0,0,0,0|2,0,0]=3 2472 B11R1.17 Cc1ccccc1CSCF 62a_100000211839_100015361967 [0,1,0,0,0,0|2,0,0]=3 2473 B11R1.17 Cc1ccccc1CSCF 62a_100015361967_100000211839 [0,1,0,0,0,0|2,0,0]=3 2474 B11R1.17 Cc1ccccc1NCC=O 34a_100015192222_200009817547 [0,1,0,0,0,0|2,0,1]=4 2475 B11R1.17 Cc1ccccc1NCCF 34a_100015192222_100011217306 [0,1,0,0,0,0|2,0,0]=3 2476 B11R1.17 Cc1ccccc1NCCO 34a_100015192222_100000211926 [0,1,0,0,0,0|2,0,0]=3 2477 B11R1.17 Cc1ccccc1OCC#N 7a_100000210338_100011215382 [0,1,0,0,0,0|2,0,1]=4 2478 B11R1.17 Cc1ccccc1OCC=O 34a_100000210338_200009817547 [0,1,0,0,0,0|2,0,1]=4 2479 B11R1.17 Cc1ccccc1OCC=O 7a_100000210338_200015260668 [0,1,0,0,0,0|2,0,1]=4 2480 B11R1.17 Cc1ccccc1OCCF 34a_100000210338_100011217306 [0,1,0,0,0,0|2,0,0]=3 2481 B11R1.17 Cc1ccccc1OCCF 7a_100000210338_100011217306 [0,1,0,0,0,0|2,0,0]=3 2482 B11R1.17 Cc1ccccc1OCCO 34a_100000210338_100000211926 [0,1,0,0,0,0|2,0,0]=3 2483 B11R1.17 Cc1ccccc1OCCO 7a_100000210338_100000211926 [0,1,0,0,0,0|2,0,0]=3 2484 B11R1.17 Cc1ccccc1SCC#N 62a_100000210755_100011215382 [0,1,0,0,0,0|2,0,1]=4 2485 B11R1.17 Cc1ccccc1SCC#N 62a_100011215382_100000210755 [0,1,0,0,0,0|2,0,1]=4 2486 B11R1.17 Cc1ccccc1SCC=O 62a_100000210755_200015260668 [0,1,0,0,0,0|2,0,1]=4 2487 B11R1.17 Cc1ccccc1SCC=O 62a_200015260668_100000210755 [0,1,0,0,0,0|2,0,1]=4 2488 B11R1.17 Cc1ccccc1SCCF 62a_100000210755_100011217306 [0,1,0,0,0,0|2,0,0]=3 2489 B11R1.17 Cc1ccccc1SCCF 62a_100011217306_100000210755 [0,1,0,0,0,0|2,0,0]=3 2490 B11R1.17 Cc1ccccc1SCCO 62a_100000210755_100000211926 [0,1,0,0,0,0|2,0,0]=3 2491 B11R1.17 Cc1ccccc1SCCO 62a_100000211926_100000210755 [0,1,0,0,0,0|2,0,0]=3 2492 B11R1.17 Cc1cccnc1CCO[13CH3] 34a_100011997706_200025704644 [0,1,0,0,0,0|2,0,0]=3 2493 B11R1.17 Cc1cccnc1CCO[13CH3] 7a_100011997706_200025704644 [0,1,0,0,0,0|2,0,0]=3 2494 B11R1.17 Cc1cccnc1CNCF 34a_100011223789_100015361967 [0,1,0,0,0,0|3,0,0]=4 2495 B11R1.17 Cc1cccnc1COCF 34a_100000698912_100015361967 [0,1,0,0,0,0|3,0,0]=4 2496 B11R1.17 Cc1cccnc1CSCF 62a_100000696600_100015361967 [0,1,0,0,0,0|3,0,0]=4 2497 B11R1.17 Cc1cccnc1CSCF 62a_100015361967_100000696600 [0,1,0,0,0,0|3,0,0]=4 2498 B11R1.17 Cc1cccnc1SCCF 62a_100000751373_100011217306 [0,1,0,0,0,0|3,0,0]=4 2499 B11R1.17 Cc1cccnc1SCCF 62a_100011217306_100000751373 [0,1,0,0,0,0|3,0,0]=4 2500 B11R1.17 Cc1cccnc1SCCO 62a_100000211926_100000751373 [0,1,0,0,0,0|3,0,0]=4 2501 B11R1.17 Cc1cccnc1SCCO 62a_100000751373_100000211926 [0,1,0,0,0,0|3,0,0]=4 2502 B11R1.17 Cc1ccncc1COCF 34a_100011996381_100015361967 [0,1,0,0,0,0|3,0,0]=4 2503 B11R1.17 Cc1ccncc1CSCF 62a_100000690890_100015361967 [0,1,0,0,0,0|3,0,0]=4 2504 B11R1.17 Cc1ccncc1CSCF 62a_100015361967_100000690890 [0,1,0,0,0,0|3,0,0]=4 2505 B11R1.17 Cc1ccncc1OCCF 34a_100011997053_100011217306 [0,1,0,0,0,0|3,0,0]=4 2506 B11R1.17 Cc1ccncc1OCCF 7a_100011997053_100011217306 [0,1,0,0,0,0|3,0,0]=4 2507 B11R1.17 Cc1ccncc1OCCO 34a_100011997053_100000211926 [0,1,0,0,0,0|3,0,0]=4 2508 B11R1.17 Cc1ccncc1OCCO 7a_100011997053_100000211926 [0,1,0,0,0,0|3,0,0]=4 2509 B11R1.17 Cc1ccncc1SCCF 62a_100000761580_100011217306 [0,1,0,0,0,0|3,0,0]=4 2510 B11R1.17 Cc1ccncc1SCCF 62a_100011217306_100000761580 [0,1,0,0,0,0|3,0,0]=4 2511 B11R1.17 Cc1ccncc1SCCO 62a_100000211926_100000761580 [0,1,0,0,0,0|3,0,0]=4 2512 B11R1.17 Cc1ccncc1SCCO 62a_100000761580_100000211926 [0,1,0,0,0,0|3,0,0]=4 2513 B11R1.17 Cc1cnccc1COCF 34a_100011997032_100015361967 [0,1,0,0,0,0|3,0,0]=4 2514 B11R1.17 Cc1cnccc1CSCF 62a_100015361967_100020672808 [0,1,0,0,0,0|3,0,0]=4 2515 B11R1.17 Cc1cnccc1CSCF 62a_100020672808_100015361967 [0,1,0,0,0,0|3,0,0]=4 2516 B11R1.17 Cc1cnccc1NCCO 27a_100000210304_100000765111 [0,1,0,0,0,0|3,0,0]=4 2517 B11R1.17 Cc1cnccc1OCCF 34a_100000694293_100011217306 [0,1,0,0,0,0|3,0,0]=4 2518 B11R1.17 Cc1cnccc1OCCO 34a_100000694293_100000211926 [0,1,0,0,0,0|3,0,0]=4 2519 B11R1.17 Cc1cnccc1SCCF 62a_100000765111_100011217306 [0,1,0,0,0,0|3,0,0]=4 2520 B11R1.17 Cc1cnccc1SCCF 62a_100011217306_100000765111 [0,1,0,0,0,0|3,0,0]=4 2521 B11R1.17 Cc1cnccc1SCCO 62a_100000211926_100000765111 [0,1,0,0,0,0|3,0,0]=4 2522 B11R1.17 Cc1cnccc1SCCO 62a_100000765111_100000211926 [0,1,0,0,0,0|3,0,0]=4 2523 B11R1.17 Cc1ncccc1COCF 34a_100000729262_100015361967 [0,1,0,0,0,0|3,0,0]=4 2524 B11R1.17 Cc1ncccc1COCF 7a_100000729262_100015361967 [0,1,0,0,0,0|3,0,0]=4 2525 B11R1.17 Cc1ncccc1CSCF 62a_100000732876_100015361967 [0,1,0,0,0,0|3,0,0]=4 2526 B11R1.17 Cc1ncccc1CSCF 62a_100015361967_100000732876 [0,1,0,0,0,0|3,0,0]=4 2527 B11R1.17 Cc1ncccc1OCCF 34a_100000745507_100011217306 [0,1,0,0,0,0|3,0,0]=4 2528 B11R1.17 Cc1ncccc1OCCF 7a_100000745507_100011217306 [0,1,0,0,0,0|3,0,0]=4 2529 B11R1.17 Cc1ncccc1OCCO 34a_100000745507_100000211926 [0,1,0,0,0,0|3,0,0]=4 2530 B11R1.17 Cc1ncccc1OCCO 7a_100000745507_100000211926 [0,1,0,0,0,0|3,0,0]=4 2531 B11R1.17 Cc1ncccc1SCCF 62a_100000751574_100011217306 [0,1,0,0,0,0|3,0,0]=4 2532 B11R1.17 Cc1ncccc1SCCF 62a_100011217306_100000751574 [0,1,0,0,0,0|3,0,0]=4 2533 B11R1.17 Cc1ncccc1SCCO 62a_100000211926_100000751574 [0,1,0,0,0,0|3,0,0]=4 2534 B11R1.17 Cc1ncccc1SCCO 62a_100000751574_100000211926 [0,1,0,0,0,0|3,0,0]=4 2535 B11R1.17 FCCNc1ccccc1Br 34a_100000210017_100011217306 [0,1,0,0,0,0|2,0,0]=3 2536 B11R1.17 FCCNc1ccccc1Cl 34a_100000185783_100011217306 [0,1,0,0,0,0|2,0,0]=3 2537 B11R1.17 FCCNc1ccccc1F 34a_100000210422_100011217306 [0,1,0,0,0,0|2,0,0]=3 2538 B11R1.17 FCCNc1ccccc1I 34a_100000210053_100011217306 [0,1,0,0,0,0|2,0,0]=3 2539 B11R1.17 FCCOc1ccccc1Br 34a_100000181306_100011217306 [0,1,0,0,0,0|2,0,0]=3 2540 B11R1.17 FCCOc1ccccc1Br 7a_100000181306_100011217306 [0,1,0,0,0,0|2,0,0]=3 2541 B11R1.17 FCCOc1ccccc1Cl 34a_100000210172_100011217306 [0,1,0,0,0,0|2,0,0]=3 2542 B11R1.17 FCCOc1ccccc1Cl 7a_100000210172_100011217306 [0,1,0,0,0,0|2,0,0]=3 2543 B11R1.17 FCCOc1ccccc1F 34a_100000210171_100011217306 [0,1,0,0,0,0|2,0,0]=3 2544 B11R1.17 FCCOc1ccccc1F 7a_100000210171_100011217306 [0,1,0,0,0,0|2,0,0]=3 2545 B11R1.17 FCCOc1ccccc1I 34a_100000739446_100011217306 [0,1,0,0,0,0|2,0,0]=3 2546 B11R1.17 FCCOc1ccccc1I 7a_100000739446_100011217306 [0,1,0,0,0,0|2,0,0]=3 2547 B11R1.17 FCCOc1cccnc1Br 34a_100000744436_100011217306 [0,1,0,0,0,0|3,0,0]=4 2548 B11R1.17 FCCOc1cccnc1Br 7a_100000744436_100011217306 [0,1,0,0,0,0|3,0,0]=4 2549 B11R1.17 FCCOc1cccnc1Cl 34a_100000757616_100011217306 [0,1,0,0,0,0|3,0,0]=4 2550 B11R1.17 FCCOc1cccnc1Cl 7a_100000757616_100011217306 [0,1,0,0,0,0|3,0,0]=4 2551 B11R1.17 FCCOc1cccnc1F 34a_100000061740_100011217306 [0,1,0,0,0,0|3,0,0]=4 2552 B11R1.17 FCCOc1cccnc1F 7a_100000061740_100011217306 [0,1,0,0,0,0|3,0,0]=4 2553 B11R1.17 FCCOc1cccnc1I 34a_100000034122_100011217306 [0,1,0,0,0,0|3,0,0]=4 2554 B11R1.17 FCCOc1cccnc1I 7a_100000034122_100011217306 [0,1,0,0,0,0|3,0,0]=4 2555 B11R1.17 FCCOc1ccncc1Br 34a_100011996408_100011217306 [0,1,0,0,0,0|3,0,0]=4 2556 B11R1.17 FCCOc1ccncc1Cl 34a_100011997054_100011217306 [0,1,0,0,0,0|3,0,0]=4 2557 B11R1.17 FCCOc1ccncc1F 34a_200000081243_100011217306 [0,1,0,0,0,0|3,0,0]=4 2558 B11R1.17 FCCOc1cnccc1Cl 34a_100011996695_100011217306 [0,1,0,0,0,0|3,0,0]=4 2559 B11R1.17 FCCOc1cnccc1I 34a_100000050107_100011217306 [0,1,0,0,0,0|3,0,0]=4 2560 B11R1.17 FCCOc1ncccc1Cl 34a_100011290957_100011217306 [0,1,0,0,0,0|3,0,0]=4 2561 B11R1.17 FCCOc1ncccc1F 34a_100011219419_100011217306 [0,1,0,0,0,0|3,0,0]=4 2562 B11R1.17 FCCSc1c[nH]ccc1=S 62a_100011217306_200012280681 [0,1,0,0,0,0|2,1,0]=4 2563 B11R1.17 FCCSc1c[nH]ccc1=S 62a_200012280681_100011217306 [0,1,0,0,0,0|2,1,0]=4 2564 B11R1.17 FCCSc1ccccc1Br 62a_100000695589_100011217306 [0,1,0,0,0,0|2,0,0]=3 2565 B11R1.17 FCCSc1ccccc1Br 62a_100011217306_100000695589 [0,1,0,0,0,0|2,0,0]=3 2566 B11R1.17 FCCSc1ccccc1Cl 62a_100000764095_100011217306 [0,1,0,0,0,0|2,0,0]=3 2567 B11R1.17 FCCSc1ccccc1Cl 62a_100011217306_100000764095 [0,1,0,0,0,0|2,0,0]=3 2568 B11R1.17 FCCSc1ccccc1F 62a_100011215700_100011217306 [0,1,0,0,0,0|2,0,0]=3 2569 B11R1.17 FCCSc1ccccc1F 62a_100011217306_100011215700 [0,1,0,0,0,0|2,0,0]=3 2570 B11R1.17 FCCSc1cccnc1Br 62a_100010202626_100011217306 [0,1,0,0,0,0|3,0,0]=4 2571 B11R1.17 FCCSc1cccnc1Br 62a_100011217306_100010202626 [0,1,0,0,0,0|3,0,0]=4 2572 B11R1.17 FCCSc1cccnc1Cl 62a_100000036424_100011217306 [0,1,0,0,0,0|3,0,0]=4 2573 B11R1.17 FCCSc1cccnc1Cl 62a_100011217306_100000036424 [0,1,0,0,0,0|3,0,0]=4 2574 B11R1.17 FCCSc1cccnc1F 62a_100009816115_100011217306 [0,1,0,0,0,0|3,0,0]=4 2575 B11R1.17 FCCSc1cccnc1F 62a_100011217306_100009816115 [0,1,0,0,0,0|3,0,0]=4 2576 B11R1.17 FCCSc1ccncc1Br 62a_100000726257_100011217306 [0,1,0,0,0,0|3,0,0]=4 2577 B11R1.17 FCCSc1ccncc1Br 62a_100011217306_100000726257 [0,1,0,0,0,0|3,0,0]=4 2578 B11R1.17 FCCSc1ccncc1Cl 62a_100000708259_100011217306 [0,1,0,0,0,0|3,0,0]=4 2579 B11R1.17 FCCSc1ccncc1Cl 62a_100011217306_100000708259 [0,1,0,0,0,0|3,0,0]=4 2580 B11R1.17 FCCSc1ccncc1F 62a_100000047030_100011217306 [0,1,0,0,0,0|3,0,0]=4 2581 B11R1.17 FCCSc1ccncc1F 62a_100011217306_100000047030 [0,1,0,0,0,0|3,0,0]=4 2582 B11R1.17 FCCSc1cnccc1Br 62a_100010138639_100011217306 [0,1,0,0,0,0|3,0,0]=4 2583 B11R1.17 FCCSc1cnccc1Br 62a_100011217306_100010138639 [0,1,0,0,0,0|3,0,0]=4 2584 B11R1.17 FCCSc1cnccc1Cl 62a_100009995489_100011217306 [0,1,0,0,0,0|3,0,0]=4 2585 B11R1.17 FCCSc1cnccc1Cl 62a_100011217306_100009995489 [0,1,0,0,0,0|3,0,0]=4 2586 B11R1.17 FCCSc1cnccc1F 62a_100009820683_100011217306 [0,1,0,0,0,0|3,0,0]=4 2587 B11R1.17 FCCSc1cnccc1F 62a_100011217306_100009820683 [0,1,0,0,0,0|3,0,0]=4 2588 B11R1.17 FCCSc1ncccc1Br 62a_100000696092_100011217306 [0,1,0,0,0,0|3,0,0]=4 2589 B11R1.17 FCCSc1ncccc1Br 62a_100011217306_100000696092 [0,1,0,0,0,0|3,0,0]=4 2590 B11R1.17 FCCSc1ncccc1Cl 62a_100011217306_100011356963 [0,1,0,0,0,0|3,0,0]=4 2591 B11R1.17 FCCSc1ncccc1Cl 62a_100011356963_100011217306 [0,1,0,0,0,0|3,0,0]=4 2592 B11R1.17 FCCSc1ncccc1F 62a_100000685392_100011217306 [0,1,0,0,0,0|3,0,0]=4 2593 B11R1.17 FCCSc1ncccc1F 62a_100011217306_100000685392 [0,1,0,0,0,0|3,0,0]=4 2594 B11R1.17 FCNCc1ccccc1Br 34a_100000689332_100015361967 [0,1,0,0,0,0|2,0,0]=3 2595 B11R1.17 FCNCc1ccccc1Cl 34a_100000174879_100015361967 [0,1,0,0,0,0|2,0,0]=3 2596 B11R1.17 FCNCc1ccccc1F 34a_100000174869_100015361967 [0,1,0,0,0,0|2,0,0]=3 2597 B11R1.17 FCNCc1cccnc1Br 34a_100009818023_100015361967 [0,1,0,0,0,0|3,0,0]=4 2598 B11R1.17 FCNCc1cccnc1Cl 34a_100015189234_100015361967 [0,1,0,0,0,0|3,0,0]=4 2599 B11R1.17 FCNCc1cccnc1F 34a_100000724633_100015361967 [0,1,0,0,0,0|3,0,0]=4 2600 B11R1.17 FCNCc1ccncc1F 34a_100011935246_100015361967 [0,1,0,0,0,0|3,0,0]=4 2601 B11R1.17 FCNCc1ncccc1F 34a_100000690088_100015361967 [0,1,0,0,0,0|3,0,0]=4 2602 B11R1.17 FCOCc1ccccc1Br 34a_100000756307_100015361967 [0,1,0,0,0,0|2,0,0]=3 2603 B11R1.17 FCOCc1ccccc1Br 7a_100000756307_100015361967 [0,1,0,0,0,0|2,0,0]=3 2604 B11R1.17 FCOCc1ccccc1Cl 34a_100000210847_100015361967 [0,1,0,0,0,0|2,0,0]=3 2605 B11R1.17 FCOCc1ccccc1Cl 7a_100000210847_100015361967 [0,1,0,0,0,0|2,0,0]=3 2606 B11R1.17 FCOCc1ccccc1F 34a_100000211962_100015361967 [0,1,0,0,0,0|2,0,0]=3 2607 B11R1.17 FCOCc1ccccc1F 7a_100000211962_100015361967 [0,1,0,0,0,0|2,0,0]=3 2608 B11R1.17 FCOCc1ccccc1I 34a_100000187465_100015361967 [0,1,0,0,0,0|2,0,0]=3 2609 B11R1.17 FCOCc1ccccc1I 7a_100000187465_100015361967 [0,1,0,0,0,0|2,0,0]=3 2610 B11R1.17 FCOCc1cccnc1Br 34a_100000719692_100015361967 [0,1,0,0,0,0|3,0,0]=4 2611 B11R1.17 FCOCc1cccnc1Br 7a_100000719692_100015361967 [0,1,0,0,0,0|3,0,0]=4 2612 B11R1.17 FCOCc1cccnc1Cl 34a_100000748726_100015361967 [0,1,0,0,0,0|3,0,0]=4 2613 B11R1.17 FCOCc1cccnc1Cl 7a_100000748726_100015361967 [0,1,0,0,0,0|3,0,0]=4 2614 B11R1.17 FCOCc1cccnc1F 34a_100000079888_100015361967 [0,1,0,0,0,0|3,0,0]=4 2615 B11R1.17 FCOCc1cccnc1F 7a_100000079888_100015361967 [0,1,0,0,0,0|3,0,0]=4 2616 B11R1.17 FCOCc1ccncc1F 34a_100012172863_100015361967 [0,1,0,0,0,0|3,0,0]=4 2617 B11R1.17 FCOCc1cnccc1Cl 34a_100000117392_100015361967 [0,1,0,0,0,0|3,0,0]=4 2618 B11R1.17 FCOCc1ncccc1Br 34a_100011996772_100015361967 [0,1,0,0,0,0|3,0,0]=4 2619 B11R1.17 FCOCc1ncccc1Cl 34a_100012002383_100015361967 [0,1,0,0,0,0|3,0,0]=4 2620 B11R1.17 FCOCc1ncccc1F 34a_100011934865_100015361967 [0,1,0,0,0,0|3,0,0]=4 2621 B11R1.17 FCSCc1ccccc1Br 62a_100000184730_100015361967 [0,1,0,0,0,0|2,0,0]=3 2622 B11R1.17 FCSCc1ccccc1Br 62a_100015361967_100000184730 [0,1,0,0,0,0|2,0,0]=3 2623 B11R1.17 FCSCc1ccccc1Cl 62a_100000187162_100015361967 [0,1,0,0,0,0|2,0,0]=3 2624 B11R1.17 FCSCc1ccccc1Cl 62a_100015361967_100000187162 [0,1,0,0,0,0|2,0,0]=3 2625 B11R1.17 FCSCc1ccccc1F 62a_100000211605_100015361967 [0,1,0,0,0,0|2,0,0]=3 2626 B11R1.17 FCSCc1ccccc1F 62a_100015361967_100000211605 [0,1,0,0,0,0|2,0,0]=3 2627 B11R1.17 FCSCc1ccccc1I 62a_100011216222_100015361967 [0,1,0,0,0,0|2,0,0]=3 2628 B11R1.17 FCSCc1ccccc1I 62a_100015361967_100011216222 [0,1,0,0,0,0|2,0,0]=3 2629 B11R1.17 FCSCc1cccnc1Br 62a_100010140945_100015361967 [0,1,0,0,0,0|3,0,0]=4 2630 B11R1.17 FCSCc1cccnc1Br 62a_100015361967_100010140945 [0,1,0,0,0,0|3,0,0]=4 2631 B11R1.17 FCSCc1cccnc1Cl 62a_100000045678_100015361967 [0,1,0,0,0,0|3,0,0]=4 2632 B11R1.17 FCSCc1cccnc1Cl 62a_100015361967_100000045678 [0,1,0,0,0,0|3,0,0]=4 2633 B11R1.17 FCSCc1cccnc1F 62a_100000099810_100015361967 [0,1,0,0,0,0|3,0,0]=4 2634 B11R1.17 FCSCc1cccnc1F 62a_100015361967_100000099810 [0,1,0,0,0,0|3,0,0]=4 2635 B11R1.17 FCSCc1ccncc1Cl 62a_100000763264_100015361967 [0,1,0,0,0,0|3,0,0]=4 2636 B11R1.17 FCSCc1ccncc1Cl 62a_100015361967_100000763264 [0,1,0,0,0,0|3,0,0]=4 2637 B11R1.17 FCSCc1ncccc1Br 62a_100015361967_100025702911 [0,1,0,0,0,0|3,0,0]=4 2638 B11R1.17 FCSCc1ncccc1Br 62a_100025702911_100015361967 [0,1,0,0,0,0|3,0,0]=4 2639 B11R1.17 FCSCc1ncccc1Cl 62a_100000099807_100015361967 [0,1,0,0,0,0|3,0,0]=4 2640 B11R1.17 FCSCc1ncccc1Cl 62a_100015361967_100000099807 [0,1,0,0,0,0|3,0,0]=4 2641 B11R1.17 FCSCc1ncccc1F 62a_100000104219_100015361967 [0,1,0,0,0,0|3,0,0]=4 2642 B11R1.17 FCSCc1ncccc1F 62a_100015361967_100000104219 [0,1,0,0,0,0|3,0,0]=4 2643 B11R1.17 N#CCOc1ccccc1Br 7a_100000181306_100011215382 [0,1,0,0,0,0|2,0,1]=4 2644 B11R1.17 N#CCOc1ccccc1Cl 7a_100000210172_100011215382 [0,1,0,0,0,0|2,0,1]=4 2645 B11R1.17 N#CCOc1ccccc1F 7a_100000210171_100011215382 [0,1,0,0,0,0|2,0,1]=4 2646 B11R1.17 N#CCOc1ccccc1I 7a_100000739446_100011215382 [0,1,0,0,0,0|2,0,1]=4 2647 B11R1.17 N#CCOc1ccccc1N 7a_100000185747_100011215382 [0,1,0,0,0,0|2,0,1]=4 2648 B11R1.17 N#CCOc1ccccc1O 271570a_203496583355_200000173881 [0,1,0,0,0,0|1,0,1]=3 2649 B11R1.17 N#CCSc1ccccc1Br 62a_100000695589_100011215382 [0,1,0,0,0,0|2,0,1]=4 2650 B11R1.17 N#CCSc1ccccc1Br 62a_100011215382_100000695589 [0,1,0,0,0,0|2,0,1]=4 2651 B11R1.17 N#CCSc1ccccc1Cl 62a_100000764095_100011215382 [0,1,0,0,0,0|2,0,1]=4 2652 B11R1.17 N#CCSc1ccccc1Cl 62a_100011215382_100000764095 [0,1,0,0,0,0|2,0,1]=4 2653 B11R1.17 N#CCSc1ccccc1F 62a_100011215382_100011215700 [0,1,0,0,0,0|2,0,1]=4 2654 B11R1.17 N#CCSc1ccccc1F 62a_100011215700_100011215382 [0,1,0,0,0,0|2,0,1]=4 2655 B11R1.17 N#CCSc1ccccc1N 62a_100000210017_100011215382 [0,1,0,0,0,0|2,0,1]=4 2656 B11R1.17 N#CCSc1ccccc1N 62a_100011215382_100000210017 [0,1,0,0,0,0|2,0,1]=4 2657 B11R1.17 N#CCSc1ccccc1O 62a_100000739446_100011215382 [0,1,0,0,0,0|1,0,1]=3 2658 B11R1.17 N#CCSc1ccccc1O 62a_100011215382_100000739446 [0,1,0,0,0,0|1,0,1]=3 2659 B11R1.17 N#CCSc1cccnc1O 62a_100000760158_100011215382 [0,1,0,0,0,0|2,0,1]=4 2660 B11R1.17 N#CCSc1cccnc1O 62a_100011215382_100000760158 [0,1,0,0,0,0|2,0,1]=4 2661 B11R1.17 N#CCSc1ccncc1O 62a_100009817591_100011215382 [0,1,0,0,0,0|2,0,1]=4 2662 B11R1.17 N#CCSc1ccncc1O 62a_100011215382_100009817591 [0,1,0,0,0,0|2,0,1]=4 2663 B11R1.17 N#CCSc1ncccc1O 62a_100000034122_100011215382 [0,1,0,0,0,0|2,0,1]=4 2664 B11R1.17 N#CCSc1ncccc1O 62a_100011215382_100000034122 [0,1,0,0,0,0|2,0,1]=4 2665 B11R1.17 N#CSCc1ccccc1O 271570a_203496583355_200010199460 [0,1,0,0,0,0|1,0,1]=3 2666 B11R1.17 NCCOc1ccccc1O 271570a_203496583355_100000744007 [0,1,0,0,0,0|1,0,0]=2 2667 B11R1.17 Nc1ccccc1COCF 34a_100000212039_100015361967 [0,1,0,0,0,0|2,0,0]=3 2668 B11R1.17 Nc1ccccc1OCC=O 34a_100000185747_200009817547 [0,1,0,0,0,0|2,0,1]=4 2669 B11R1.17 Nc1ccccc1OCC=O 7a_100000185747_200015260668 [0,1,0,0,0,0|2,0,1]=4 2670 B11R1.17 Nc1ccccc1OCCF 34a_100000185747_100011217306 [0,1,0,0,0,0|2,0,0]=3 2671 B11R1.17 Nc1ccccc1OCCF 7a_100000185747_100011217306 [0,1,0,0,0,0|2,0,0]=3 2672 B11R1.17 Nc1ccccc1OCCO 34a_100000185747_100000211926 [0,1,0,0,0,0|2,0,0]=3 2673 B11R1.17 Nc1ccccc1OCCO 7a_100000185747_100000211926 [0,1,0,0,0,0|2,0,0]=3 2674 B11R1.17 Nc1ccccc1SCC=O 62a_100000210017_200015260668 [0,1,0,0,0,0|2,0,1]=4 2675 B11R1.17 Nc1ccccc1SCC=O 62a_200015260668_100000210017 [0,1,0,0,0,0|2,0,1]=4 2676 B11R1.17 Nc1ccccc1SCCF 62a_100000210017_100011217306 [0,1,0,0,0,0|2,0,0]=3 2677 B11R1.17 Nc1ccccc1SCCF 62a_100011217306_100000210017 [0,1,0,0,0,0|2,0,0]=3 2678 B11R1.17 Nc1ccccc1SCCO 62a_100000210017_100000211926 [0,1,0,0,0,0|2,0,0]=3 2679 B11R1.17 Nc1ccccc1SCCO 62a_100000211926_100000210017 [0,1,0,0,0,0|2,0,0]=3 2680 B11R1.17 Nc1cccnc1COCF 34a_114873767017_100015361967 [0,1,0,0,0,0|3,0,0]=4 2681 B11R1.17 Nc1cccnc1OCCF 34a_100000746358_100011217306 [0,1,0,0,0,0|3,0,0]=4 2682 B11R1.17 Nc1cccnc1OCCO 34a_100000746358_100000211926 [0,1,0,0,0,0|3,0,0]=4 2683 B11R1.17 Nc1cccnc1SCCF 62a_100000688686_100011217306 [0,1,0,0,0,0|3,0,0]=4 2684 B11R1.17 Nc1cccnc1SCCF 62a_100011217306_100000688686 [0,1,0,0,0,0|3,0,0]=4 2685 B11R1.17 Nc1cccnc1SCCO 62a_100000211926_100000688686 [0,1,0,0,0,0|3,0,0]=4 2686 B11R1.17 Nc1cccnc1SCCO 62a_100000688686_100000211926 [0,1,0,0,0,0|3,0,0]=4 2687 B11R1.17 Nc1ccncc1OCCF 34a_100000753702_100011217306 [0,1,0,0,0,0|3,0,0]=4 2688 B11R1.17 Nc1ccncc1OCCO 34a_100000753702_100000211926 [0,1,0,0,0,0|3,0,0]=4 2689 B11R1.17 Nc1ccncc1SCCF 62a_100000047001_100011217306 [0,1,0,0,0,0|3,0,0]=4 2690 B11R1.17 Nc1ccncc1SCCF 62a_100011217306_100000047001 [0,1,0,0,0,0|3,0,0]=4 2691 B11R1.17 Nc1ccncc1SCCO 62a_100000047001_100000211926 [0,1,0,0,0,0|3,0,0]=4 2692 B11R1.17 Nc1ccncc1SCCO 62a_100000211926_100000047001 [0,1,0,0,0,0|3,0,0]=4 2693 B11R1.17 Nc1cnccc1SCCF 62a_100000756074_100011217306 [0,1,0,0,0,0|3,0,0]=4 2694 B11R1.17 Nc1cnccc1SCCF 62a_100011217306_100000756074 [0,1,0,0,0,0|3,0,0]=4 2695 B11R1.17 Nc1cnccc1SCCO 62a_100000211926_100000756074 [0,1,0,0,0,0|3,0,0]=4 2696 B11R1.17 Nc1cnccc1SCCO 62a_100000756074_100000211926 [0,1,0,0,0,0|3,0,0]=4 2697 B11R1.17 Nc1ncccc1OCCF 34a_100000211975_100011217306 [0,1,0,0,0,0|3,0,0]=4 2698 B11R1.17 Nc1ncccc1OCCF 7a_100000211975_100011217306 [0,1,0,0,0,0|3,0,0]=4 2699 B11R1.17 Nc1ncccc1OCCO 34a_100000211975_100000211926 [0,1,0,0,0,0|3,0,0]=4 2700 B11R1.17 Nc1ncccc1OCCO 7a_100000211975_100000211926 [0,1,0,0,0,0|3,0,0]=4 2701 B11R1.17 Nc1ncccc1SCCF 62a_100000045569_100011217306 [0,1,0,0,0,0|3,0,0]=4 2702 B11R1.17 Nc1ncccc1SCCF 62a_100011217306_100000045569 [0,1,0,0,0,0|3,0,0]=4 2703 B11R1.17 Nc1ncccc1SCCO 62a_100000045569_100000211926 [0,1,0,0,0,0|3,0,0]=4 2704 B11R1.17 Nc1ncccc1SCCO 62a_100000211926_100000045569 [0,1,0,0,0,0|3,0,0]=4 2705 B11R1.17 O=CCCc1ccccc1O 271570a_203496583355_100011713448 [0,1,0,0,0,0|0,0,1]=2 2706 B11R1.17 O=CCNc1ccccc1Br 34a_100000210017_200009817547 [0,1,0,0,0,0|2,0,1]=4 2707 B11R1.17 O=CCNc1ccccc1Cl 34a_100000185783_200009817547 [0,1,0,0,0,0|2,0,1]=4 2708 B11R1.17 O=CCNc1ccccc1F 34a_100000210422_200009817547 [0,1,0,0,0,0|2,0,1]=4 2709 B11R1.17 O=CCNc1ccccc1I 34a_100000210053_200009817547 [0,1,0,0,0,0|2,0,1]=4 2710 B11R1.17 O=CCNc1ccccc1O 34a_100000185747_200009817547 [0,1,0,0,0,0|1,0,1]=3 2711 B11R1.17 O=CCOc1ccccc1Br 34a_100000181306_200009817547 [0,1,0,0,0,0|2,0,1]=4 2712 B11R1.17 O=CCOc1ccccc1Br 7a_100000181306_200015260668 [0,1,0,0,0,0|2,0,1]=4 2713 B11R1.17 O=CCOc1ccccc1Cl 34a_100000210172_200009817547 [0,1,0,0,0,0|2,0,1]=4 2714 B11R1.17 O=CCOc1ccccc1Cl 7a_100000210172_200015260668 [0,1,0,0,0,0|2,0,1]=4 2715 B11R1.17 O=CCOc1ccccc1F 34a_100000210171_200009817547 [0,1,0,0,0,0|2,0,1]=4 2716 B11R1.17 O=CCOc1ccccc1F 7a_100000210171_200015260668 [0,1,0,0,0,0|2,0,1]=4 2717 B11R1.17 O=CCOc1ccccc1I 34a_100000739446_200009817547 [0,1,0,0,0,0|2,0,1]=4 2718 B11R1.17 O=CCOc1ccccc1I 7a_100000739446_200015260668 [0,1,0,0,0,0|2,0,1]=4 2719 B11R1.17 O=CCSc1ccccc1Br 62a_100000695589_200015260668 [0,1,0,0,0,0|2,0,1]=4 2720 B11R1.17 O=CCSc1ccccc1Br 62a_200015260668_100000695589 [0,1,0,0,0,0|2,0,1]=4 2721 B11R1.17 O=CCSc1ccccc1Cl 62a_100000764095_200015260668 [0,1,0,0,0,0|2,0,1]=4 2722 B11R1.17 O=CCSc1ccccc1Cl 62a_200015260668_100000764095 [0,1,0,0,0,0|2,0,1]=4 2723 B11R1.17 O=CCSc1ccccc1F 62a_100011215700_200015260668 [0,1,0,0,0,0|2,0,1]=4 2724 B11R1.17 O=CCSc1ccccc1F 62a_200015260668_100011215700 [0,1,0,0,0,0|2,0,1]=4 2725 B11R1.17 O=CCSc1ccccc1O 62a_100000739446_200015260668 [0,1,0,0,0,0|1,0,1]=3 2726 B11R1.17 O=CCSc1ccccc1O 62a_200015260668_100000739446 [0,1,0,0,0,0|1,0,1]=3 2727 B11R1.17 O=CCSc1cccnc1O 62a_100000760158_200015260668 [0,1,0,0,0,0|2,0,1]=4 2728 B11R1.17 O=CCSc1cccnc1O 62a_200015260668_100000760158 [0,1,0,0,0,0|2,0,1]=4 2729 B11R1.17 O=CCSc1ccncc1O 62a_100009817591_200015260668 [0,1,0,0,0,0|2,0,1]=4 2730 B11R1.17 O=CCSc1ccncc1O 62a_200015260668_100009817591 [0,1,0,0,0,0|2,0,1]=4 2731 B11R1.17 O=CCSc1ncccc1O 62a_100000034122_200015260668 [0,1,0,0,0,0|2,0,1]=4 2732 B11R1.17 O=CCSc1ncccc1O 62a_200015260668_100000034122 [0,1,0,0,0,0|2,0,1]=4 2733 B11R1.17 O=c1cc[nH]cc1SCCF 62a_100009998708_100011217306 [0,1,0,0,0,0|2,0,1]=4 2734 B11R1.17 O=c1cc[nH]cc1SCCF 62a_100011217306_100009998708 [0,1,0,0,0,0|2,0,1]=4 2735 B11R1.17 O=c1cc[nH]cc1SCCO 62a_100000211926_100009998708 [0,1,0,0,0,0|2,0,1]=4 2736 B11R1.17 O=c1cc[nH]cc1SCCO 62a_100009998708_100000211926 [0,1,0,0,0,0|2,0,1]=4 2737 B11R1.17 O=c1ccocc1OCCF 34a_100000060831_100011217306 [0,1,0,0,0,0|2,0,1]=4 2738 B11R1.17 O=c1ccocc1OCCO 34a_100000060831_100000211926 [0,1,0,0,0,0|2,0,1]=4 2739 B11R1.17 O=c1occcc1OCCF 34a_100000077404_100011217306 [0,1,0,0,0,0|2,0,1]=4 2740 B11R1.17 O=c1occcc1OCCF 7a_100000077404_100011217306 [0,1,0,0,0,0|2,0,1]=4 2741 B11R1.17 O=c1occcc1OCCO 34a_100000077404_100000211926 [0,1,0,0,0,0|2,0,1]=4 2742 B11R1.17 O=c1occcc1OCCO 7a_100000077404_100000211926 [0,1,0,0,0,0|2,0,1]=4 2743 B11R1.17 OCC#Cc1ccccc1O 271570a_203496583355_100009814404 [0,1,0,0,0,0|0,0,2]=3 2744 B11R1.17 OCCCc1ccccc1O 271570a_203496583355_100000699526 [0,1,0,0,0,0|0,0,0]=1 2745 B11R1.17 OCCNc1ccccc1Br 34a_100000210017_100000211926 [0,1,0,0,0,0|2,0,0]=3 2746 B11R1.17 OCCNc1ccccc1Cl 34a_100000185783_100000211926 [0,1,0,0,0,0|2,0,0]=3 2747 B11R1.17 OCCNc1ccccc1F 34a_100000210422_100000211926 [0,1,0,0,0,0|2,0,0]=3 2748 B11R1.17 OCCNc1ccccc1I 34a_100000210053_100000211926 [0,1,0,0,0,0|2,0,0]=3 2749 B11R1.17 OCCNc1ccccc1O 34a_100000185747_100000211926 [0,1,0,0,0,0|1,0,0]=2 2750 B11R1.17 OCCNc1ccncc1Br 27a_100000210304_100000726257 [0,1,0,0,0,0|3,0,0]=4 2751 B11R1.17 OCCNc1ccncc1F 27a_100000210304_100000035921 [0,1,0,0,0,0|3,0,0]=4 2752 B11R1.17 OCCNc1ncccc1Br 27a_100000210304_100000696092 [0,1,0,0,0,0|3,0,0]=4 2753 B11R1.17 OCCNc1ncccc1O 271570a_203496583355_200011464885 [0,1,0,0,0,0|2,0,0]=3 2754 B11R1.17 OCCNc1nccnc1O 271570a_203496583355_200011219046 [0,1,0,0,0,0|3,0,0]=4 2755 B11R1.17 OCCOc1ccccc1Br 34a_100000181306_100000211926 [0,1,0,0,0,0|2,0,0]=3 2756 B11R1.17 OCCOc1ccccc1Br 7a_100000181306_100000211926 [0,1,0,0,0,0|2,0,0]=3 2757 B11R1.17 OCCOc1ccccc1Cl 34a_100000210172_100000211926 [0,1,0,0,0,0|2,0,0]=3 2758 B11R1.17 OCCOc1ccccc1Cl 7a_100000210172_100000211926 [0,1,0,0,0,0|2,0,0]=3 2759 B11R1.17 OCCOc1ccccc1F 34a_100000210171_100000211926 [0,1,0,0,0,0|2,0,0]=3 2760 B11R1.17 OCCOc1ccccc1F 7a_100000210171_100000211926 [0,1,0,0,0,0|2,0,0]=3 2761 B11R1.17 OCCOc1ccccc1I 34a_100000739446_100000211926 [0,1,0,0,0,0|2,0,0]=3 2762 B11R1.17 OCCOc1ccccc1I 7a_100000739446_100000211926 [0,1,0,0,0,0|2,0,0]=3 2763 B11R1.17 OCCOc1ccccc1O 271570a_203496583355_100000230753 [0,1,0,0,0,0|1,0,0]=2 2764 B11R1.17 OCCOc1cccnc1Br 34a_100000744436_100000211926 [0,1,0,0,0,0|3,0,0]=4 2765 B11R1.17 OCCOc1cccnc1Br 7a_100000744436_100000211926 [0,1,0,0,0,0|3,0,0]=4 2766 B11R1.17 OCCOc1cccnc1Cl 34a_100000757616_100000211926 [0,1,0,0,0,0|3,0,0]=4 2767 B11R1.17 OCCOc1cccnc1Cl 7a_100000757616_100000211926 [0,1,0,0,0,0|3,0,0]=4 2768 B11R1.17 OCCOc1cccnc1F 34a_100000061740_100000211926 [0,1,0,0,0,0|3,0,0]=4 2769 B11R1.17 OCCOc1cccnc1F 7a_100000061740_100000211926 [0,1,0,0,0,0|3,0,0]=4 2770 B11R1.17 OCCOc1cccnc1I 34a_100000034122_100000211926 [0,1,0,0,0,0|3,0,0]=4 2771 B11R1.17 OCCOc1cccnc1I 7a_100000034122_100000211926 [0,1,0,0,0,0|3,0,0]=4 2772 B11R1.17 OCCOc1ccncc1Br 34a_100011996408_100000211926 [0,1,0,0,0,0|3,0,0]=4 2773 B11R1.17 OCCOc1ccncc1Cl 34a_100011997054_100000211926 [0,1,0,0,0,0|3,0,0]=4 2774 B11R1.17 OCCOc1ccncc1F 34a_200000081243_100000211926 [0,1,0,0,0,0|3,0,0]=4 2775 B11R1.17 OCCOc1cnccc1Cl 34a_100011996695_100000211926 [0,1,0,0,0,0|3,0,0]=4 2776 B11R1.17 OCCOc1cnccc1I 34a_100000050107_100000211926 [0,1,0,0,0,0|3,0,0]=4 2777 B11R1.17 OCCOc1ncccc1Cl 34a_100011290957_100000211926 [0,1,0,0,0,0|3,0,0]=4 2778 B11R1.17 OCCOc1ncccc1F 34a_100011219419_100000211926 [0,1,0,0,0,0|3,0,0]=4 2779 B11R1.17 OCCSc1c[nH]ccc1=S 62a_100000211926_200012280681 [0,1,0,0,0,0|2,1,0]=4 2780 B11R1.17 OCCSc1c[nH]ccc1=S 62a_200012280681_100000211926 [0,1,0,0,0,0|2,1,0]=4 2781 B11R1.17 OCCSc1ccccc1Br 62a_100000211926_100000695589 [0,1,0,0,0,0|2,0,0]=3 2782 B11R1.17 OCCSc1ccccc1Br 62a_100000695589_100000211926 [0,1,0,0,0,0|2,0,0]=3 2783 B11R1.17 OCCSc1ccccc1Cl 62a_100000211926_100000764095 [0,1,0,0,0,0|2,0,0]=3 2784 B11R1.17 OCCSc1ccccc1Cl 62a_100000764095_100000211926 [0,1,0,0,0,0|2,0,0]=3 2785 B11R1.17 OCCSc1ccccc1F 62a_100000211926_100011215700 [0,1,0,0,0,0|2,0,0]=3 2786 B11R1.17 OCCSc1ccccc1F 62a_100011215700_100000211926 [0,1,0,0,0,0|2,0,0]=3 2787 B11R1.17 OCCSc1ccccc1O 271570a_203496583355_200000230852 [0,1,0,0,0,0|1,0,0]=2 2788 B11R1.17 OCCSc1ccccc1O 62a_100000211926_100000739446 [0,1,0,0,0,0|1,0,0]=2 2789 B11R1.17 OCCSc1ccccc1O 62a_100000739446_100000211926 [0,1,0,0,0,0|1,0,0]=2 2790 B11R1.17 OCCSc1cccnc1Br 62a_100000211926_100010202626 [0,1,0,0,0,0|3,0,0]=4 2791 B11R1.17 OCCSc1cccnc1Br 62a_100010202626_100000211926 [0,1,0,0,0,0|3,0,0]=4 2792 B11R1.17 OCCSc1cccnc1Cl 62a_100000036424_100000211926 [0,1,0,0,0,0|3,0,0]=4 2793 B11R1.17 OCCSc1cccnc1Cl 62a_100000211926_100000036424 [0,1,0,0,0,0|3,0,0]=4 2794 B11R1.17 OCCSc1cccnc1F 62a_100000211926_100009816115 [0,1,0,0,0,0|3,0,0]=4 2795 B11R1.17 OCCSc1cccnc1F 62a_100009816115_100000211926 [0,1,0,0,0,0|3,0,0]=4 2796 B11R1.17 OCCSc1cccnc1O 62a_100000211926_100000760158 [0,1,0,0,0,0|2,0,0]=3 2797 B11R1.17 OCCSc1cccnc1O 62a_100000760158_100000211926 [0,1,0,0,0,0|2,0,0]=3 2798 B11R1.17 OCCSc1ccncc1Br 62a_100000211926_100000726257 [0,1,0,0,0,0|3,0,0]=4 2799 B11R1.17 OCCSc1ccncc1Br 62a_100000726257_100000211926 [0,1,0,0,0,0|3,0,0]=4 2800 B11R1.17 OCCSc1ccncc1Cl 62a_100000211926_100000708259 [0,1,0,0,0,0|3,0,0]=4 2801 B11R1.17 OCCSc1ccncc1Cl 62a_100000708259_100000211926 [0,1,0,0,0,0|3,0,0]=4 2802 B11R1.17 OCCSc1ccncc1F 62a_100000047030_100000211926 [0,1,0,0,0,0|3,0,0]=4 2803 B11R1.17 OCCSc1ccncc1F 62a_100000211926_100000047030 [0,1,0,0,0,0|3,0,0]=4 2804 B11R1.17 OCCSc1ccncc1O 62a_100000211926_100009817591 [0,1,0,0,0,0|2,0,0]=3 2805 B11R1.17 OCCSc1ccncc1O 62a_100009817591_100000211926 [0,1,0,0,0,0|2,0,0]=3 2806 B11R1.17 OCCSc1cnccc1Br 62a_100000211926_100010138639 [0,1,0,0,0,0|3,0,0]=4 2807 B11R1.17 OCCSc1cnccc1Br 62a_100010138639_100000211926 [0,1,0,0,0,0|3,0,0]=4 2808 B11R1.17 OCCSc1cnccc1Cl 62a_100000211926_100009995489 [0,1,0,0,0,0|3,0,0]=4 2809 B11R1.17 OCCSc1cnccc1Cl 62a_100009995489_100000211926 [0,1,0,0,0,0|3,0,0]=4 2810 B11R1.17 OCCSc1cnccc1F 62a_100000211926_100009820683 [0,1,0,0,0,0|3,0,0]=4 2811 B11R1.17 OCCSc1cnccc1F 62a_100009820683_100000211926 [0,1,0,0,0,0|3,0,0]=4 2812 B11R1.17 OCCSc1cncnc1O 62a_100000211926_100000751107 [0,1,0,0,0,0|3,0,0]=4 2813 B11R1.17 OCCSc1cncnc1O 62a_100000751107_100000211926 [0,1,0,0,0,0|3,0,0]=4 2814 B11R1.17 OCCSc1ncccc1Br 62a_100000211926_100000696092 [0,1,0,0,0,0|3,0,0]=4 2815 B11R1.17 OCCSc1ncccc1Br 62a_100000696092_100000211926 [0,1,0,0,0,0|3,0,0]=4 2816 B11R1.17 OCCSc1ncccc1Cl 62a_100000211926_100011356963 [0,1,0,0,0,0|3,0,0]=4 2817 B11R1.17 OCCSc1ncccc1Cl 62a_100011356963_100000211926 [0,1,0,0,0,0|3,0,0]=4 2818 B11R1.17 OCCSc1ncccc1F 62a_100000211926_100000685392 [0,1,0,0,0,0|3,0,0]=4 2819 B11R1.17 OCCSc1ncccc1F 62a_100000685392_100000211926 [0,1,0,0,0,0|3,0,0]=4 2820 B11R1.17 OCCSc1ncccc1O 62a_100000034122_100000211926 [0,1,0,0,0,0|2,0,0]=3 2821 B11R1.17 OCCSc1ncccc1O 62a_100000211926_100000034122 [0,1,0,0,0,0|2,0,0]=3 2822 B11R1.17 Oc1ccccc1CNCF 34a_100000185550_100015361967 [0,1,0,0,0,0|1,0,0]=2 2823 B11R1.17 Oc1ccccc1NCCF 34a_100000185747_100011217306 [0,1,0,0,0,0|1,0,0]=2 2824 B11R1.17 Oc1ccccc1SCCF 62a_100000739446_100011217306 [0,1,0,0,0,0|1,0,0]=2 2825 B11R1.17 Oc1ccccc1SCCF 62a_100011217306_100000739446 [0,1,0,0,0,0|1,0,0]=2 2826 B11R1.17 Oc1cccnc1CSCF 62a_100015361967_200020655725 [0,1,0,0,0,0|2,0,0]=3 2827 B11R1.17 Oc1cccnc1CSCF 62a_200020655725_100015361967 [0,1,0,0,0,0|2,0,0]=3 2828 B11R1.17 Oc1cccnc1SCCF 62a_100000034122_100011217306 [0,1,0,0,0,0|2,0,0]=3 2829 B11R1.17 Oc1cccnc1SCCF 62a_100011217306_100000034122 [0,1,0,0,0,0|2,0,0]=3 2830 B11R1.17 Oc1cnccc1SCCF 62a_100009817591_100011217306 [0,1,0,0,0,0|2,0,0]=3 2831 B11R1.17 Oc1cnccc1SCCF 62a_100011217306_100009817591 [0,1,0,0,0,0|2,0,0]=3 2832 B11R1.17 Oc1ncccc1OCCF 271570a_203496583355_100012814765 [0,1,0,0,0,0|2,0,0]=3 2833 B11R1.17 Oc1ncccc1SCCF 62a_100000760158_100011217306 [0,1,0,0,0,0|2,0,0]=3 2834 B11R1.17 Oc1ncccc1SCCF 62a_100011217306_100000760158 [0,1,0,0,0,0|2,0,0]=3 2835 B11R1.17 Oc1ncncc1SCCF 62a_100000751107_100011217306 [0,1,0,0,0,0|3,0,0]=4 2836 B11R1.17 Oc1ncncc1SCCF 62a_100011217306_100000751107 [0,1,0,0,0,0|3,0,0]=4 2837 B11R1.17 [13CH3]NCCc1ccccc1Br 2230a_100000747383_200025704644 [0,1,0,0,0,0|1,0,0]=2 2838 B11R1.17 [13CH3]NCCc1ccccc1Br 34a_100000747383_200025704644 [0,1,0,0,0,0|1,0,0]=2 2839 B11R1.17 [13CH3]NCCc1ccccc1Cl 2230a_100011207228_200025704644 [0,1,0,0,0,0|1,0,0]=2 2840 B11R1.17 [13CH3]NCCc1ccccc1Cl 34a_100011207228_200025704644 [0,1,0,0,0,0|1,0,0]=2 2841 B11R1.17 [13CH3]NCCc1ccccc1F 2230a_100000185272_200025704644 [0,1,0,0,0,0|1,0,0]=2 2842 B11R1.17 [13CH3]NCCc1ccccc1F 34a_100000185272_200025704644 [0,1,0,0,0,0|1,0,0]=2 2843 B11R1.17 [13CH3]NCCc1ccccc1O 34a_100011207237_200025704644 [0,1,0,0,0,0|0,0,0]=1 2844 B11R1.17 [13CH3]NCCn1ccccc1=O 2230a_100000687133_200025704644 [0,1,0,0,0,0|1,0,1]=3 2845 B11R1.17 [13CH3]OCCc1ccccc1Br 34a_100000731337_200025704644 [0,1,0,0,0,0|1,0,0]=2 2846 B11R1.17 [13CH3]OCCc1ccccc1Br 7a_100000731337_200025704644 [0,1,0,0,0,0|1,0,0]=2 2847 B11R1.17 [13CH3]OCCc1ccccc1Cl 34a_100011215284_200025704644 [0,1,0,0,0,0|1,0,0]=2 2848 B11R1.17 [13CH3]OCCc1ccccc1Cl 7a_100011215284_200025704644 [0,1,0,0,0,0|1,0,0]=2 2849 B11R1.17 [13CH3]OCCc1ccccc1F 34a_100000753711_200025704644 [0,1,0,0,0,0|1,0,0]=2 2850 B11R1.17 [13CH3]OCCc1ccccc1F 7a_100000753711_200025704644 [0,1,0,0,0,0|1,0,0]=2 2851 B11R1.17 [13CH3]OCCc1ccccc1I 34a_100010255290_200025704644 [0,1,0,0,0,0|1,0,0]=2 2852 B11R1.17 [13CH3]OCCc1ccccc1I 7a_100010255290_200025704644 [0,1,0,0,0,0|1,0,0]=2 2853 B11R1.17 [13CH3]OCCc1ccccc1N 34a_100011215289_200025704644 [0,1,0,0,0,0|1,0,0]=2 2854 B11R1.17 [13CH3]SCCc1ccccc1Br 62a_100012161201_200025704644 [0,1,0,0,0,0|1,0,0]=2 2855 B11R1.17 [13CH3]SCCc1ccccc1Br 62a_200025704644_100012161201 [0,1,0,0,0,0|1,0,0]=2 2856 B11R1.17 [13CH3]SCCc1ccccc1Cl 62a_100011713703_200025704644 [0,1,0,0,0,0|1,0,0]=2 2857 B11R1.17 [13CH3]SCCc1ccccc1Cl 62a_200025704644_100011713703 [0,1,0,0,0,0|1,0,0]=2 2858 B11R1.17 [13CH3]SCCc1ccccc1F 62a_100011713696_200025704644 [0,1,0,0,0,0|1,0,0]=2 2859 B11R1.17 [13CH3]SCCc1ccccc1F 62a_200025704644_100011713696 [0,1,0,0,0,0|1,0,0]=2 2860 B11R1.17 [13CH3]SCCc1ccccc1O 62a_100000722297_200025704644 [0,1,0,0,0,0|0,0,0]=1 2861 B11R1.17 [13CH3]SCCc1ccccc1O 62a_200025704644_100000722297 [0,1,0,0,0,0|0,0,0]=1 2862 B11R1.17 [O-][n+]1ccccc1OCCF 7a_100000211761_100011217306 [0,1,0,0,0,0|2,0,1]=4 2863 B11R1.17 [O-][n+]1ccccc1OCCO 7a_100000211761_100000211926 [0,1,0,0,0,0|2,0,1]=4 2864 B11R1.17 [O-][n+]1ccccc1SCCF 62a_100011217306_200000042595 [0,1,0,0,0,0|2,0,1]=4 2865 B11R1.17 [O-][n+]1ccccc1SCCO 62a_100000211926_200000042595 [0,1,0,0,0,0|2,0,1]=4 2866 B11R1.41 C#Cc1ccccc1CNC 34a_100020634229_200000210301 [0,1,0,0,0,0|2,0,0]=3 2867 B11R1.41 C#Cc1ccccc1CN[13CH3] 34a_100020634229_200025704644 [0,1,0,0,0,0|2,0,0]=3 2868 B11R1.41 C#Cc1ccccc1COC 34a_100000054652_200000210301 [0,1,0,0,0,0|2,0,0]=3 2869 B11R1.41 C#Cc1ccccc1COC 7a_100000054652_200000210301 [0,1,0,0,0,0|2,0,0]=3 2870 B11R1.41 C#Cc1ccccc1CO[13CH3] 34a_100000054652_200025704644 [0,1,0,0,0,0|2,0,0]=3 2871 B11R1.41 C#Cc1ccccc1CO[13CH3] 7a_100000054652_200025704644 [0,1,0,0,0,0|2,0,0]=3 2872 B11R1.41 C#Cc1ccccc1NCC 34a_100011470550_100000210202 [0,1,0,0,0,0|2,0,0]=3 2873 B11R1.41 C#Cc1ccccc1NCF 34a_100011470550_100015361967 [0,1,0,0,0,0|3,0,0]=4 2874 B11R1.41 C#Cc1ccccc1OCC 34a_200011470546_100000210202 [0,1,0,0,0,0|2,0,0]=3 2875 B11R1.41 C#Cc1ccccc1OCC 7a_200011470546_100000210202 [0,1,0,0,0,0|2,0,0]=3 2876 B11R1.41 C#Cc1ccccc1OCF 34a_200011470546_100015361967 [0,1,0,0,0,0|3,0,0]=4 2877 B11R1.41 C#Cc1ccccc1OCF 7a_200011470546_100015361967 [0,1,0,0,0,0|3,0,0]=4 2878 B11R1.41 C/C=C/c1ccccc1OC 34a_200000189419_200000210301 [0,1,0,0,0,0|0,0,2]=3 2879 B11R1.41 C/C=C/c1ccccc1OC 7a_200000189419_200000210301 [0,1,0,0,0,0|0,0,2]=3 2880 B11R1.41 C/C=C/c1ccccc1O[13CH3] 34a_200000189419_200025704644 [0,1,0,0,0,0|0,0,2]=3 2881 B11R1.41 C/C=C/c1ccccc1O[13CH3] 7a_200000189419_200025704644 [0,1,0,0,0,0|0,0,2]=3 2882 B11R1.41 C=C=Cc1ccccc1CO 271570a_100015277604_100000187465 [0,1,0,0,0,0|0,0,3]=4 2883 B11R1.41 C=C=Cc1ccccc1OC 271570a_100015277604_100000174000 [0,1,0,0,0,0|0,0,3]=4 2884 B11R1.41 C=CCc1ccccc1C=C 271570a_100011290941_100009828059 [0,1,0,0,0,0|1,0,2]=4 2885 B11R1.41 C=CCc1ccccc1NC 2230a_200138433279_200000210301 [0,1,0,0,0,0|1,0,2]=4 2886 B11R1.41 C=CCc1ccccc1NC 34a_200138433279_200000210301 [0,1,0,0,0,0|1,0,2]=4 2887 B11R1.41 C=CCc1ccccc1N[13CH3] 2230a_200138433279_200025704644 [0,1,0,0,0,0|1,0,2]=4 2888 B11R1.41 C=CCc1ccccc1N[13CH3] 34a_200138433279_200025704644 [0,1,0,0,0,0|1,0,2]=4 2889 B11R1.41 C=CCc1ccccc1OC 34a_100000211836_200000210301 [0,1,0,0,0,0|0,0,2]=3 2890 B11R1.41 C=CCc1ccccc1OC 7a_100000211836_200000210301 [0,1,0,0,0,0|0,0,2]=3 2891 B11R1.41 C=CCc1ccccc1O[13CH3] 34a_100000211836_200025704644 [0,1,0,0,0,0|0,0,2]=3 2892 B11R1.41 C=CCc1ccccc1O[13CH3] 7a_100000211836_200025704644 [0,1,0,0,0,0|0,0,2]=3 2893 B11R1.41 C=CCc1ccccc1SC 62a_100009828059_200000210301 [0,1,0,0,0,0|0,1,2]=4 2894 B11R1.41 C=CCc1ccccc1SC 62a_200000210301_100009828059 [0,1,0,0,0,0|0,1,2]=4 2895 B11R1.41 C=CCc1ccccc1S[13CH3] 62a_100009828059_200025704644 [0,1,0,0,0,0|0,1,2]=4 2896 B11R1.41 C=CCc1ccccc1S[13CH3] 62a_200025704644_100009828059 [0,1,0,0,0,0|0,1,2]=4 2897 B11R1.41 C=Cc1ccccc1CC#N 271570a_100011290941_100000033512 [0,1,0,0,0,0|2,0,1]=4 2898 B11R1.41 C=Cc1ccccc1CCN 271570a_100011290941_100000747383 [0,1,0,0,0,0|2,0,0]=3 2899 B11R1.41 C=Cc1ccccc1CCO 271570a_100011290941_100000731337 [0,1,0,0,0,0|2,0,0]=3 2900 B11R1.41 C=Cc1ccccc1CNC 271570a_100011290941_100000184654 [0,1,0,0,0,0|2,0,0]=3 2901 B11R1.41 C=Cc1ccccc1CNN 271570a_100011290941_200016993956 [0,1,0,0,0,0|3,0,0]=4 2902 B11R1.41 C=Cc1ccccc1COC 271570a_100011290941_100011493684 [0,1,0,0,0,0|2,0,0]=3 2903 B11R1.41 C=Cc1ccccc1COC 34a_200010883148_200000210301 [0,1,0,0,0,0|2,0,0]=3 2904 B11R1.41 C=Cc1ccccc1COC 7a_200010883148_200000210301 [0,1,0,0,0,0|2,0,0]=3 2905 B11R1.41 C=Cc1ccccc1CO[13CH3] 34a_200010883148_200025704644 [0,1,0,0,0,0|2,0,0]=3 2906 B11R1.41 C=Cc1ccccc1CO[13CH3] 7a_200010883148_200025704644 [0,1,0,0,0,0|2,0,0]=3 2907 B11R1.41 C=Cc1ccccc1CSC 271570a_100011290941_100000148299 [0,1,0,0,0,0|2,0,0]=3 2908 B11R1.41 C=Cc1ccccc1NCC 271570a_100011290941_114873767003 [0,1,0,0,0,0|2,0,0]=3 2909 B11R1.41 C=Cc1ccccc1NCC 34a_100012022501_100000210202 [0,1,0,0,0,0|2,0,0]=3 2910 B11R1.41 C=Cc1ccccc1NCF 34a_100012022501_100015361967 [0,1,0,0,0,0|3,0,0]=4 2911 B11R1.41 C=Cc1ccccc1OCC 271570a_100011290941_100000230754 [0,1,0,0,0,0|2,0,0]=3 2912 B11R1.41 C=Cc1ccccc1SCC 271570a_100011290941_100000230856 [0,1,0,0,0,0|2,0,0]=3 2913 B11R1.41 C=Cc1ccccc1SCC 62a_100000210202_100011218376 [0,1,0,0,0,0|2,0,0]=3 2914 B11R1.41 C=Cc1ccccc1SCC 62a_100011218376_100000210202 [0,1,0,0,0,0|2,0,0]=3 2915 B11R1.41 C=Cc1ccccc1SCF 62a_100011218376_100015361967 [0,1,0,0,0,0|3,0,0]=4 2916 B11R1.41 C=Cc1ccccc1SCF 62a_100015361967_100011218376 [0,1,0,0,0,0|3,0,0]=4 2917 B11R1.41 C=Cc1cccnc1OCC 271570a_100011290941_100011465154 [0,1,0,0,0,0|3,0,0]=4 2918 B11R1.41 C=Cc1cncnc1CCC 271570a_100011290941_100009816987 [0,1,0,0,0,0|3,0,0]=4 2919 B11R1.41 C=Cc1ncccc1CNC 271570a_100011290941_103496529121 [0,1,0,0,0,0|3,0,0]=4 2920 B11R1.41 C=Cc1ncccc1OCC 271570a_100011290941_100011597540 [0,1,0,0,0,0|3,0,0]=4 2921 B11R1.41 CC=Cc1ccccc1C#N 271570a_100016259895_100000188569 [0,1,0,0,0,0|1,0,2]=4 2922 B11R1.41 CC=Cc1ccccc1C=O 271570a_100016259895_100000211189 [0,1,0,0,0,0|0,0,3]=4 2923 B11R1.41 CC=Cc1ccccc1CC 271570a_100016259895_100011215823 [0,1,0,0,0,0|1,0,2]=4 2924 B11R1.41 CC=Cc1ccccc1CN 271570a_100016259895_100000689332 [0,1,0,0,0,0|1,0,2]=4 2925 B11R1.41 CC=Cc1ccccc1CO 271570a_100016259895_100000187465 [0,1,0,0,0,0|0,0,2]=3 2926 B11R1.41 CC=Cc1ccccc1NC 271570a_100016259895_100020606079 [0,1,0,0,0,0|1,0,2]=4 2927 B11R1.41 CC=Cc1ccccc1NN 271570a_100016259895_100000241748 [0,1,0,0,0,0|1,0,2]=4 2928 B11R1.41 CC=Cc1ccccc1OC 271570a_100016259895_100000174000 [0,1,0,0,0,0|0,0,2]=3 2929 B11R1.41 CC=Cc1ccccc1SC 271570a_100016259895_100011217816 [0,1,0,0,0,0|0,1,2]=4 2930 B11R1.41 CC=Cc1cccnc1CO 271570a_100016259895_100011996772 [0,1,0,0,0,0|1,0,2]=4 2931 B11R1.41 CC=Cc1cccnc1OC 271570a_100016259895_100000047025 [0,1,0,0,0,0|1,0,2]=4 2932 B11R1.41 CC=Cc1ccncc1CO 271570a_100016259895_100000117392 [0,1,0,0,0,0|1,0,2]=4 2933 B11R1.41 CC=Cc1ccncc1OC 271570a_100016259895_100016988167 [0,1,0,0,0,0|1,0,2]=4 2934 B11R1.41 CC=Cc1cnccc1CO 271570a_100016259895_100009873359 [0,1,0,0,0,0|1,0,2]=4 2935 B11R1.41 CC=Cc1cnccc1OC 271570a_100016259895_100011997281 [0,1,0,0,0,0|1,0,2]=4 2936 B11R1.41 CC=Cc1ncccc1CO 271570a_100016259895_100000748726 [0,1,0,0,0,0|1,0,2]=4 2937 B11R1.41 CC=Cc1ncccc1OC 271570a_100016259895_100000690851 [0,1,0,0,0,0|1,0,2]=4 2938 B11R1.41 CCCc1ccccc1NC 2230a_100000737634_200000210301 [0,1,0,0,0,0|1,0,0]=2 2939 B11R1.41 CCCc1ccccc1NC 34a_100000737634_200000210301 [0,1,0,0,0,0|1,0,0]=2 2940 B11R1.41 CCCc1ccccc1NC 7a_100000737634_200000210301 [0,1,0,0,0,0|1,0,0]=2 2941 B11R1.41 CCCc1ccccc1N[13CH3] 2230a_100000737634_200025704644 [0,1,0,0,0,0|1,0,0]=2 2942 B11R1.41 CCCc1ccccc1N[13CH3] 34a_100000737634_200025704644 [0,1,0,0,0,0|1,0,0]=2 2943 B11R1.41 CCCc1ccccc1N[13CH3] 7a_100000737634_200025704644 [0,1,0,0,0,0|1,0,0]=2 2944 B11R1.41 CCCc1ccccc1OC 34a_100011217252_200000210301 [0,1,0,0,0,0|0,0,0]=1 2945 B11R1.41 CCCc1ccccc1OC 7a_100011217252_200000210301 [0,1,0,0,0,0|0,0,0]=1 2946 B11R1.41 CCCc1ccccc1O[13CH3] 34a_100011217252_200025704644 [0,1,0,0,0,0|0,0,0]=1 2947 B11R1.41 CCCc1ccccc1O[13CH3] 7a_100011217252_200025704644 [0,1,0,0,0,0|0,0,0]=1 2948 B11R1.41 CCCc1ncncc1NC 27a_100102657272_100009816987 [0,1,0,0,0,0|3,0,0]=4 2949 B11R1.41 CCCc1ncncc1SC 62a_100009816987_200000210301 [0,1,0,0,0,0|2,1,0]=4 2950 B11R1.41 CCCc1ncncc1SC 62a_200000210301_100009816987 [0,1,0,0,0,0|2,1,0]=4 2951 B11R1.41 CCCc1ncncc1S[13CH3] 62a_100009816987_200025704644 [0,1,0,0,0,0|2,1,0]=4 2952 B11R1.41 CCCc1ncncc1S[13CH3] 62a_200025704644_100009816987 [0,1,0,0,0,0|2,1,0]=4 2953 B11R1.41 CCNc1ccccc1C#N 34a_100000211148_100000210202 [0,1,0,0,0,0|2,0,0]=3 2954 B11R1.41 CCNc1ccccc1CC 2230a_100000212081_100000210202 [0,1,0,0,0,0|2,0,0]=3 2955 B11R1.41 CCNc1ccccc1CC 34a_100000212081_100000210202 [0,1,0,0,0,0|2,0,0]=3 2956 B11R1.41 CCNc1ccccc1CC 7a_100000212081_100000210202 [0,1,0,0,0,0|2,0,0]=3 2957 B11R1.41 CCNc1ccccc1CO 34a_100000212039_100000210202 [0,1,0,0,0,0|1,0,0]=2 2958 B11R1.41 CCNc1ccccc1OC 34a_100000210025_100000210202 [0,1,0,0,0,0|1,0,0]=2 2959 B11R1.41 CCNc1ccccc1OC 34a_103624766699_200000210301 [0,1,0,0,0,0|1,0,0]=2 2960 B11R1.41 CCNc1ccccc1OC 7a_103624766699_200000210301 [0,1,0,0,0,0|1,0,0]=2 2961 B11R1.41 CCNc1ccccc1O[13CH3] 34a_103624766699_200025704644 [0,1,0,0,0,0|1,0,0]=2 2962 B11R1.41 CCNc1ccccc1O[13CH3] 7a_103624766699_200025704644 [0,1,0,0,0,0|1,0,0]=2 2963 B11R1.41 CCNc1ccccc1SC 34a_100000211160_100000210202 [0,1,0,0,0,0|1,1,0]=3 2964 B11R1.41 CCNc1ccccc1SC 62a_114873767003_200000210301 [0,1,0,0,0,0|1,1,0]=3 2965 B11R1.41 CCNc1ccccc1SC 62a_200000210301_114873767003 [0,1,0,0,0,0|1,1,0]=3 2966 B11R1.41 CCNc1ccccc1S[13CH3] 62a_114873767003_200025704644 [0,1,0,0,0,0|1,1,0]=3 2967 B11R1.41 CCNc1ccccc1S[13CH3] 62a_200025704644_114873767003 [0,1,0,0,0,0|1,1,0]=3 2968 B11R1.41 CCNc1ccncc1C#N 27a_100015525214_100000687039 [0,1,0,0,0,0|3,0,0]=4 2969 B11R1.41 CCNc1ccncc1CO 27a_100015525214_100000117392 [0,1,0,0,0,0|2,0,0]=3 2970 B11R1.41 CCNc1cnccc1C#N 27a_100015525214_100000684818 [0,1,0,0,0,0|3,0,0]=4 2971 B11R1.41 CCNc1ncccc1C#N 27a_100015525214_100000211984 [0,1,0,0,0,0|3,0,0]=4 2972 B11R1.41 CCNc1nccnc1OC 27a_100015525214_100009858322 [0,1,0,0,0,0|3,0,0]=4 2973 B11R1.41 CCNc1ncncc1OC 27a_100015525214_100012001275 [0,1,0,0,0,0|3,0,0]=4 2974 B11R1.41 CCOc1ccccc1C#N 34a_100000211048_100000210202 [0,1,0,0,0,0|2,0,0]=3 2975 B11R1.41 CCOc1ccccc1C#N 7a_100000211048_100000210202 [0,1,0,0,0,0|2,0,0]=3 2976 B11R1.41 CCOc1ccccc1CC 34a_100000210936_100000210202 [0,1,0,0,0,0|2,0,0]=3 2977 B11R1.41 CCOc1ccccc1CC 7a_100000210936_100000210202 [0,1,0,0,0,0|2,0,0]=3 2978 B11R1.41 CCOc1ccccc1CN 34a_100000185550_100000210202 [0,1,0,0,0,0|2,0,0]=3 2979 B11R1.41 CCOc1ccccc1CO 34a_100011216872_100000210202 [0,1,0,0,0,0|1,0,0]=2 2980 B11R1.41 CCOc1ccccc1NC 34a_100000033821_100000210202 [0,1,0,0,0,0|2,0,0]=3 2981 B11R1.41 CCOc1ccccc1NC 34a_100000211218_200000210301 [0,1,0,0,0,0|2,0,0]=3 2982 B11R1.41 CCOc1ccccc1N[13CH3] 34a_100000211218_200025704644 [0,1,0,0,0,0|2,0,0]=3 2983 B11R1.41 CCOc1ccccc1OC 34a_100000210385_100000210202 [0,1,0,0,0,0|1,0,0]=2 2984 B11R1.41 CCOc1ccccc1OC 34a_100000211404_200000210301 [0,1,0,0,0,0|1,0,0]=2 2985 B11R1.41 CCOc1ccccc1OC 7a_100000211404_200000210301 [0,1,0,0,0,0|1,0,0]=2 2986 B11R1.41 CCOc1ccccc1O[13CH3] 34a_100000211404_200025704644 [0,1,0,0,0,0|1,0,0]=2 2987 B11R1.41 CCOc1ccccc1O[13CH3] 7a_100000211404_200025704644 [0,1,0,0,0,0|1,0,0]=2 2988 B11R1.41 CCOc1ccccc1SC 34a_100011216402_100000210202 [0,1,0,0,0,0|1,1,0]=3 2989 B11R1.41 CCOc1ccccc1SC 62a_100000230754_200000210301 [0,1,0,0,0,0|1,1,0]=3 2990 B11R1.41 CCOc1ccccc1SC 62a_200000210301_100000230754 [0,1,0,0,0,0|1,1,0]=3 2991 B11R1.41 CCOc1ccccc1S[13CH3] 62a_100000230754_200025704644 [0,1,0,0,0,0|1,1,0]=3 2992 B11R1.41 CCOc1ccccc1S[13CH3] 62a_200025704644_100000230754 [0,1,0,0,0,0|1,1,0]=3 2993 B11R1.41 CCOc1cccnc1C#N 34a_100000722750_100000210202 [0,1,0,0,0,0|3,0,0]=4 2994 B11R1.41 CCOc1cccnc1C#N 7a_100000722750_100000210202 [0,1,0,0,0,0|3,0,0]=4 2995 B11R1.41 CCOc1cccnc1CBr 34a_200020655725_100000210202 [0,1,0,0,0,0|3,0,0]=4 2996 B11R1.41 CCOc1cccnc1CBr 7a_200020655725_100000210202 [0,1,0,0,0,0|3,0,0]=4 2997 B11R1.41 CCOc1cccnc1CO 34a_100000731849_100000210202 [0,1,0,0,0,0|2,0,0]=3 2998 B11R1.41 CCOc1cccnc1OC 34a_100000698397_100000210202 [0,1,0,0,0,0|2,0,0]=3 2999 B11R1.41 CCOc1cccnc1OC 7a_100000698397_100000210202 [0,1,0,0,0,0|2,0,0]=3 3000 B11R1.41 CCOc1cccnc1SC 62a_100011597540_200000210301 [0,1,0,0,0,0|2,1,0]=4 3001 B11R1.41 CCOc1cccnc1SC 62a_200000210301_100011597540 [0,1,0,0,0,0|2,1,0]=4 3002 B11R1.41 CCOc1cccnc1S[13CH3] 62a_100011597540_200025704644 [0,1,0,0,0,0|2,1,0]=4 3003 B11R1.41 CCOc1cccnc1S[13CH3] 62a_200025704644_100011597540 [0,1,0,0,0,0|2,1,0]=4 3004 B11R1.41 CCOc1cnccc1C#N 7a_100012181322_100000210202 [0,1,0,0,0,0|3,0,0]=4 3005 B11R1.41 CCOc1cnccc1CO 34a_100000078615_100000210202 [0,1,0,0,0,0|2,0,0]=3 3006 B11R1.41 CCOc1cnccc1OC 34a_100000101186_100000210202 [0,1,0,0,0,0|2,0,0]=3 3007 B11R1.41 CCOc1ncccc1OC 34a_100011998697_200000210301 [0,1,0,0,0,0|2,0,0]=3 3008 B11R1.41 CCOc1ncccc1OC 34a_100025773188_100000210202 [0,1,0,0,0,0|2,0,0]=3 3009 B11R1.41 CCOc1ncccc1O[13CH3] 34a_100011998697_200025704644 [0,1,0,0,0,0|2,0,0]=3 3010 B11R1.41 CCOc1ncccc1SC 62a_100011465154_200000210301 [0,1,0,0,0,0|2,1,0]=4 3011 B11R1.41 CCOc1ncccc1SC 62a_200000210301_100011465154 [0,1,0,0,0,0|2,1,0]=4 3012 B11R1.41 CCOc1ncccc1S[13CH3] 62a_100011465154_200025704644 [0,1,0,0,0,0|2,1,0]=4 3013 B11R1.41 CCOc1ncccc1S[13CH3] 62a_200025704644_100011465154 [0,1,0,0,0,0|2,1,0]=4 3014 B11R1.41 CCSc1ccccc1C#N 62a_100000210202_100000188569 [0,1,0,0,0,0|2,0,0]=3 3015 B11R1.41 CCSc1ccccc1C=O 62a_100000210073_100000210202 [0,1,0,0,0,0|1,0,1]=3 3016 B11R1.41 CCSc1ccccc1C=O 62a_100000210202_100000210073 [0,1,0,0,0,0|1,0,1]=3 3017 B11R1.41 CCSc1ccccc1CC 62a_100000210202_100011215823 [0,1,0,0,0,0|2,0,0]=3 3018 B11R1.41 CCSc1ccccc1CC 62a_100011215823_100000210202 [0,1,0,0,0,0|2,0,0]=3 3019 B11R1.41 CCSc1ccccc1CN 62a_100000210202_100000689332 [0,1,0,0,0,0|2,0,0]=3 3020 B11R1.41 CCSc1ccccc1CN 62a_100000689332_100000210202 [0,1,0,0,0,0|2,0,0]=3 3021 B11R1.41 CCSc1ccccc1CO 62a_100000187465_100000210202 [0,1,0,0,0,0|1,0,0]=2 3022 B11R1.41 CCSc1ccccc1CO 62a_100000210202_100000187465 [0,1,0,0,0,0|1,0,0]=2 3023 B11R1.41 CCSc1ccccc1NC 34a_100011223125_200000210301 [0,1,0,0,0,0|2,0,0]=3 3024 B11R1.41 CCSc1ccccc1NC 62a_100000210202_100020606079 [0,1,0,0,0,0|2,0,0]=3 3025 B11R1.41 CCSc1ccccc1NC 62a_100020606079_100000210202 [0,1,0,0,0,0|2,0,0]=3 3026 B11R1.41 CCSc1ccccc1NN 62a_100000210202_100000241748 [0,1,0,0,0,0|2,0,0]=3 3027 B11R1.41 CCSc1ccccc1NN 62a_100000241748_100000210202 [0,1,0,0,0,0|2,0,0]=3 3028 B11R1.41 CCSc1ccccc1N[13CH3] 34a_100011223125_200025704644 [0,1,0,0,0,0|2,0,0]=3 3029 B11R1.41 CCSc1ccccc1OC 62a_100000210202_100000210334 [0,1,0,0,0,0|1,0,0]=2 3030 B11R1.41 CCSc1ccccc1OC 62a_100000210334_100000210202 [0,1,0,0,0,0|1,0,0]=2 3031 B11R1.41 CCSc1ccccc1SC 62a_100000210202_100011217816 [0,1,0,0,0,0|1,1,0]=3 3032 B11R1.41 CCSc1ccccc1SC 62a_100000230856_200000210301 [0,1,0,0,0,0|1,1,0]=3 3033 B11R1.41 CCSc1ccccc1SC 62a_100011217816_100000210202 [0,1,0,0,0,0|1,1,0]=3 3034 B11R1.41 CCSc1ccccc1SC 62a_200000210301_100000230856 [0,1,0,0,0,0|1,1,0]=3 3035 B11R1.41 CCSc1ccccc1S[13CH3] 62a_100000230856_200025704644 [0,1,0,0,0,0|1,1,0]=3 3036 B11R1.41 CCSc1ccccc1S[13CH3] 62a_200025704644_100000230856 [0,1,0,0,0,0|1,1,0]=3 3037 B11R1.41 CCSc1cccnc1C#N 62a_100000210202_100000685805 [0,1,0,0,0,0|3,0,0]=4 3038 B11R1.41 CCSc1cccnc1C=O 62a_100000210202_100011934733 [0,1,0,0,0,0|2,0,1]=4 3039 B11R1.41 CCSc1cccnc1C=O 62a_100011934733_100000210202 [0,1,0,0,0,0|2,0,1]=4 3040 B11R1.41 CCSc1cccnc1CC 62a_100000210202_100009877225 [0,1,0,0,0,0|3,0,0]=4 3041 B11R1.41 CCSc1cccnc1CC 62a_100009877225_100000210202 [0,1,0,0,0,0|3,0,0]=4 3042 B11R1.41 CCSc1cccnc1CN 62a_100000210202_100020591323 [0,1,0,0,0,0|3,0,0]=4 3043 B11R1.41 CCSc1cccnc1CN 62a_100020591323_100000210202 [0,1,0,0,0,0|3,0,0]=4 3044 B11R1.41 CCSc1cccnc1CO 62a_100000210202_100011996772 [0,1,0,0,0,0|2,0,0]=3 3045 B11R1.41 CCSc1cccnc1CO 62a_100011996772_100000210202 [0,1,0,0,0,0|2,0,0]=3 3046 B11R1.41 CCSc1cccnc1NC 62a_100000210202_100000700899 [0,1,0,0,0,0|3,0,0]=4 3047 B11R1.41 CCSc1cccnc1NC 62a_100000700899_100000210202 [0,1,0,0,0,0|3,0,0]=4 3048 B11R1.41 CCSc1cccnc1NN 62a_100000210202_100011464834 [0,1,0,0,0,0|3,0,0]=4 3049 B11R1.41 CCSc1cccnc1NN 62a_100011464834_100000210202 [0,1,0,0,0,0|3,0,0]=4 3050 B11R1.41 CCSc1cccnc1OC 62a_100000047025_100000210202 [0,1,0,0,0,0|2,0,0]=3 3051 B11R1.41 CCSc1cccnc1OC 62a_100000210202_100000047025 [0,1,0,0,0,0|2,0,0]=3 3052 B11R1.41 CCSc1cccnc1SC 62a_100000210202_100011465278 [0,1,0,0,0,0|2,1,0]=4 3053 B11R1.41 CCSc1cccnc1SC 62a_100011465278_100000210202 [0,1,0,0,0,0|2,1,0]=4 3054 B11R1.41 CCSc1ccncc1C#N 62a_100000210202_100000687039 [0,1,0,0,0,0|3,0,0]=4 3055 B11R1.41 CCSc1ccncc1C=O 62a_100000050567_100000210202 [0,1,0,0,0,0|2,0,1]=4 3056 B11R1.41 CCSc1ccncc1C=O 62a_100000210202_100000050567 [0,1,0,0,0,0|2,0,1]=4 3057 B11R1.41 CCSc1ccncc1CC 62a_100000210202_100025704421 [0,1,0,0,0,0|3,0,0]=4 3058 B11R1.41 CCSc1ccncc1CC 62a_100025704421_100000210202 [0,1,0,0,0,0|3,0,0]=4 3059 B11R1.41 CCSc1ccncc1CO 62a_100000117392_100000210202 [0,1,0,0,0,0|2,0,0]=3 3060 B11R1.41 CCSc1ccncc1CO 62a_100000210202_100000117392 [0,1,0,0,0,0|2,0,0]=3 3061 B11R1.41 CCSc1ccncc1OC 62a_100000210202_100016988167 [0,1,0,0,0,0|2,0,0]=3 3062 B11R1.41 CCSc1ccncc1OC 62a_100016988167_100000210202 [0,1,0,0,0,0|2,0,0]=3 3063 B11R1.41 CCSc1cnccc1C#N 62a_100000210202_100000684818 [0,1,0,0,0,0|3,0,0]=4 3064 B11R1.41 CCSc1cnccc1C=O 62a_100000210202_100011934409 [0,1,0,0,0,0|2,0,1]=4 3065 B11R1.41 CCSc1cnccc1C=O 62a_100011934409_100000210202 [0,1,0,0,0,0|2,0,1]=4 3066 B11R1.41 CCSc1cnccc1CC 62a_100000210202_100009819861 [0,1,0,0,0,0|3,0,0]=4 3067 B11R1.41 CCSc1cnccc1CC 62a_100009819861_100000210202 [0,1,0,0,0,0|3,0,0]=4 3068 B11R1.41 CCSc1cnccc1CN 62a_100000210202_100020640021 [0,1,0,0,0,0|3,0,0]=4 3069 B11R1.41 CCSc1cnccc1CN 62a_100020640021_100000210202 [0,1,0,0,0,0|3,0,0]=4 3070 B11R1.41 CCSc1cnccc1CO 62a_100000210202_100009873359 [0,1,0,0,0,0|2,0,0]=3 3071 B11R1.41 CCSc1cnccc1CO 62a_100009873359_100000210202 [0,1,0,0,0,0|2,0,0]=3 3072 B11R1.41 CCSc1cnccc1NC 62a_100000210202_100010069531 [0,1,0,0,0,0|3,0,0]=4 3073 B11R1.41 CCSc1cnccc1NC 62a_100010069531_100000210202 [0,1,0,0,0,0|3,0,0]=4 3074 B11R1.41 CCSc1cnccc1NN 62a_100000210202_100013404636 [0,1,0,0,0,0|3,0,0]=4 3075 B11R1.41 CCSc1cnccc1NN 62a_100013404636_100000210202 [0,1,0,0,0,0|3,0,0]=4 3076 B11R1.41 CCSc1cnccc1OC 62a_100000210202_100011997281 [0,1,0,0,0,0|2,0,0]=3 3077 B11R1.41 CCSc1cnccc1OC 62a_100011997281_100000210202 [0,1,0,0,0,0|2,0,0]=3 3078 B11R1.41 CCSc1cncnc1OC 62a_100000210202_100000719902 [0,1,0,0,0,0|3,0,0]=4 3079 B11R1.41 CCSc1cncnc1OC 62a_100000719902_100000210202 [0,1,0,0,0,0|3,0,0]=4 3080 B11R1.41 CCSc1ncccc1C#N 62a_100000210202_100000211984 [0,1,0,0,0,0|3,0,0]=4 3081 B11R1.41 CCSc1ncccc1C=O 62a_100000210202_100009816751 [0,1,0,0,0,0|2,0,1]=4 3082 B11R1.41 CCSc1ncccc1C=O 62a_100009816751_100000210202 [0,1,0,0,0,0|2,0,1]=4 3083 B11R1.41 CCSc1ncccc1CN 62a_100000210202_100015189234 [0,1,0,0,0,0|3,0,0]=4 3084 B11R1.41 CCSc1ncccc1CN 62a_100015189234_100000210202 [0,1,0,0,0,0|3,0,0]=4 3085 B11R1.41 CCSc1ncccc1CO 62a_100000210202_100000748726 [0,1,0,0,0,0|2,0,0]=3 3086 B11R1.41 CCSc1ncccc1CO 62a_100000748726_100000210202 [0,1,0,0,0,0|2,0,0]=3 3087 B11R1.41 CCSc1ncccc1NC 62a_100000210202_200011806188 [0,1,0,0,0,0|3,0,0]=4 3088 B11R1.41 CCSc1ncccc1OC 62a_100000210202_100000690851 [0,1,0,0,0,0|2,0,0]=3 3089 B11R1.41 CCSc1ncccc1OC 62a_100000767102_100000210202 [0,1,0,0,0,0|2,0,0]=3 3090 B11R1.41 CCSc1nccnc1CO 62a_100000057004_100000210202 [0,1,0,0,0,0|3,0,0]=4 3091 B11R1.41 CCSc1nccnc1CO 62a_100000210202_100000057004 [0,1,0,0,0,0|3,0,0]=4 3092 B11R1.41 CCSc1nccnc1OC 62a_100000210202_100000749998 [0,1,0,0,0,0|3,0,0]=4 3093 B11R1.41 CCSc1nccnc1OC 62a_100009858322_100000210202 [0,1,0,0,0,0|3,0,0]=4 3094 B11R1.41 CCSc1ncncc1OC 62a_100000210202_100012001275 [0,1,0,0,0,0|3,0,0]=4 3095 B11R1.41 CCSc1ncncc1OC 62a_100012001275_100000210202 [0,1,0,0,0,0|3,0,0]=4 3096 B11R1.41 CCc1ccccc1CNC 207a_100102657272_100011219594 [0,1,0,0,0,0|2,0,0]=3 3097 B11R1.41 CCc1ccccc1CNC 270004a_106832991635_100011219594 [0,1,0,0,0,0|2,0,0]=3 3098 B11R1.41 CCc1ccccc1COC 34a_100011663872_200000210301 [0,1,0,0,0,0|2,0,0]=3 3099 B11R1.41 CCc1ccccc1COC 7a_100011663872_200000210301 [0,1,0,0,0,0|2,0,0]=3 3100 B11R1.41 CCc1ccccc1CO[13CH3] 34a_100011663872_200025704644 [0,1,0,0,0,0|2,0,0]=3 3101 B11R1.41 CCc1ccccc1CO[13CH3] 7a_100011663872_200025704644 [0,1,0,0,0,0|2,0,0]=3 3102 B11R1.41 CCc1ccccc1NCF 34a_100000212081_100015361967 [0,1,0,0,0,0|3,0,0]=4 3103 B11R1.41 CCc1ccccc1NCF 7a_100000212081_100015361967 [0,1,0,0,0,0|3,0,0]=4 3104 B11R1.41 CCc1ccccc1OCF 34a_100000210936_100015361967 [0,1,0,0,0,0|3,0,0]=4 3105 B11R1.41 CCc1ccccc1OCF 7a_100000210936_100015361967 [0,1,0,0,0,0|3,0,0]=4 3106 B11R1.41 CCc1ccccc1SCF 62a_100011215823_100015361967 [0,1,0,0,0,0|3,0,0]=4 3107 B11R1.41 CCc1ccccc1SCF 62a_100015361967_100011215823 [0,1,0,0,0,0|3,0,0]=4 3108 B11R1.41 CNCc1ccccc1C#N 2230a_106832991635_100000181865 [0,1,0,0,0,0|2,0,0]=3 3109 B11R1.41 CNCc1ccccc1C#N 34a_100016989011_200000210301 [0,1,0,0,0,0|2,0,0]=3 3110 B11R1.41 CNCc1ccccc1C#N 34a_100102657272_100000181865 [0,1,0,0,0,0|2,0,0]=3 3111 B11R1.41 CNCc1ccccc1C#N 7a_106832991635_100000181865 [0,1,0,0,0,0|2,0,0]=3 3112 B11R1.41 CNCc1ccccc1C=O 2230a_106832991635_200009853537 [0,1,0,0,0,0|1,0,1]=3 3113 B11R1.41 CNCc1ccccc1C=O 34a_100102657272_200009853537 [0,1,0,0,0,0|1,0,1]=3 3114 B11R1.41 CNCc1ccccc1C=O 7a_106832991635_200009853537 [0,1,0,0,0,0|1,0,1]=3 3115 B11R1.41 CNCc1ccccc1CO 2230a_106832991635_100009816955 [0,1,0,0,0,0|1,0,0]=2 3116 B11R1.41 CNCc1ccccc1CO 34a_100102657272_100009816955 [0,1,0,0,0,0|1,0,0]=2 3117 B11R1.41 CNCc1ccccc1CO 7a_106832991635_100009816955 [0,1,0,0,0,0|1,0,0]=2 3118 B11R1.41 CNCc1ccccc1OC 207a_100102657272_100000169842 [0,1,0,0,0,0|1,0,0]=2 3119 B11R1.41 CNCc1ccccc1OC 2230a_106832991635_100000210004 [0,1,0,0,0,0|1,0,0]=2 3120 B11R1.41 CNCc1ccccc1OC 270004a_106832991635_100000169842 [0,1,0,0,0,0|1,0,0]=2 3121 B11R1.41 CNCc1ccccc1OC 34a_100000188900_200000210301 [0,1,0,0,0,0|1,0,0]=2 3122 B11R1.41 CNCc1ccccc1OC 34a_100015189988_200000210301 [0,1,0,0,0,0|1,0,0]=2 3123 B11R1.41 CNCc1ccccc1OC 34a_100102657272_100000210004 [0,1,0,0,0,0|1,0,0]=2 3124 B11R1.41 CNCc1ccccc1OC 7a_106832991635_100000210004 [0,1,0,0,0,0|1,0,0]=2 3125 B11R1.41 CNCc1ccccc1O[13CH3] 34a_100015189988_200025704644 [0,1,0,0,0,0|1,0,0]=2 3126 B11R1.41 CNCc1ccccc1SC 207a_100102657272_100011217347 [0,1,0,0,0,0|1,1,0]=3 3127 B11R1.41 CNCc1ccccc1SC 2230a_106832991635_100000699184 [0,1,0,0,0,0|1,1,0]=3 3128 B11R1.41 CNCc1ccccc1SC 270004a_106832991635_100011217347 [0,1,0,0,0,0|1,1,0]=3 3129 B11R1.41 CNCc1ccccc1SC 34a_100102657272_100000699184 [0,1,0,0,0,0|1,1,0]=3 3130 B11R1.41 CNCc1ccccc1SC 34a_102495365025_200000210301 [0,1,0,0,0,0|1,1,0]=3 3131 B11R1.41 CNCc1ccccc1SC 62a_100000184654_200000210301 [0,1,0,0,0,0|1,1,0]=3 3132 B11R1.41 CNCc1ccccc1SC 62a_200000210301_100000184654 [0,1,0,0,0,0|1,1,0]=3 3133 B11R1.41 CNCc1ccccc1SC 7a_106832991635_100000699184 [0,1,0,0,0,0|1,1,0]=3 3134 B11R1.41 CNCc1ccccc1S[13CH3] 62a_100000184654_200025704644 [0,1,0,0,0,0|1,1,0]=3 3135 B11R1.41 CNCc1ccccc1S[13CH3] 62a_200025704644_100000184654 [0,1,0,0,0,0|1,1,0]=3 3136 B11R1.41 CNCc1cccnc1C#N 2230a_106832991635_100011768898 [0,1,0,0,0,0|3,0,0]=4 3137 B11R1.41 CNCc1cccnc1C#N 34a_100102657272_100011768898 [0,1,0,0,0,0|3,0,0]=4 3138 B11R1.41 CNCc1cccnc1C#N 7a_106832991635_100011768898 [0,1,0,0,0,0|3,0,0]=4 3139 B11R1.41 CNCc1cccnc1OC 207a_100102657272_100011290804 [0,1,0,0,0,0|2,0,0]=3 3140 B11R1.41 CNCc1cccnc1OC 2230a_106832991635_100020631285 [0,1,0,0,0,0|2,0,0]=3 3141 B11R1.41 CNCc1cccnc1OC 270004a_106832991635_100011290804 [0,1,0,0,0,0|2,0,0]=3 3142 B11R1.41 CNCc1cccnc1OC 34a_100102657272_100020631285 [0,1,0,0,0,0|2,0,0]=3 3143 B11R1.41 CNCc1cccnc1OC 7a_106832991635_100020631285 [0,1,0,0,0,0|2,0,0]=3 3144 B11R1.41 CNCc1cccnc1SC 62a_103496529121_200000210301 [0,1,0,0,0,0|2,1,0]=4 3145 B11R1.41 CNCc1cccnc1SC 62a_200000210301_103496529121 [0,1,0,0,0,0|2,1,0]=4 3146 B11R1.41 CNCc1cccnc1S[13CH3] 62a_103496529121_200025704644 [0,1,0,0,0,0|2,1,0]=4 3147 B11R1.41 CNCc1cccnc1S[13CH3] 62a_200025704644_103496529121 [0,1,0,0,0,0|2,1,0]=4 3148 B11R1.41 CNCc1ccncc1OC 207a_100102657272_100011361505 [0,1,0,0,0,0|2,0,0]=3 3149 B11R1.41 CNCc1ccncc1OC 2230a_106832991635_100020635607 [0,1,0,0,0,0|2,0,0]=3 3150 B11R1.41 CNCc1ccncc1OC 270004a_106832991635_100011361505 [0,1,0,0,0,0|2,0,0]=3 3151 B11R1.41 CNCc1ccncc1OC 7a_106832991635_100020635607 [0,1,0,0,0,0|2,0,0]=3 3152 B11R1.41 CNCc1cnccc1OC 207a_100102657272_200011997045 [0,1,0,0,0,0|2,0,0]=3 3153 B11R1.41 CNCc1cnccc1OC 270004a_106832991635_200011997045 [0,1,0,0,0,0|2,0,0]=3 3154 B11R1.41 CNCc1ncccc1C#N 2230a_106832991635_100000099805 [0,1,0,0,0,0|3,0,0]=4 3155 B11R1.41 CNCc1ncccc1C#N 7a_106832991635_100000099805 [0,1,0,0,0,0|3,0,0]=4 3156 B11R1.41 CNCc1ncccc1OC 207a_100102657272_100011912573 [0,1,0,0,0,0|2,0,0]=3 3157 B11R1.41 CNCc1ncccc1OC 270004a_106832991635_100011912573 [0,1,0,0,0,0|2,0,0]=3 3158 B11R1.41 CNc1ccccc1CCO 2230a_100011215289_200000210301 [0,1,0,0,0,0|2,0,0]=3 3159 B11R1.41 CNc1ccccc1CCO 34a_100011215289_200000210301 [0,1,0,0,0,0|2,0,0]=3 3160 B11R1.41 CNc1ccccc1OCF 34a_100000033821_100015361967 [0,1,0,0,0,0|3,0,0]=4 3161 B11R1.41 CNc1ccccc1SCF 62a_100015361967_100020606079 [0,1,0,0,0,0|3,0,0]=4 3162 B11R1.41 CNc1ccccc1SCF 62a_100020606079_100015361967 [0,1,0,0,0,0|3,0,0]=4 3163 B11R1.41 COCc1ccccc1C#N 34a_100138415774_100000181865 [0,1,0,0,0,0|2,0,0]=3 3164 B11R1.41 COCc1ccccc1C#N 34a_200011269968_200000210301 [0,1,0,0,0,0|2,0,0]=3 3165 B11R1.41 COCc1ccccc1C#N 7a_200011269968_200000210301 [0,1,0,0,0,0|2,0,0]=3 3166 B11R1.41 COCc1ccccc1C=O 34a_100138415774_200009853537 [0,1,0,0,0,0|1,0,1]=3 3167 B11R1.41 COCc1ccccc1CBr 34a_100009816955_200000210301 [0,1,0,0,0,0|2,0,0]=3 3168 B11R1.41 COCc1ccccc1CBr 7a_100009816955_200000210301 [0,1,0,0,0,0|2,0,0]=3 3169 B11R1.41 COCc1ccccc1CN 34a_100000743596_200000210301 [0,1,0,0,0,0|2,0,0]=3 3170 B11R1.41 COCc1ccccc1CO 34a_100138415774_100009816955 [0,1,0,0,0,0|1,0,0]=2 3171 B11R1.41 COCc1ccccc1OC 34a_100000211301_200000210301 [0,1,0,0,0,0|1,0,0]=2 3172 B11R1.41 COCc1ccccc1OC 34a_100011488565_200000210301 [0,1,0,0,0,0|1,0,0]=2 3173 B11R1.41 COCc1ccccc1OC 34a_100138415774_100000210004 [0,1,0,0,0,0|1,0,0]=2 3174 B11R1.41 COCc1ccccc1OC 7a_100011488565_200000210301 [0,1,0,0,0,0|1,0,0]=2 3175 B11R1.41 COCc1ccccc1O[13CH3] 34a_100011488565_200025704644 [0,1,0,0,0,0|1,0,0]=2 3176 B11R1.41 COCc1ccccc1O[13CH3] 7a_100011488565_200025704644 [0,1,0,0,0,0|1,0,0]=2 3177 B11R1.41 COCc1ccccc1SC 34a_100000699167_200000210301 [0,1,0,0,0,0|1,1,0]=3 3178 B11R1.41 COCc1ccccc1SC 34a_100138415774_100000699184 [0,1,0,0,0,0|1,1,0]=3 3179 B11R1.41 COCc1ccccc1SC 62a_100011493684_200000210301 [0,1,0,0,0,0|1,1,0]=3 3180 B11R1.41 COCc1ccccc1SC 62a_200000210301_100011493684 [0,1,0,0,0,0|1,1,0]=3 3181 B11R1.41 COCc1ccccc1S[13CH3] 62a_100011493684_200025704644 [0,1,0,0,0,0|1,1,0]=3 3182 B11R1.41 COCc1ccccc1S[13CH3] 62a_200025704644_100011493684 [0,1,0,0,0,0|1,1,0]=3 3183 B11R1.41 COCc1cccnc1C#N 34a_100138415774_100011768898 [0,1,0,0,0,0|3,0,0]=4 3184 B11R1.41 COCc1cccnc1OC 34a_100000717863_200000210301 [0,1,0,0,0,0|2,0,0]=3 3185 B11R1.41 COCc1cccnc1OC 34a_100138415774_100020631285 [0,1,0,0,0,0|2,0,0]=3 3186 B11R1.41 COCc1ncccc1OC 34a_100011998681_200000210301 [0,1,0,0,0,0|2,0,0]=3 3187 B11R1.41 COc1ccccc1CC#N 34a_100000043107_200000210301 [0,1,0,0,0,0|1,0,1]=3 3188 B11R1.41 COc1ccccc1CC#N 7a_100000043107_200000210301 [0,1,0,0,0,0|1,0,1]=3 3189 B11R1.41 COc1ccccc1CCBr 34a_100000722297_200000210301 [0,1,0,0,0,0|1,0,0]=2 3190 B11R1.41 COc1ccccc1CCBr 7a_100000722297_200000210301 [0,1,0,0,0,0|1,0,0]=2 3191 B11R1.41 COc1ccccc1CCN 34a_100011207237_200000210301 [0,1,0,0,0,0|1,0,0]=2 3192 B11R1.41 COc1ccccc1CCO 34a_100000719421_200000210301 [0,1,0,0,0,0|1,0,0]=2 3193 B11R1.41 COc1ccccc1CCO 7a_100000719421_200000210301 [0,1,0,0,0,0|1,0,0]=2 3194 B11R1.41 COc1ccccc1CN[13CH3] 34a_100000188900_200025704644 [0,1,0,0,0,0|1,0,0]=2 3195 B11R1.41 COc1ccccc1CO[13CH3] 34a_100000211301_200025704644 [0,1,0,0,0,0|1,0,0]=2 3196 B11R1.41 COc1ccccc1CSC 62a_100000210004_200000210301 [0,1,0,0,0,0|1,0,0]=2 3197 B11R1.41 COc1ccccc1CSC 62a_200000210301_100000210004 [0,1,0,0,0,0|1,0,0]=2 3198 B11R1.41 COc1ccccc1CS[13CH3] 62a_100000210004_200025704644 [0,1,0,0,0,0|1,0,0]=2 3199 B11R1.41 COc1ccccc1CS[13CH3] 62a_200025704644_100000210004 [0,1,0,0,0,0|1,0,0]=2 3200 B11R1.41 COc1ccccc1NCF 34a_100000210025_100015361967 [0,1,0,0,0,0|2,0,0]=3 3201 B11R1.41 COc1ccccc1OCF 34a_100000210385_100015361967 [0,1,0,0,0,0|2,0,0]=3 3202 B11R1.41 COc1ccccc1SCF 62a_100000210334_100015361967 [0,1,0,0,0,0|2,0,0]=3 3203 B11R1.41 COc1ccccc1SCF 62a_100015361967_100000210334 [0,1,0,0,0,0|2,0,0]=3 3204 B11R1.41 COc1cccnc1CO[13CH3] 34a_100011998681_200025704644 [0,1,0,0,0,0|2,0,0]=3 3205 B11R1.41 COc1cccnc1OCF 34a_100025773188_100015361967 [0,1,0,0,0,0|3,0,0]=4 3206 B11R1.41 COc1cccnc1SCF 62a_100000767102_100015361967 [0,1,0,0,0,0|3,0,0]=4 3207 B11R1.41 COc1cccnc1SCF 62a_100015361967_100000690851 [0,1,0,0,0,0|3,0,0]=4 3208 B11R1.41 COc1ccncc1OCF 34a_100000101186_100015361967 [0,1,0,0,0,0|3,0,0]=4 3209 B11R1.41 COc1ccncc1SCF 62a_100011997281_100015361967 [0,1,0,0,0,0|3,0,0]=4 3210 B11R1.41 COc1ccncc1SCF 62a_100015361967_100011997281 [0,1,0,0,0,0|3,0,0]=4 3211 B11R1.41 COc1cnccc1CSC 62a_100020635607_200000210301 [0,1,0,0,0,0|2,0,0]=3 3212 B11R1.41 COc1cnccc1CSC 62a_200000210301_100020635607 [0,1,0,0,0,0|2,0,0]=3 3213 B11R1.41 COc1cnccc1CS[13CH3] 62a_100020635607_200025704644 [0,1,0,0,0,0|2,0,0]=3 3214 B11R1.41 COc1cnccc1CS[13CH3] 62a_200025704644_100020635607 [0,1,0,0,0,0|2,0,0]=3 3215 B11R1.41 COc1cnccc1SCF 62a_100015361967_100016988167 [0,1,0,0,0,0|3,0,0]=4 3216 B11R1.41 COc1cnccc1SCF 62a_100016988167_100015361967 [0,1,0,0,0,0|3,0,0]=4 3217 B11R1.41 COc1ncccc1CO[13CH3] 34a_100000717863_200025704644 [0,1,0,0,0,0|2,0,0]=3 3218 B11R1.41 COc1ncccc1CSC 62a_100020631285_200000210301 [0,1,0,0,0,0|2,0,0]=3 3219 B11R1.41 COc1ncccc1CSC 62a_200000210301_100020631285 [0,1,0,0,0,0|2,0,0]=3 3220 B11R1.41 COc1ncccc1CS[13CH3] 62a_100020631285_200025704644 [0,1,0,0,0,0|2,0,0]=3 3221 B11R1.41 COc1ncccc1CS[13CH3] 62a_200025704644_100020631285 [0,1,0,0,0,0|2,0,0]=3 3222 B11R1.41 COc1ncccc1OCF 34a_100000698397_100015361967 [0,1,0,0,0,0|3,0,0]=4 3223 B11R1.41 COc1ncccc1OCF 7a_100000698397_100015361967 [0,1,0,0,0,0|3,0,0]=4 3224 B11R1.41 COc1ncccc1SCF 62a_100000047025_100015361967 [0,1,0,0,0,0|3,0,0]=4 3225 B11R1.41 COc1ncccc1SCF 62a_100015361967_100000047025 [0,1,0,0,0,0|3,0,0]=4 3226 B11R1.41 CSCc1ccccc1C#N 62a_100000186380_200000210301 [0,1,0,0,0,0|2,0,0]=3 3227 B11R1.41 CSCc1ccccc1C#N 62a_200000210301_100000181865 [0,1,0,0,0,0|2,0,0]=3 3228 B11R1.41 CSCc1ccccc1C=O 62a_200000210301_200009853537 [0,1,0,0,0,0|1,0,1]=3 3229 B11R1.41 CSCc1ccccc1C=O 62a_200009853537_200000210301 [0,1,0,0,0,0|1,0,1]=3 3230 B11R1.41 CSCc1ccccc1CO 62a_100009816955_200000210301 [0,1,0,0,0,0|1,0,0]=2 3231 B11R1.41 CSCc1ccccc1CO 62a_200000210301_100009816955 [0,1,0,0,0,0|1,0,0]=2 3232 B11R1.41 CSCc1ccccc1SC 62a_100000148299_200000210301 [0,1,0,0,0,0|1,1,0]=3 3233 B11R1.41 CSCc1ccccc1SC 62a_100000699184_200000210301 [0,1,0,0,0,0|1,1,0]=3 3234 B11R1.41 CSCc1ccccc1SC 62a_200000210301_100000148299 [0,1,0,0,0,0|1,1,0]=3 3235 B11R1.41 CSCc1ccccc1SC 62a_200000210301_100000699184 [0,1,0,0,0,0|1,1,0]=3 3236 B11R1.41 CSCc1ccccc1S[13CH3] 62a_100000148299_200025704644 [0,1,0,0,0,0|1,1,0]=3 3237 B11R1.41 CSCc1ccccc1S[13CH3] 62a_200025704644_100000148299 [0,1,0,0,0,0|1,1,0]=3 3238 B11R1.41 CSCc1cccnc1C#N 62a_200000210301_100011768898 [0,1,0,0,0,0|3,0,0]=4 3239 B11R1.41 CSCc1ncccc1C#N 62a_200000210301_100000099805 [0,1,0,0,0,0|3,0,0]=4 3240 B11R1.41 CSc1ccccc1CC#N 62a_100000033512_200000210301 [0,1,0,0,0,0|1,1,1]=4 3241 B11R1.41 CSc1ccccc1CC#N 62a_200000210301_100000033512 [0,1,0,0,0,0|1,1,1]=4 3242 B11R1.41 CSc1ccccc1CCN 62a_100000747383_200000210301 [0,1,0,0,0,0|1,1,0]=3 3243 B11R1.41 CSc1ccccc1CCN 62a_200000210301_100000747383 [0,1,0,0,0,0|1,1,0]=3 3244 B11R1.41 CSc1ccccc1CCO 62a_100000731337_200000210301 [0,1,0,0,0,0|1,1,0]=3 3245 B11R1.41 CSc1ccccc1CCO 62a_200000210301_100000731337 [0,1,0,0,0,0|1,1,0]=3 3246 B11R1.41 CSc1ccccc1CNN 62a_200000210301_200016993956 [0,1,0,0,0,0|2,1,0]=4 3247 B11R1.41 CSc1ccccc1CNN 62a_200016993956_200000210301 [0,1,0,0,0,0|2,1,0]=4 3248 B11R1.41 CSc1ccccc1CN[13CH3] 34a_102495365025_200025704644 [0,1,0,0,0,0|1,1,0]=3 3249 B11R1.41 CSc1ccccc1CO[13CH3] 34a_100000699167_200025704644 [0,1,0,0,0,0|1,1,0]=3 3250 B11R1.41 CSc1ccccc1CS[13CH3] 62a_100000699184_200025704644 [0,1,0,0,0,0|1,1,0]=3 3251 B11R1.41 CSc1ccccc1CS[13CH3] 62a_200025704644_100000699184 [0,1,0,0,0,0|1,1,0]=3 3252 B11R1.41 CSc1ccccc1NCF 34a_100000211160_100015361967 [0,1,0,0,0,0|2,1,0]=4 3253 B11R1.41 CSc1ccccc1OCF 34a_100011216402_100015361967 [0,1,0,0,0,0|2,1,0]=4 3254 B11R1.41 CSc1ccccc1SCF 62a_100011217816_100015361967 [0,1,0,0,0,0|2,1,0]=4 3255 B11R1.41 CSc1ccccc1SCF 62a_100015361967_100011217816 [0,1,0,0,0,0|2,1,0]=4 3256 B11R1.41 N#Cc1ccccc1NCF 34a_100000211148_100015361967 [0,1,0,0,0,0|3,0,0]=4 3257 B11R1.41 N#Cc1ccccc1OCF 34a_100000211048_100015361967 [0,1,0,0,0,0|3,0,0]=4 3258 B11R1.41 N#Cc1ccccc1OCF 7a_100000211048_100015361967 [0,1,0,0,0,0|3,0,0]=4 3259 B11R1.41 N#Cc1ccccc1SCF 62a_100015361967_100000188569 [0,1,0,0,0,0|3,0,0]=4 3260 B11R1.41 NCc1ccccc1OCF 34a_100000185550_100015361967 [0,1,0,0,0,0|3,0,0]=4 3261 B11R1.41 NCc1ccccc1SCF 62a_100000689332_100015361967 [0,1,0,0,0,0|3,0,0]=4 3262 B11R1.41 NCc1ccccc1SCF 62a_100015361967_100000689332 [0,1,0,0,0,0|3,0,0]=4 3263 B11R1.41 NNc1ccccc1SCF 62a_100000241748_100015361967 [0,1,0,0,0,0|3,0,0]=4 3264 B11R1.41 NNc1ccccc1SCF 62a_100015361967_100000241748 [0,1,0,0,0,0|3,0,0]=4 3265 B11R1.41 O=Cc1ccccc1SCF 62a_100000210073_100015361967 [0,1,0,0,0,0|2,0,1]=4 3266 B11R1.41 O=Cc1ccccc1SCF 62a_100015361967_100000210073 [0,1,0,0,0,0|2,0,1]=4 3267 B11R1.41 OCc1ccccc1NCF 34a_100000212039_100015361967 [0,1,0,0,0,0|2,0,0]=3 3268 B11R1.41 OCc1ccccc1OCF 34a_100011216872_100015361967 [0,1,0,0,0,0|2,0,0]=3 3269 B11R1.41 OCc1ccccc1SCF 62a_100000187465_100015361967 [0,1,0,0,0,0|2,0,0]=3 3270 B11R1.41 OCc1ccccc1SCF 62a_100015361967_100000187465 [0,1,0,0,0,0|2,0,0]=3 3271 B11R1.41 OCc1cccnc1SCF 62a_100000748726_100015361967 [0,1,0,0,0,0|3,0,0]=4 3272 B11R1.41 OCc1cccnc1SCF 62a_100015361967_100000748726 [0,1,0,0,0,0|3,0,0]=4 3273 B11R1.41 OCc1ccncc1OCF 34a_100000078615_100015361967 [0,1,0,0,0,0|3,0,0]=4 3274 B11R1.41 OCc1ccncc1SCF 62a_100009873359_100015361967 [0,1,0,0,0,0|3,0,0]=4 3275 B11R1.41 OCc1ccncc1SCF 62a_100015361967_100009873359 [0,1,0,0,0,0|3,0,0]=4 3276 B11R1.41 OCc1cnccc1SCF 62a_100000117392_100015361967 [0,1,0,0,0,0|3,0,0]=4 3277 B11R1.41 OCc1cnccc1SCF 62a_100015361967_100000117392 [0,1,0,0,0,0|3,0,0]=4 3278 B11R1.41 OCc1ncccc1OCF 34a_100000731849_100015361967 [0,1,0,0,0,0|3,0,0]=4 3279 B11R1.41 OCc1ncccc1SCF 62a_100011996772_100015361967 [0,1,0,0,0,0|3,0,0]=4 3280 B11R1.41 OCc1ncccc1SCF 62a_100015361967_100011996772 [0,1,0,0,0,0|3,0,0]=4 3281 B11R1.41 [13CH3]NCc1ccccc1C#N 34a_100016989011_200025704644 [0,1,0,0,0,0|2,0,0]=3 3282 B11R1.41 [13CH3]Nc1ccccc1CCO 2230a_100011215289_200025704644 [0,1,0,0,0,0|2,0,0]=3 3283 B11R1.41 [13CH3]Nc1ccccc1CCO 34a_100011215289_200025704644 [0,1,0,0,0,0|2,0,0]=3 3284 B11R1.41 [13CH3]OCc1ccccc1C#N 34a_200011269968_200025704644 [0,1,0,0,0,0|2,0,0]=3 3285 B11R1.41 [13CH3]OCc1ccccc1C#N 7a_200011269968_200025704644 [0,1,0,0,0,0|2,0,0]=3 3286 B11R1.41 [13CH3]OCc1ccccc1CBr 34a_100009816955_200025704644 [0,1,0,0,0,0|2,0,0]=3 3287 B11R1.41 [13CH3]OCc1ccccc1CBr 7a_100009816955_200025704644 [0,1,0,0,0,0|2,0,0]=3 3288 B11R1.41 [13CH3]OCc1ccccc1CN 34a_100000743596_200025704644 [0,1,0,0,0,0|2,0,0]=3 3289 B11R1.41 [13CH3]Oc1ccccc1CC#N 34a_100000043107_200025704644 [0,1,0,0,0,0|1,0,1]=3 3290 B11R1.41 [13CH3]Oc1ccccc1CC#N 7a_100000043107_200025704644 [0,1,0,0,0,0|1,0,1]=3 3291 B11R1.41 [13CH3]Oc1ccccc1CCBr 34a_100000722297_200025704644 [0,1,0,0,0,0|1,0,0]=2 3292 B11R1.41 [13CH3]Oc1ccccc1CCBr 7a_100000722297_200025704644 [0,1,0,0,0,0|1,0,0]=2 3293 B11R1.41 [13CH3]Oc1ccccc1CCN 34a_100011207237_200025704644 [0,1,0,0,0,0|1,0,0]=2 3294 B11R1.41 [13CH3]Oc1ccccc1CCO 34a_100000719421_200025704644 [0,1,0,0,0,0|1,0,0]=2 3295 B11R1.41 [13CH3]Oc1ccccc1CCO 7a_100000719421_200025704644 [0,1,0,0,0,0|1,0,0]=2 3296 B11R1.41 [13CH3]SCc1ccccc1C#N 62a_100000186380_200025704644 [0,1,0,0,0,0|2,0,0]=3 3297 B11R1.41 [13CH3]SCc1ccccc1C#N 62a_200025704644_100000181865 [0,1,0,0,0,0|2,0,0]=3 3298 B11R1.41 [13CH3]SCc1ccccc1C=O 62a_200009853537_200025704644 [0,1,0,0,0,0|1,0,1]=3 3299 B11R1.41 [13CH3]SCc1ccccc1C=O 62a_200025704644_200009853537 [0,1,0,0,0,0|1,0,1]=3 3300 B11R1.41 [13CH3]SCc1ccccc1CO 62a_100009816955_200025704644 [0,1,0,0,0,0|1,0,0]=2 3301 B11R1.41 [13CH3]SCc1ccccc1CO 62a_200025704644_100009816955 [0,1,0,0,0,0|1,0,0]=2 3302 B11R1.41 [13CH3]SCc1cccnc1C#N 62a_200025704644_100011768898 [0,1,0,0,0,0|3,0,0]=4 3303 B11R1.41 [13CH3]SCc1ncccc1C#N 62a_200025704644_100000099805 [0,1,0,0,0,0|3,0,0]=4 3304 B11R1.41 [13CH3]Sc1ccccc1CC#N 62a_100000033512_200025704644 [0,1,0,0,0,0|1,1,1]=4 3305 B11R1.41 [13CH3]Sc1ccccc1CC#N 62a_200025704644_100000033512 [0,1,0,0,0,0|1,1,1]=4 3306 B11R1.41 [13CH3]Sc1ccccc1CCN 62a_100000747383_200025704644 [0,1,0,0,0,0|1,1,0]=3 3307 B11R1.41 [13CH3]Sc1ccccc1CCN 62a_200025704644_100000747383 [0,1,0,0,0,0|1,1,0]=3 3308 B11R1.41 [13CH3]Sc1ccccc1CCO 62a_100000731337_200025704644 [0,1,0,0,0,0|1,1,0]=3 3309 B11R1.41 [13CH3]Sc1ccccc1CCO 62a_200025704644_100000731337 [0,1,0,0,0,0|1,1,0]=3 3310 B11R1.41 [13CH3]Sc1ccccc1CNN 62a_200016993956_200025704644 [0,1,0,0,0,0|2,1,0]=4 3311 B11R1.41 [13CH3]Sc1ccccc1CNN 62a_200025704644_200016993956 [0,1,0,0,0,0|2,1,0]=4 3312 B11R1.81 C=C=Cc1ccc(cc1O)Br 271570a_100015277604_100012344904 [0,1,0,0,0,0|0,0,3]=4 3313 B11R1.81 C=C=Cc1ccc(cc1O)C 271570a_100015277604_100012002257 [0,1,0,0,0,0|0,0,3]=4 3314 B11R1.81 C=C=Cc1ccc(cc1O)Cl 271570a_100015277604_100000050036 [0,1,0,0,0,0|0,0,3]=4 3315 B11R1.81 C=C=Cc1ccc(cc1O)F 271570a_100015277604_100000690578 [0,1,0,0,0,0|0,0,3]=4 3316 B11R1.81 C=C=Cc1ccc(cc1O)O 271570a_100015277604_100009813921 [0,1,0,0,0,0|0,0,3]=4 3317 B11R1.81 CC=Cc1ccc(cc1Br)Br 271570a_100016259895_100011484698 [0,1,0,0,0,0|1,0,2]=4 3318 B11R1.81 CC=Cc1ccc(cc1Br)C 271570a_100016259895_100009813563 [0,1,0,0,0,0|1,0,2]=4 3319 B11R1.81 CC=Cc1ccc(cc1Br)Cl 271570a_100016259895_100011219703 [0,1,0,0,0,0|1,0,2]=4 3320 B11R1.81 CC=Cc1ccc(cc1Br)F 271570a_100016259895_100011217111 [0,1,0,0,0,0|1,0,2]=4 3321 B11R1.81 CC=Cc1ccc(cc1Br)N 271570a_100016259895_100000750458 [0,1,0,0,0,0|1,0,2]=4 3322 B11R1.81 CC=Cc1ccc(cc1Br)O 271570a_100016259895_100000701344 [0,1,0,0,0,0|1,0,2]=4 3323 B11R1.81 CC=Cc1ccc(cc1C)Br 271570a_100016259895_100000701812 [0,1,0,0,0,0|1,0,2]=4 3324 B11R1.81 CC=Cc1ccc(cc1C)C 271570a_100016259895_100011217332 [0,1,0,0,0,0|1,0,2]=4 3325 B11R1.81 CC=Cc1ccc(cc1C)Cl 271570a_100016259895_100011219607 [0,1,0,0,0,0|1,0,2]=4 3326 B11R1.81 CC=Cc1ccc(cc1C)F 271570a_100016259895_100011205405 [0,1,0,0,0,0|1,0,2]=4 3327 B11R1.81 CC=Cc1ccc(cc1C)N 271570a_100016259895_100000210723 [0,1,0,0,0,0|1,0,2]=4 3328 B11R1.81 CC=Cc1ccc(cc1C)O 271570a_100016259895_100000729255 [0,1,0,0,0,0|1,0,2]=4 3329 B11R1.81 CC=Cc1ccc(cc1Cl)Br 271570a_100016259895_100011216062 [0,1,0,0,0,0|1,0,2]=4 3330 B11R1.81 CC=Cc1ccc(cc1Cl)C 271570a_100016259895_100011263221 [0,1,0,0,0,0|1,0,2]=4 3331 B11R1.81 CC=Cc1ccc(cc1Cl)Cl 271570a_100016259895_100000699841 [0,1,0,0,0,0|1,0,2]=4 3332 B11R1.81 CC=Cc1ccc(cc1Cl)F 271570a_100016259895_100000733362 [0,1,0,0,0,0|1,0,2]=4 3333 B11R1.81 CC=Cc1ccc(cc1Cl)N 271570a_100016259895_100000761885 [0,1,0,0,0,0|1,0,2]=4 3334 B11R1.81 CC=Cc1ccc(cc1Cl)O 271570a_100016259895_100000047559 [0,1,0,0,0,0|1,0,2]=4 3335 B11R1.81 CC=Cc1ccc(cc1F)Br 271570a_100016259895_100009814013 [0,1,0,0,0,0|1,0,2]=4 3336 B11R1.81 CC=Cc1ccc(cc1F)C 271570a_100016259895_100011216119 [0,1,0,0,0,0|1,0,2]=4 3337 B11R1.81 CC=Cc1ccc(cc1F)Cl 271570a_100016259895_100011216042 [0,1,0,0,0,0|1,0,2]=4 3338 B11R1.81 CC=Cc1ccc(cc1F)F 271570a_100016259895_100000750030 [0,1,0,0,0,0|1,0,2]=4 3339 B11R1.81 CC=Cc1ccc(cc1F)N 271570a_100016259895_100011356925 [0,1,0,0,0,0|1,0,2]=4 3340 B11R1.81 CC=Cc1ccc(cc1F)O 271570a_100016259895_100000755031 [0,1,0,0,0,0|1,0,2]=4 3341 B11R1.81 CC=Cc1ccc(cc1N)Br 271570a_100016259895_100000743836 [0,1,0,0,0,0|1,0,2]=4 3342 B11R1.81 CC=Cc1ccc(cc1N)C 271570a_100016259895_100011216686 [0,1,0,0,0,0|1,0,2]=4 3343 B11R1.81 CC=Cc1ccc(cc1N)Cl 271570a_100016259895_100000761886 [0,1,0,0,0,0|1,0,2]=4 3344 B11R1.81 CC=Cc1ccc(cc1N)F 271570a_100016259895_100011218093 [0,1,0,0,0,0|1,0,2]=4 3345 B11R1.81 CC=Cc1ccc(cc1N)N 271570a_100016259895_200012175722 [0,1,0,0,0,0|1,0,2]=4 3346 B11R1.81 CC=Cc1ccc(cc1N)O 271570a_100016259895_100011999798 [0,1,0,0,0,0|1,0,2]=4 3347 B11R1.81 CC=Cc1ccc(cc1O)Br 271570a_100016259895_100012344904 [0,1,0,0,0,0|0,0,2]=3 3348 B11R1.81 CC=Cc1ccc(cc1O)C 271570a_100016259895_100012002257 [0,1,0,0,0,0|0,0,2]=3 3349 B11R1.81 CC=Cc1ccc(cc1O)Cl 271570a_100016259895_100000050036 [0,1,0,0,0,0|0,0,2]=3 3350 B11R1.81 CC=Cc1ccc(cc1O)F 271570a_100016259895_100000690578 [0,1,0,0,0,0|0,0,2]=3 3351 B11R1.81 CC=Cc1ccc(cc1O)O 271570a_100016259895_100009813921 [0,1,0,0,0,0|0,0,2]=3 3352 B11R1.81 CC=Cc1ccc(nc1O)C 271570a_100016259895_100009817604 [0,1,0,0,0,0|1,0,2]=4 3353 B11R1.81 CC=Cc1cnc(cc1O)C 271570a_100016259895_100011016184 [0,1,0,0,0,0|1,0,2]=4 3354 B11R1.81 CC=Cc1ncc(cc1O)Br 271570a_100016259895_100010210634 [0,1,0,0,0,0|1,0,2]=4 3355 B11R1.81 CC=Cc1ncc(cc1O)C 271570a_100016259895_100012000487 [0,1,0,0,0,0|1,0,2]=4 3356 B11R1.81 CC=Cc1ncc(cc1O)Cl 271570a_100016259895_100010233512 [0,1,0,0,0,0|1,0,2]=4 3357 B11R1.81 CC=Cc1ncc(cc1O)F 271570a_100016259895_100000079967 [0,1,0,0,0,0|1,0,2]=4 3358 B11R1.81 CCCc1cnc(nc1O)C 271570a_203496583355_200000069602 [0,1,0,0,0,0|2,0,0]=3 3359 B11R1.81 CCNc1ccc(cc1Br)Br 34a_100000211012_100000210202 [0,1,0,0,0,0|2,0,0]=3 3360 B11R1.81 CCNc1ccc(cc1Br)C 34a_100000210942_100000210202 [0,1,0,0,0,0|2,0,0]=3 3361 B11R1.81 CCNc1ccc(cc1Br)Cl 34a_100000752454_100000210202 [0,1,0,0,0,0|2,0,0]=3 3362 B11R1.81 CCNc1ccc(cc1Br)F 34a_100000738039_100000210202 [0,1,0,0,0,0|2,0,0]=3 3363 B11R1.81 CCNc1ccc(cc1Br)O 34a_100012001276_100000210202 [0,1,0,0,0,0|2,0,0]=3 3364 B11R1.81 CCNc1ccc(cc1C)Br 34a_100000211769_100000210202 [0,1,0,0,0,0|2,0,0]=3 3365 B11R1.81 CCNc1ccc(cc1C)Br 7a_100000211769_100000210202 [0,1,0,0,0,0|2,0,0]=3 3366 B11R1.81 CCNc1ccc(cc1C)C 34a_100000736561_100000210202 [0,1,0,0,0,0|2,0,0]=3 3367 B11R1.81 CCNc1ccc(cc1C)C 7a_100000736561_100000210202 [0,1,0,0,0,0|2,0,0]=3 3368 B11R1.81 CCNc1ccc(cc1C)Cl 34a_100000210418_100000210202 [0,1,0,0,0,0|2,0,0]=3 3369 B11R1.81 CCNc1ccc(cc1C)Cl 7a_100000210418_100000210202 [0,1,0,0,0,0|2,0,0]=3 3370 B11R1.81 CCNc1ccc(cc1C)F 34a_100000211637_100000210202 [0,1,0,0,0,0|2,0,0]=3 3371 B11R1.81 CCNc1ccc(cc1C)F 7a_100000211637_100000210202 [0,1,0,0,0,0|2,0,0]=3 3372 B11R1.81 CCNc1ccc(cc1C)I 34a_100000184554_100000210202 [0,1,0,0,0,0|2,0,0]=3 3373 B11R1.81 CCNc1ccc(cc1C)I 7a_100000184554_100000210202 [0,1,0,0,0,0|2,0,0]=3 3374 B11R1.81 CCNc1ccc(cc1C)O 34a_100000756630_100000210202 [0,1,0,0,0,0|2,0,0]=3 3375 B11R1.81 CCNc1ccc(cc1Cl)Br 34a_100000211467_100000210202 [0,1,0,0,0,0|2,0,0]=3 3376 B11R1.81 CCNc1ccc(cc1Cl)C 34a_100000210522_100000210202 [0,1,0,0,0,0|2,0,0]=3 3377 B11R1.81 CCNc1ccc(cc1Cl)Cl 34a_100000185861_100000210202 [0,1,0,0,0,0|2,0,0]=3 3378 B11R1.81 CCNc1ccc(cc1Cl)F 34a_100000212003_100000210202 [0,1,0,0,0,0|2,0,0]=3 3379 B11R1.81 CCNc1ccc(cc1Cl)I 34a_100011218065_100000210202 [0,1,0,0,0,0|2,0,0]=3 3380 B11R1.81 CCNc1ccc(cc1Cl)O 34a_100011215599_100000210202 [0,1,0,0,0,0|2,0,0]=3 3381 B11R1.81 CCNc1ccc(cc1F)Br 34a_100000210722_100000210202 [0,1,0,0,0,0|2,0,0]=3 3382 B11R1.81 CCNc1ccc(cc1F)C 34a_100000211023_100000210202 [0,1,0,0,0,0|2,0,0]=3 3383 B11R1.81 CCNc1ccc(cc1F)Cl 34a_100000211020_100000210202 [0,1,0,0,0,0|2,0,0]=3 3384 B11R1.81 CCNc1ccc(cc1F)F 34a_100000210720_100000210202 [0,1,0,0,0,0|2,0,0]=3 3385 B11R1.81 CCNc1ccc(cc1F)I 34a_100011215594_100000210202 [0,1,0,0,0,0|2,0,0]=3 3386 B11R1.81 CCNc1ccc(cc1F)O 34a_100000759473_100000210202 [0,1,0,0,0,0|2,0,0]=3 3387 B11R1.81 CCNc1ccc(cc1I)Br 34a_100000187925_100000210202 [0,1,0,0,0,0|2,0,0]=3 3388 B11R1.81 CCNc1ccc(cc1I)C 34a_100011356834_100000210202 [0,1,0,0,0,0|2,0,0]=3 3389 B11R1.81 CCNc1ccc(cc1I)Cl 34a_100000761889_100000210202 [0,1,0,0,0,0|2,0,0]=3 3390 B11R1.81 CCNc1ccc(cc1I)F 34a_100000760547_100000210202 [0,1,0,0,0,0|2,0,0]=3 3391 B11R1.81 CCNc1ccc(cc1I)O 34a_100010084370_100000210202 [0,1,0,0,0,0|2,0,0]=3 3392 B11R1.81 CCNc1ccc(cc1O)Br 34a_100000739049_100000210202 [0,1,0,0,0,0|1,0,0]=2 3393 B11R1.81 CCNc1ccc(cc1O)C 34a_100000211527_100000210202 [0,1,0,0,0,0|1,0,0]=2 3394 B11R1.81 CCNc1ccc(cc1O)Cl 34a_100000185728_100000210202 [0,1,0,0,0,0|1,0,0]=2 3395 B11R1.81 CCNc1ccc(cc1O)F 34a_100000753323_100000210202 [0,1,0,0,0,0|1,0,0]=2 3396 B11R1.81 CCNc1ccc(cc1O)O 34a_100000106777_100000210202 [0,1,0,0,0,0|1,0,0]=2 3397 B11R1.81 CCOc1ccc(cc1Br)Br 34a_100000188717_100000210202 [0,1,0,0,0,0|2,0,0]=3 3398 B11R1.81 CCOc1ccc(cc1Br)Br 7a_100000188717_100000210202 [0,1,0,0,0,0|2,0,0]=3 3399 B11R1.81 CCOc1ccc(cc1Br)C 34a_100000210800_100000210202 [0,1,0,0,0,0|2,0,0]=3 3400 B11R1.81 CCOc1ccc(cc1Br)C 7a_100000210800_100000210202 [0,1,0,0,0,0|2,0,0]=3 3401 B11R1.81 CCOc1ccc(cc1Br)Cl 34a_100000211998_100000210202 [0,1,0,0,0,0|2,0,0]=3 3402 B11R1.81 CCOc1ccc(cc1Br)Cl 7a_100000211998_100000210202 [0,1,0,0,0,0|2,0,0]=3 3403 B11R1.81 CCOc1ccc(cc1Br)F 34a_100000211999_100000210202 [0,1,0,0,0,0|2,0,0]=3 3404 B11R1.81 CCOc1ccc(cc1Br)F 7a_100000211999_100000210202 [0,1,0,0,0,0|2,0,0]=3 3405 B11R1.81 CCOc1ccc(cc1Br)I 34a_100012361655_100000210202 [0,1,0,0,0,0|2,0,0]=3 3406 B11R1.81 CCOc1ccc(cc1Br)I 7a_100012361655_100000210202 [0,1,0,0,0,0|2,0,0]=3 3407 B11R1.81 CCOc1ccc(cc1Br)N 34a_100011534360_100000210202 [0,1,0,0,0,0|2,0,0]=3 3408 B11R1.81 CCOc1ccc(cc1Br)N 7a_100011534360_100000210202 [0,1,0,0,0,0|2,0,0]=3 3409 B11R1.81 CCOc1ccc(cc1C)Br 34a_100000186361_100000210202 [0,1,0,0,0,0|2,0,0]=3 3410 B11R1.81 CCOc1ccc(cc1C)Br 7a_100000186361_100000210202 [0,1,0,0,0,0|2,0,0]=3 3411 B11R1.81 CCOc1ccc(cc1C)C 34a_100000211776_100000210202 [0,1,0,0,0,0|2,0,0]=3 3412 B11R1.81 CCOc1ccc(cc1C)C 7a_100000211776_100000210202 [0,1,0,0,0,0|2,0,0]=3 3413 B11R1.81 CCOc1ccc(cc1C)Cl 34a_100000211091_100000210202 [0,1,0,0,0,0|2,0,0]=3 3414 B11R1.81 CCOc1ccc(cc1C)Cl 7a_100000211091_100000210202 [0,1,0,0,0,0|2,0,0]=3 3415 B11R1.81 CCOc1ccc(cc1C)F 34a_100000764316_100000210202 [0,1,0,0,0,0|2,0,0]=3 3416 B11R1.81 CCOc1ccc(cc1C)F 7a_100000764316_100000210202 [0,1,0,0,0,0|2,0,0]=3 3417 B11R1.81 CCOc1ccc(cc1C)I 34a_100011218673_100000210202 [0,1,0,0,0,0|2,0,0]=3 3418 B11R1.81 CCOc1ccc(cc1C)I 7a_100011218673_100000210202 [0,1,0,0,0,0|2,0,0]=3 3419 B11R1.81 CCOc1ccc(cc1C)N 34a_100011218179_100000210202 [0,1,0,0,0,0|2,0,0]=3 3420 B11R1.81 CCOc1ccc(cc1C)N 7a_100011218179_100000210202 [0,1,0,0,0,0|2,0,0]=3 3421 B11R1.81 CCOc1ccc(cc1C)O 271570a_203496583355_100011308936 [0,1,0,0,0,0|2,0,0]=3 3422 B11R1.81 CCOc1ccc(cc1Cl)Br 34a_100000186472_100000210202 [0,1,0,0,0,0|2,0,0]=3 3423 B11R1.81 CCOc1ccc(cc1Cl)Br 7a_100000186472_100000210202 [0,1,0,0,0,0|2,0,0]=3 3424 B11R1.81 CCOc1ccc(cc1Cl)C 34a_100000749699_100000210202 [0,1,0,0,0,0|2,0,0]=3 3425 B11R1.81 CCOc1ccc(cc1Cl)C 7a_100000749699_100000210202 [0,1,0,0,0,0|2,0,0]=3 3426 B11R1.81 CCOc1ccc(cc1Cl)Cl 34a_100015191787_100000210202 [0,1,0,0,0,0|2,0,0]=3 3427 B11R1.81 CCOc1ccc(cc1Cl)Cl 7a_100015191787_100000210202 [0,1,0,0,0,0|2,0,0]=3 3428 B11R1.81 CCOc1ccc(cc1Cl)F 34a_100000212004_100000210202 [0,1,0,0,0,0|2,0,0]=3 3429 B11R1.81 CCOc1ccc(cc1Cl)F 7a_100000212004_100000210202 [0,1,0,0,0,0|2,0,0]=3 3430 B11R1.81 CCOc1ccc(cc1Cl)I 34a_100012360047_100000210202 [0,1,0,0,0,0|2,0,0]=3 3431 B11R1.81 CCOc1ccc(cc1Cl)I 7a_100012360047_100000210202 [0,1,0,0,0,0|2,0,0]=3 3432 B11R1.81 CCOc1ccc(cc1Cl)N 34a_100000744943_100000210202 [0,1,0,0,0,0|2,0,0]=3 3433 B11R1.81 CCOc1ccc(cc1Cl)N 7a_100000744943_100000210202 [0,1,0,0,0,0|2,0,0]=3 3434 B11R1.81 CCOc1ccc(cc1F)Br 34a_100000185481_100000210202 [0,1,0,0,0,0|2,0,0]=3 3435 B11R1.81 CCOc1ccc(cc1F)Br 7a_100000185481_100000210202 [0,1,0,0,0,0|2,0,0]=3 3436 B11R1.81 CCOc1ccc(cc1F)C 34a_100011216688_100000210202 [0,1,0,0,0,0|2,0,0]=3 3437 B11R1.81 CCOc1ccc(cc1F)C 7a_100011216688_100000210202 [0,1,0,0,0,0|2,0,0]=3 3438 B11R1.81 CCOc1ccc(cc1F)Cl 34a_100000230166_100000210202 [0,1,0,0,0,0|2,0,0]=3 3439 B11R1.81 CCOc1ccc(cc1F)Cl 7a_100000230166_100000210202 [0,1,0,0,0,0|2,0,0]=3 3440 B11R1.81 CCOc1ccc(cc1F)F 34a_100000230127_100000210202 [0,1,0,0,0,0|2,0,0]=3 3441 B11R1.81 CCOc1ccc(cc1F)F 7a_100000230127_100000210202 [0,1,0,0,0,0|2,0,0]=3 3442 B11R1.81 CCOc1ccc(cc1F)I 34a_100011356965_100000210202 [0,1,0,0,0,0|2,0,0]=3 3443 B11R1.81 CCOc1ccc(cc1F)I 7a_100011356965_100000210202 [0,1,0,0,0,0|2,0,0]=3 3444 B11R1.81 CCOc1ccc(cc1F)N 34a_100011220035_100000210202 [0,1,0,0,0,0|2,0,0]=3 3445 B11R1.81 CCOc1ccc(cc1F)N 7a_100011220035_100000210202 [0,1,0,0,0,0|2,0,0]=3 3446 B11R1.81 CCOc1ccc(cc1F)O 271570a_203496583355_200000171753 [0,1,0,0,0,0|2,0,0]=3 3447 B11R1.81 CCOc1ccc(cc1I)Br 34a_100012355227_100000210202 [0,1,0,0,0,0|2,0,0]=3 3448 B11R1.81 CCOc1ccc(cc1I)Br 7a_100012355227_100000210202 [0,1,0,0,0,0|2,0,0]=3 3449 B11R1.81 CCOc1ccc(cc1I)C 34a_100000765521_100000210202 [0,1,0,0,0,0|2,0,0]=3 3450 B11R1.81 CCOc1ccc(cc1I)C 7a_100000765521_100000210202 [0,1,0,0,0,0|2,0,0]=3 3451 B11R1.81 CCOc1ccc(cc1I)Cl 34a_100011356953_100000210202 [0,1,0,0,0,0|2,0,0]=3 3452 B11R1.81 CCOc1ccc(cc1I)Cl 7a_100011356953_100000210202 [0,1,0,0,0,0|2,0,0]=3 3453 B11R1.81 CCOc1ccc(cc1I)F 34a_100012355409_100000210202 [0,1,0,0,0,0|2,0,0]=3 3454 B11R1.81 CCOc1ccc(cc1I)F 7a_100012355409_100000210202 [0,1,0,0,0,0|2,0,0]=3 3455 B11R1.81 CCOc1ccc(cc1I)I 7a_100010001573_100000210202 [0,1,0,0,0,0|2,0,0]=3 3456 B11R1.81 CCOc1ccc(cc1N)Br 34a_100000752626_100000210202 [0,1,0,0,0,0|2,0,0]=3 3457 B11R1.81 CCOc1ccc(cc1N)Br 7a_100000752626_100000210202 [0,1,0,0,0,0|2,0,0]=3 3458 B11R1.81 CCOc1ccc(cc1N)C 34a_100011215204_100000210202 [0,1,0,0,0,0|2,0,0]=3 3459 B11R1.81 CCOc1ccc(cc1N)C 7a_100011215204_100000210202 [0,1,0,0,0,0|2,0,0]=3 3460 B11R1.81 CCOc1ccc(cc1N)Cl 34a_100000210500_100000210202 [0,1,0,0,0,0|2,0,0]=3 3461 B11R1.81 CCOc1ccc(cc1N)Cl 7a_100000210500_100000210202 [0,1,0,0,0,0|2,0,0]=3 3462 B11R1.81 CCOc1ccc(cc1N)F 34a_100000759472_100000210202 [0,1,0,0,0,0|2,0,0]=3 3463 B11R1.81 CCOc1ccc(cc1N)F 7a_100000759472_100000210202 [0,1,0,0,0,0|2,0,0]=3 3464 B11R1.81 CCOc1ccc(cc1N)I 34a_100000753495_100000210202 [0,1,0,0,0,0|2,0,0]=3 3465 B11R1.81 CCOc1ccc(cc1N)I 7a_100000753495_100000210202 [0,1,0,0,0,0|2,0,0]=3 3466 B11R1.81 CCOc1ccc(cc1N)N 34a_100000725306_100000210202 [0,1,0,0,0,0|2,0,0]=3 3467 B11R1.81 CCOc1ccc(cc1N)O 271570a_203496583355_100000751366 [0,1,0,0,0,0|2,0,0]=3 3468 B11R1.81 CCOc1ccc(cc1O)C 271570a_203496583355_200000230997 [0,1,0,0,0,0|1,0,0]=2 3469 B11R1.81 CCOc1ccc(cc1O)F 271570a_203496583355_100000171695 [0,1,0,0,0,0|1,0,0]=2 3470 B11R1.81 CCOc1ccc(nc1Br)Br 34a_100009999766_100000210202 [0,1,0,0,0,0|3,0,0]=4 3471 B11R1.81 CCOc1ccc(nc1Br)Br 7a_100009999766_100000210202 [0,1,0,0,0,0|3,0,0]=4 3472 B11R1.81 CCOc1ccc(nc1Br)C 34a_100000702858_100000210202 [0,1,0,0,0,0|3,0,0]=4 3473 B11R1.81 CCOc1ccc(nc1Br)C 7a_100000702858_100000210202 [0,1,0,0,0,0|3,0,0]=4 3474 B11R1.81 CCOc1ccc(nc1Br)Cl 34a_100010219353_100000210202 [0,1,0,0,0,0|3,0,0]=4 3475 B11R1.81 CCOc1ccc(nc1Br)Cl 7a_100010219353_100000210202 [0,1,0,0,0,0|3,0,0]=4 3476 B11R1.81 CCOc1ccc(nc1Br)F 34a_100009887730_100000210202 [0,1,0,0,0,0|3,0,0]=4 3477 B11R1.81 CCOc1ccc(nc1Br)F 7a_100009887730_100000210202 [0,1,0,0,0,0|3,0,0]=4 3478 B11R1.81 CCOc1ccc(nc1Br)I 34a_100000725334_100000210202 [0,1,0,0,0,0|3,0,0]=4 3479 B11R1.81 CCOc1ccc(nc1Br)I 7a_100000725334_100000210202 [0,1,0,0,0,0|3,0,0]=4 3480 B11R1.81 CCOc1ccc(nc1C)Br 34a_100012002022_100000210202 [0,1,0,0,0,0|3,0,0]=4 3481 B11R1.81 CCOc1ccc(nc1C)Br 7a_100012002022_100000210202 [0,1,0,0,0,0|3,0,0]=4 3482 B11R1.81 CCOc1ccc(nc1C)C 34a_100011218912_100000210202 [0,1,0,0,0,0|3,0,0]=4 3483 B11R1.81 CCOc1ccc(nc1C)C 7a_100011218912_100000210202 [0,1,0,0,0,0|3,0,0]=4 3484 B11R1.81 CCOc1ccc(nc1C)Cl 34a_100012184626_100000210202 [0,1,0,0,0,0|3,0,0]=4 3485 B11R1.81 CCOc1ccc(nc1C)Cl 7a_100012184626_100000210202 [0,1,0,0,0,0|3,0,0]=4 3486 B11R1.81 CCOc1ccc(nc1C)F 34a_100009881036_100000210202 [0,1,0,0,0,0|3,0,0]=4 3487 B11R1.81 CCOc1ccc(nc1C)F 7a_100009881036_100000210202 [0,1,0,0,0,0|3,0,0]=4 3488 B11R1.81 CCOc1ccc(nc1C)I 34a_100010233687_100000210202 [0,1,0,0,0,0|3,0,0]=4 3489 B11R1.81 CCOc1ccc(nc1C)I 7a_100010233687_100000210202 [0,1,0,0,0,0|3,0,0]=4 3490 B11R1.81 CCOc1ccc(nc1Cl)Br 34a_100010246206_100000210202 [0,1,0,0,0,0|3,0,0]=4 3491 B11R1.81 CCOc1ccc(nc1Cl)Br 7a_100010246206_100000210202 [0,1,0,0,0,0|3,0,0]=4 3492 B11R1.81 CCOc1ccc(nc1Cl)C 34a_100000086286_100000210202 [0,1,0,0,0,0|3,0,0]=4 3493 B11R1.81 CCOc1ccc(nc1Cl)C 7a_100000086286_100000210202 [0,1,0,0,0,0|3,0,0]=4 3494 B11R1.81 CCOc1ccc(nc1Cl)Cl 34a_100000101165_100000210202 [0,1,0,0,0,0|3,0,0]=4 3495 B11R1.81 CCOc1ccc(nc1Cl)Cl 7a_100000101165_100000210202 [0,1,0,0,0,0|3,0,0]=4 3496 B11R1.81 CCOc1ccc(nc1Cl)I 34a_100000721234_100000210202 [0,1,0,0,0,0|3,0,0]=4 3497 B11R1.81 CCOc1ccc(nc1Cl)I 7a_100000721234_100000210202 [0,1,0,0,0,0|3,0,0]=4 3498 B11R1.81 CCOc1ccc(nc1F)Br 34a_100009819667_100000210202 [0,1,0,0,0,0|3,0,0]=4 3499 B11R1.81 CCOc1ccc(nc1F)Br 7a_100009819667_100000210202 [0,1,0,0,0,0|3,0,0]=4 3500 B11R1.81 CCOc1ccc(nc1F)C 34a_100000079963_100000210202 [0,1,0,0,0,0|3,0,0]=4 3501 B11R1.81 CCOc1ccc(nc1F)C 7a_100000079963_100000210202 [0,1,0,0,0,0|3,0,0]=4 3502 B11R1.81 CCOc1ccc(nc1F)Cl 34a_100009880201_100000210202 [0,1,0,0,0,0|3,0,0]=4 3503 B11R1.81 CCOc1ccc(nc1F)Cl 7a_100009880201_100000210202 [0,1,0,0,0,0|3,0,0]=4 3504 B11R1.81 CCOc1ccc(nc1F)F 34a_100000101184_100000210202 [0,1,0,0,0,0|3,0,0]=4 3505 B11R1.81 CCOc1ccc(nc1F)F 7a_100000101184_100000210202 [0,1,0,0,0,0|3,0,0]=4 3506 B11R1.81 CCOc1ccc(nc1I)Br 34a_100010253912_100000210202 [0,1,0,0,0,0|3,0,0]=4 3507 B11R1.81 CCOc1ccc(nc1I)Br 7a_100010253912_100000210202 [0,1,0,0,0,0|3,0,0]=4 3508 B11R1.81 CCOc1ccc(nc1I)C 34a_100000023897_100000210202 [0,1,0,0,0,0|3,0,0]=4 3509 B11R1.81 CCOc1ccc(nc1I)C 7a_100000023897_100000210202 [0,1,0,0,0,0|3,0,0]=4 3510 B11R1.81 CCOc1ccc(nc1I)Cl 34a_100000696390_100000210202 [0,1,0,0,0,0|3,0,0]=4 3511 B11R1.81 CCOc1ccc(nc1I)Cl 7a_100000696390_100000210202 [0,1,0,0,0,0|3,0,0]=4 3512 B11R1.81 CCOc1ccc(nc1I)F 34a_100010382442_100000210202 [0,1,0,0,0,0|3,0,0]=4 3513 B11R1.81 CCOc1ccc(nc1I)F 7a_100010382442_100000210202 [0,1,0,0,0,0|3,0,0]=4 3514 B11R1.81 CCOc1ccc(nc1N)Br 34a_100000685527_100000210202 [0,1,0,0,0,0|3,0,0]=4 3515 B11R1.81 CCOc1ccc(nc1N)Br 7a_100000685527_100000210202 [0,1,0,0,0,0|3,0,0]=4 3516 B11R1.81 CCOc1ccc(nc1N)C 34a_100000694039_100000210202 [0,1,0,0,0,0|3,0,0]=4 3517 B11R1.81 CCOc1ccc(nc1N)C 7a_100000694039_100000210202 [0,1,0,0,0,0|3,0,0]=4 3518 B11R1.81 CCOc1ccc(nc1N)Cl 34a_100000717809_100000210202 [0,1,0,0,0,0|3,0,0]=4 3519 B11R1.81 CCOc1ccc(nc1N)Cl 7a_100000717809_100000210202 [0,1,0,0,0,0|3,0,0]=4 3520 B11R1.81 CCOc1cnc(cc1Br)C 34a_100009843476_100000210202 [0,1,0,0,0,0|3,0,0]=4 3521 B11R1.81 CCOc1cnc(cc1Br)C 7a_100009843476_100000210202 [0,1,0,0,0,0|3,0,0]=4 3522 B11R1.81 CCOc1cnc(cc1C)C 34a_200000068632_100000210202 [0,1,0,0,0,0|3,0,0]=4 3523 B11R1.81 CCOc1cnc(cc1C)C 7a_200000068632_100000210202 [0,1,0,0,0,0|3,0,0]=4 3524 B11R1.81 CCOc1cnc(cc1C)Cl 34a_100000692680_100000210202 [0,1,0,0,0,0|3,0,0]=4 3525 B11R1.81 CCOc1cnc(cc1C)Cl 7a_100000692680_100000210202 [0,1,0,0,0,0|3,0,0]=4 3526 B11R1.81 CCOc1cnc(cc1C)F 34a_100009856773_100000210202 [0,1,0,0,0,0|3,0,0]=4 3527 B11R1.81 CCOc1cnc(cc1C)F 7a_100009856773_100000210202 [0,1,0,0,0,0|3,0,0]=4 3528 B11R1.81 CCOc1cnc(cc1Cl)Cl 34a_100009868576_100000210202 [0,1,0,0,0,0|3,0,0]=4 3529 B11R1.81 CCOc1cnc(cc1Cl)Cl 7a_100009868576_100000210202 [0,1,0,0,0,0|3,0,0]=4 3530 B11R1.81 CCOc1cnc(cc1F)F 34a_100009885687_100000210202 [0,1,0,0,0,0|3,0,0]=4 3531 B11R1.81 CCOc1cnc(cc1F)F 7a_100009885687_100000210202 [0,1,0,0,0,0|3,0,0]=4 3532 B11R1.81 CCOc1cnc(cc1I)Cl 34a_100000698892_100000210202 [0,1,0,0,0,0|3,0,0]=4 3533 B11R1.81 CCOc1cnc(cc1I)Cl 7a_100000698892_100000210202 [0,1,0,0,0,0|3,0,0]=4 3534 B11R1.81 CCOc1cnc(cc1N)Br 34a_100009819941_100000210202 [0,1,0,0,0,0|3,0,0]=4 3535 B11R1.81 CCOc1cnc(cc1N)Br 7a_100009819941_100000210202 [0,1,0,0,0,0|3,0,0]=4 3536 B11R1.81 CCOc1coc(cc1=O)C 34a_100000081520_100000210202 [0,1,0,0,0,0|2,0,1]=4 3537 B11R1.81 CCOc1ncc(cc1Br)Br 34a_100000701035_100000210202 [0,1,0,0,0,0|3,0,0]=4 3538 B11R1.81 CCOc1ncc(cc1Br)C 34a_100000719714_100000210202 [0,1,0,0,0,0|3,0,0]=4 3539 B11R1.81 CCOc1ncc(cc1C)Br 34a_100000685391_100000210202 [0,1,0,0,0,0|3,0,0]=4 3540 B11R1.81 CCOc1ncc(cc1C)O 271570a_203496583355_100012351028 [0,1,0,0,0,0|3,0,0]=4 3541 B11R1.81 CCOc1ncc(cc1Cl)Br 34a_100012339560_100000210202 [0,1,0,0,0,0|3,0,0]=4 3542 B11R1.81 CCOc1ncc(cc1Cl)F 34a_100009847679_100000210202 [0,1,0,0,0,0|3,0,0]=4 3543 B11R1.81 CCOc1ncc(cc1F)Cl 34a_100011998252_100000210202 [0,1,0,0,0,0|3,0,0]=4 3544 B11R1.81 CCOc1ncc(cc1F)F 34a_100012025737_100000210202 [0,1,0,0,0,0|3,0,0]=4 3545 B11R1.81 CCOc1ncc(cc1N)Br 34a_100000743729_100000210202 [0,1,0,0,0,0|3,0,0]=4 3546 B11R1.81 CCOc1ncc(cc1N)C 34a_100012000488_100000210202 [0,1,0,0,0,0|3,0,0]=4 3547 B11R1.81 CCOc1ncc(cc1N)Cl 34a_100011998249_100000210202 [0,1,0,0,0,0|3,0,0]=4 3548 B11R1.81 CCOc1ncc(cc1N)O 271570a_203496583355_100011433076 [0,1,0,0,0,0|3,0,0]=4 3549 B11R1.81 CCOc1ncc(cc1O)Br 271570a_203496583355_200010177599 [0,1,0,0,0,0|2,0,0]=3 3550 B11R1.81 CCSc1c[nH]c(=O)cc1F 62a_100000210202_100015631685 [0,1,0,0,0,0|3,0,0]=4 3551 B11R1.81 CCSc1c[nH]c(=O)cc1F 62a_100015631685_100000210202 [0,1,0,0,0,0|3,0,0]=4 3552 B11R1.81 CCSc1cc[n+](cc1C)[O-] 62a_100000210202_100000074940 [0,1,0,0,0,0|3,0,0]=4 3553 B11R1.81 CCSc1ccc(=O)[nH]c1N 62a_100009884077_100000210202 [0,1,0,0,0,0|3,0,0]=4 3554 B11R1.81 CCSc1ccc(c[n+]1[O-])C 62a_100000210202_100009819918 [0,1,0,0,0,0|2,0,1]=4 3555 B11R1.81 CCSc1ccc(c[n+]1[O-])F 62a_100000210202_100009817261 [0,1,0,0,0,0|2,0,1]=4 3556 B11R1.81 CCSc1ccc(c[n+]1[O-])F 62a_100009817261_100000210202 [0,1,0,0,0,0|2,0,1]=4 3557 B11R1.81 CCSc1ccc(cc1Br)Br 62a_100000210202_100011484698 [0,1,0,0,0,0|2,0,0]=3 3558 B11R1.81 CCSc1ccc(cc1Br)Br 62a_100011484698_100000210202 [0,1,0,0,0,0|2,0,0]=3 3559 B11R1.81 CCSc1ccc(cc1Br)C 62a_100000210202_100009813563 [0,1,0,0,0,0|2,0,0]=3 3560 B11R1.81 CCSc1ccc(cc1Br)C 62a_100009813563_100000210202 [0,1,0,0,0,0|2,0,0]=3 3561 B11R1.81 CCSc1ccc(cc1Br)Cl 62a_100000210202_100011219703 [0,1,0,0,0,0|2,0,0]=3 3562 B11R1.81 CCSc1ccc(cc1Br)Cl 62a_100011219703_100000210202 [0,1,0,0,0,0|2,0,0]=3 3563 B11R1.81 CCSc1ccc(cc1Br)F 62a_100000210202_100011217111 [0,1,0,0,0,0|2,0,0]=3 3564 B11R1.81 CCSc1ccc(cc1Br)F 62a_100011217111_100000210202 [0,1,0,0,0,0|2,0,0]=3 3565 B11R1.81 CCSc1ccc(cc1Br)N 62a_100000210202_100000750458 [0,1,0,0,0,0|2,0,0]=3 3566 B11R1.81 CCSc1ccc(cc1Br)N 62a_100000750458_100000210202 [0,1,0,0,0,0|2,0,0]=3 3567 B11R1.81 CCSc1ccc(cc1Br)O 62a_100000210202_100000701344 [0,1,0,0,0,0|2,0,0]=3 3568 B11R1.81 CCSc1ccc(cc1Br)O 62a_100000701344_100000210202 [0,1,0,0,0,0|2,0,0]=3 3569 B11R1.81 CCSc1ccc(cc1C)Br 62a_100000210202_100000701812 [0,1,0,0,0,0|2,0,0]=3 3570 B11R1.81 CCSc1ccc(cc1C)Br 62a_100000701812_100000210202 [0,1,0,0,0,0|2,0,0]=3 3571 B11R1.81 CCSc1ccc(cc1C)C 62a_100000210202_100011217332 [0,1,0,0,0,0|2,0,0]=3 3572 B11R1.81 CCSc1ccc(cc1C)C 62a_100011217332_100000210202 [0,1,0,0,0,0|2,0,0]=3 3573 B11R1.81 CCSc1ccc(cc1C)Cl 62a_100000210202_100011219607 [0,1,0,0,0,0|2,0,0]=3 3574 B11R1.81 CCSc1ccc(cc1C)Cl 62a_100011219607_100000210202 [0,1,0,0,0,0|2,0,0]=3 3575 B11R1.81 CCSc1ccc(cc1C)F 62a_100000210202_100011205405 [0,1,0,0,0,0|2,0,0]=3 3576 B11R1.81 CCSc1ccc(cc1C)F 62a_100011205405_100000210202 [0,1,0,0,0,0|2,0,0]=3 3577 B11R1.81 CCSc1ccc(cc1C)N 62a_100000210202_100000210723 [0,1,0,0,0,0|2,0,0]=3 3578 B11R1.81 CCSc1ccc(cc1C)N 62a_100000210723_100000210202 [0,1,0,0,0,0|2,0,0]=3 3579 B11R1.81 CCSc1ccc(cc1C)O 62a_100000210202_100000690111 [0,1,0,0,0,0|2,0,0]=3 3580 B11R1.81 CCSc1ccc(cc1Cl)Br 62a_100000210202_100011216062 [0,1,0,0,0,0|2,0,0]=3 3581 B11R1.81 CCSc1ccc(cc1Cl)Br 62a_100011216062_100000210202 [0,1,0,0,0,0|2,0,0]=3 3582 B11R1.81 CCSc1ccc(cc1Cl)C 62a_100000210202_100011263221 [0,1,0,0,0,0|2,0,0]=3 3583 B11R1.81 CCSc1ccc(cc1Cl)C 62a_100011263221_100000210202 [0,1,0,0,0,0|2,0,0]=3 3584 B11R1.81 CCSc1ccc(cc1Cl)Cl 62a_100000210202_100000699841 [0,1,0,0,0,0|2,0,0]=3 3585 B11R1.81 CCSc1ccc(cc1Cl)Cl 62a_100000699841_100000210202 [0,1,0,0,0,0|2,0,0]=3 3586 B11R1.81 CCSc1ccc(cc1Cl)F 62a_100000210202_100000733362 [0,1,0,0,0,0|2,0,0]=3 3587 B11R1.81 CCSc1ccc(cc1Cl)F 62a_100000733362_100000210202 [0,1,0,0,0,0|2,0,0]=3 3588 B11R1.81 CCSc1ccc(cc1Cl)N 62a_100000210202_100000761885 [0,1,0,0,0,0|2,0,0]=3 3589 B11R1.81 CCSc1ccc(cc1Cl)N 62a_100000761885_100000210202 [0,1,0,0,0,0|2,0,0]=3 3590 B11R1.81 CCSc1ccc(cc1Cl)O 62a_100000047559_100000210202 [0,1,0,0,0,0|2,0,0]=3 3591 B11R1.81 CCSc1ccc(cc1Cl)O 62a_100000210202_100000047559 [0,1,0,0,0,0|2,0,0]=3 3592 B11R1.81 CCSc1ccc(cc1F)Br 62a_100000210202_100009814013 [0,1,0,0,0,0|2,0,0]=3 3593 B11R1.81 CCSc1ccc(cc1F)Br 62a_100009814013_100000210202 [0,1,0,0,0,0|2,0,0]=3 3594 B11R1.81 CCSc1ccc(cc1F)C 62a_100000210202_100011216119 [0,1,0,0,0,0|2,0,0]=3 3595 B11R1.81 CCSc1ccc(cc1F)C 62a_100011216119_100000210202 [0,1,0,0,0,0|2,0,0]=3 3596 B11R1.81 CCSc1ccc(cc1F)Cl 62a_100000210202_100011216042 [0,1,0,0,0,0|2,0,0]=3 3597 B11R1.81 CCSc1ccc(cc1F)Cl 62a_100011216042_100000210202 [0,1,0,0,0,0|2,0,0]=3 3598 B11R1.81 CCSc1ccc(cc1F)F 62a_100000210202_100000750030 [0,1,0,0,0,0|2,0,0]=3 3599 B11R1.81 CCSc1ccc(cc1F)F 62a_100000750030_100000210202 [0,1,0,0,0,0|2,0,0]=3 3600 B11R1.81 CCSc1ccc(cc1F)N 62a_100000210202_100011356925 [0,1,0,0,0,0|2,0,0]=3 3601 B11R1.81 CCSc1ccc(cc1F)N 62a_100011356925_100000210202 [0,1,0,0,0,0|2,0,0]=3 3602 B11R1.81 CCSc1ccc(cc1F)O 62a_100000210202_100000755031 [0,1,0,0,0,0|2,0,0]=3 3603 B11R1.81 CCSc1ccc(cc1F)O 62a_100000755031_100000210202 [0,1,0,0,0,0|2,0,0]=3 3604 B11R1.81 CCSc1ccc(cc1N)Br 62a_100000210202_100000743836 [0,1,0,0,0,0|2,0,0]=3 3605 B11R1.81 CCSc1ccc(cc1N)Br 62a_100000743836_100000210202 [0,1,0,0,0,0|2,0,0]=3 3606 B11R1.81 CCSc1ccc(cc1N)C 62a_100000210202_100011216686 [0,1,0,0,0,0|2,0,0]=3 3607 B11R1.81 CCSc1ccc(cc1N)C 62a_100011216686_100000210202 [0,1,0,0,0,0|2,0,0]=3 3608 B11R1.81 CCSc1ccc(cc1N)Cl 62a_100000210202_100000761886 [0,1,0,0,0,0|2,0,0]=3 3609 B11R1.81 CCSc1ccc(cc1N)Cl 62a_100000761886_100000210202 [0,1,0,0,0,0|2,0,0]=3 3610 B11R1.81 CCSc1ccc(cc1N)F 62a_100000210202_100000687223 [0,1,0,0,0,0|2,0,0]=3 3611 B11R1.81 CCSc1ccc(cc1N)F 62a_100000687223_100000210202 [0,1,0,0,0,0|2,0,0]=3 3612 B11R1.81 CCSc1ccc(cc1N)N 62a_100000210202_200012175722 [0,1,0,0,0,0|2,0,0]=3 3613 B11R1.81 CCSc1ccc(cc1N)N 62a_200012175722_100000210202 [0,1,0,0,0,0|2,0,0]=3 3614 B11R1.81 CCSc1ccc(cc1N)O 62a_100000210202_100011999798 [0,1,0,0,0,0|2,0,0]=3 3615 B11R1.81 CCSc1ccc(cc1N)O 62a_100011999798_100000210202 [0,1,0,0,0,0|2,0,0]=3 3616 B11R1.81 CCSc1ccc(cc1O)Br 62a_100000210202_100012344904 [0,1,0,0,0,0|1,0,0]=2 3617 B11R1.81 CCSc1ccc(cc1O)Br 62a_100012344904_100000210202 [0,1,0,0,0,0|1,0,0]=2 3618 B11R1.81 CCSc1ccc(cc1O)C 62a_100000210202_100012002257 [0,1,0,0,0,0|1,0,0]=2 3619 B11R1.81 CCSc1ccc(cc1O)C 62a_100012002257_100000210202 [0,1,0,0,0,0|1,0,0]=2 3620 B11R1.81 CCSc1ccc(cc1O)Cl 62a_100000050036_100000210202 [0,1,0,0,0,0|1,0,0]=2 3621 B11R1.81 CCSc1ccc(cc1O)Cl 62a_100000210202_100000050036 [0,1,0,0,0,0|1,0,0]=2 3622 B11R1.81 CCSc1ccc(cc1O)F 62a_100000210202_100000690578 [0,1,0,0,0,0|1,0,0]=2 3623 B11R1.81 CCSc1ccc(cc1O)F 62a_100000690578_100000210202 [0,1,0,0,0,0|1,0,0]=2 3624 B11R1.81 CCSc1ccc(cc1O)O 62a_100000210202_100009813921 [0,1,0,0,0,0|1,0,0]=2 3625 B11R1.81 CCSc1ccc(nc1Br)N 62a_100000210202_100010734177 [0,1,0,0,0,0|3,0,0]=4 3626 B11R1.81 CCSc1ccc(nc1Br)N 62a_100010734177_100000210202 [0,1,0,0,0,0|3,0,0]=4 3627 B11R1.81 CCSc1ccc(nc1C)C 62a_100000210202_100009813853 [0,1,0,0,0,0|3,0,0]=4 3628 B11R1.81 CCSc1ccc(nc1C)C 62a_100009813853_100000210202 [0,1,0,0,0,0|3,0,0]=4 3629 B11R1.81 CCSc1ccc(nc1C)Cl 62a_100000062408_100000210202 [0,1,0,0,0,0|3,0,0]=4 3630 B11R1.81 CCSc1ccc(nc1C)Cl 62a_100000210202_100000062408 [0,1,0,0,0,0|3,0,0]=4 3631 B11R1.81 CCSc1ccc(nc1C)F 62a_100000210202_100000688911 [0,1,0,0,0,0|3,0,0]=4 3632 B11R1.81 CCSc1ccc(nc1C)F 62a_100000688911_100000210202 [0,1,0,0,0,0|3,0,0]=4 3633 B11R1.81 CCSc1ccc(nc1C)N 62a_100000187202_100000210202 [0,1,0,0,0,0|3,0,0]=4 3634 B11R1.81 CCSc1ccc(nc1C)N 62a_100000210202_100000187202 [0,1,0,0,0,0|3,0,0]=4 3635 B11R1.81 CCSc1ccc(nc1C)O 62a_100000210202_100000691680 [0,1,0,0,0,0|3,0,0]=4 3636 B11R1.81 CCSc1ccc(nc1C)O 62a_100000691680_100000210202 [0,1,0,0,0,0|3,0,0]=4 3637 B11R1.81 CCSc1ccc(nc1Cl)Br 62a_100000210202_100010246183 [0,1,0,0,0,0|3,0,0]=4 3638 B11R1.81 CCSc1ccc(nc1Cl)Br 62a_100010246183_100000210202 [0,1,0,0,0,0|3,0,0]=4 3639 B11R1.81 CCSc1ccc(nc1Cl)Cl 62a_100000210202_100000043682 [0,1,0,0,0,0|3,0,0]=4 3640 B11R1.81 CCSc1ccc(nc1Cl)N 62a_100000210202_100010270343 [0,1,0,0,0,0|3,0,0]=4 3641 B11R1.81 CCSc1ccc(nc1Cl)N 62a_100010270343_100000210202 [0,1,0,0,0,0|3,0,0]=4 3642 B11R1.81 CCSc1ccc(nc1F)C 62a_100000210202_100010006597 [0,1,0,0,0,0|3,0,0]=4 3643 B11R1.81 CCSc1ccc(nc1F)C 62a_100010006597_100000210202 [0,1,0,0,0,0|3,0,0]=4 3644 B11R1.81 CCSc1ccc(nc1F)Cl 62a_100000210202_100010168078 [0,1,0,0,0,0|3,0,0]=4 3645 B11R1.81 CCSc1ccc(nc1F)Cl 62a_100010168078_100000210202 [0,1,0,0,0,0|3,0,0]=4 3646 B11R1.81 CCSc1ccc(nc1F)F 62a_100000070099_100000210202 [0,1,0,0,0,0|3,0,0]=4 3647 B11R1.81 CCSc1ccc(nc1F)F 62a_100000210202_100000070099 [0,1,0,0,0,0|3,0,0]=4 3648 B11R1.81 CCSc1ccc(nc1F)N 62a_100000210202_100009882772 [0,1,0,0,0,0|3,0,0]=4 3649 B11R1.81 CCSc1ccc(nc1F)N 62a_100009882772_100000210202 [0,1,0,0,0,0|3,0,0]=4 3650 B11R1.81 CCSc1ccc(nc1F)O 62a_100000210202_100009879308 [0,1,0,0,0,0|3,0,0]=4 3651 B11R1.81 CCSc1ccc(nc1F)O 62a_100009879308_100000210202 [0,1,0,0,0,0|3,0,0]=4 3652 B11R1.81 CCSc1ccc(nc1N)C 62a_100000210202_100009816662 [0,1,0,0,0,0|3,0,0]=4 3653 B11R1.81 CCSc1ccc(nc1N)C 62a_100009816662_100000210202 [0,1,0,0,0,0|3,0,0]=4 3654 B11R1.81 CCSc1ccc(nc1N)Cl 62a_100000210202_100010171640 [0,1,0,0,0,0|3,0,0]=4 3655 B11R1.81 CCSc1ccc(nc1N)Cl 62a_100010171640_100000210202 [0,1,0,0,0,0|3,0,0]=4 3656 B11R1.81 CCSc1ccc(nc1N)F 62a_100000210202_100009854977 [0,1,0,0,0,0|3,0,0]=4 3657 B11R1.81 CCSc1ccc(nc1N)F 62a_100009854977_100000210202 [0,1,0,0,0,0|3,0,0]=4 3658 B11R1.81 CCSc1ccc(nc1N)N 62a_100011356871_100000210202 [0,1,0,0,0,0|3,0,0]=4 3659 B11R1.81 CCSc1ccc(nc1O)C 62a_100000210202_100009817604 [0,1,0,0,0,0|2,0,0]=3 3660 B11R1.81 CCSc1ccc(nc1O)C 62a_100009817604_100000210202 [0,1,0,0,0,0|2,0,0]=3 3661 B11R1.81 CCSc1cnc(cc1Br)F 62a_100000210202_100015451857 [0,1,0,0,0,0|3,0,0]=4 3662 B11R1.81 CCSc1cnc(cc1Br)F 62a_100015451857_100000210202 [0,1,0,0,0,0|3,0,0]=4 3663 B11R1.81 CCSc1cnc(cc1Br)N 62a_100000210202_100010074611 [0,1,0,0,0,0|3,0,0]=4 3664 B11R1.81 CCSc1cnc(cc1Br)N 62a_100010074611_100000210202 [0,1,0,0,0,0|3,0,0]=4 3665 B11R1.81 CCSc1cnc(cc1C)Br 62a_100000210202_100009816104 [0,1,0,0,0,0|3,0,0]=4 3666 B11R1.81 CCSc1cnc(cc1C)Br 62a_100009816104_100000210202 [0,1,0,0,0,0|3,0,0]=4 3667 B11R1.81 CCSc1cnc(cc1C)C 62a_100000210202_100009819613 [0,1,0,0,0,0|3,0,0]=4 3668 B11R1.81 CCSc1cnc(cc1C)C 62a_100009819613_100000210202 [0,1,0,0,0,0|3,0,0]=4 3669 B11R1.81 CCSc1cnc(cc1C)Cl 62a_100000210202_100010172789 [0,1,0,0,0,0|3,0,0]=4 3670 B11R1.81 CCSc1cnc(cc1C)Cl 62a_100010172789_100000210202 [0,1,0,0,0,0|3,0,0]=4 3671 B11R1.81 CCSc1cnc(cc1C)F 62a_100000210202_100009820716 [0,1,0,0,0,0|3,0,0]=4 3672 B11R1.81 CCSc1cnc(cc1C)F 62a_100009820716_100000210202 [0,1,0,0,0,0|3,0,0]=4 3673 B11R1.81 CCSc1cnc(cc1C)N 62a_100000050067_100000210202 [0,1,0,0,0,0|3,0,0]=4 3674 B11R1.81 CCSc1cnc(cc1C)N 62a_100000210202_100000050067 [0,1,0,0,0,0|3,0,0]=4 3675 B11R1.81 CCSc1cnc(cc1C)O 62a_100000210202_100000766222 [0,1,0,0,0,0|3,0,0]=4 3676 B11R1.81 CCSc1cnc(cc1C)O 62a_100000766222_100000210202 [0,1,0,0,0,0|3,0,0]=4 3677 B11R1.81 CCSc1cnc(cc1Cl)Br 62a_100000210202_100010381092 [0,1,0,0,0,0|3,0,0]=4 3678 B11R1.81 CCSc1cnc(cc1Cl)Br 62a_100010381092_100000210202 [0,1,0,0,0,0|3,0,0]=4 3679 B11R1.81 CCSc1cnc(cc1Cl)Cl 62a_100000210202_100010200927 [0,1,0,0,0,0|3,0,0]=4 3680 B11R1.81 CCSc1cnc(cc1Cl)Cl 62a_100010200927_100000210202 [0,1,0,0,0,0|3,0,0]=4 3681 B11R1.81 CCSc1cnc(cc1Cl)N 62a_100000210202_100000694920 [0,1,0,0,0,0|3,0,0]=4 3682 B11R1.81 CCSc1cnc(cc1Cl)N 62a_100000694920_100000210202 [0,1,0,0,0,0|3,0,0]=4 3683 B11R1.81 CCSc1cnc(cc1F)Cl 62a_100000210202_100010128100 [0,1,0,0,0,0|3,0,0]=4 3684 B11R1.81 CCSc1cnc(cc1F)Cl 62a_100010128100_100000210202 [0,1,0,0,0,0|3,0,0]=4 3685 B11R1.81 CCSc1cnc(cc1F)N 62a_100000210202_100009844730 [0,1,0,0,0,0|3,0,0]=4 3686 B11R1.81 CCSc1cnc(cc1F)N 62a_100009844730_100000210202 [0,1,0,0,0,0|3,0,0]=4 3687 B11R1.81 CCSc1cnc(cc1N)C 62a_100000210202_100009817891 [0,1,0,0,0,0|3,0,0]=4 3688 B11R1.81 CCSc1cnc(cc1N)C 62a_100009817891_100000210202 [0,1,0,0,0,0|3,0,0]=4 3689 B11R1.81 CCSc1cnc(cc1N)Cl 62a_100000210202_100010209552 [0,1,0,0,0,0|3,0,0]=4 3690 B11R1.81 CCSc1cnc(cc1N)Cl 62a_100010209552_100000210202 [0,1,0,0,0,0|3,0,0]=4 3691 B11R1.81 CCSc1cnc(cc1N)N 62a_100000210202_200009857908 [0,1,0,0,0,0|3,0,0]=4 3692 B11R1.81 CCSc1cnc(cc1N)N 62a_200009857908_100000210202 [0,1,0,0,0,0|3,0,0]=4 3693 B11R1.81 CCSc1cnc(cc1O)C 62a_100000210202_100011016184 [0,1,0,0,0,0|2,0,0]=3 3694 B11R1.81 CCSc1cnc(cc1O)C 62a_100011016184_100000210202 [0,1,0,0,0,0|2,0,0]=3 3695 B11R1.81 CCSc1ncc(cc1Br)Cl 62a_100000210202_100012154958 [0,1,0,0,0,0|3,0,0]=4 3696 B11R1.81 CCSc1ncc(cc1Br)Cl 62a_100012154958_100000210202 [0,1,0,0,0,0|3,0,0]=4 3697 B11R1.81 CCSc1ncc(cc1C)Br 62a_100000210202_100012353652 [0,1,0,0,0,0|3,0,0]=4 3698 B11R1.81 CCSc1ncc(cc1C)Br 62a_100012353652_100000210202 [0,1,0,0,0,0|3,0,0]=4 3699 B11R1.81 CCSc1ncc(cc1C)C 62a_100000210202_100009864548 [0,1,0,0,0,0|3,0,0]=4 3700 B11R1.81 CCSc1ncc(cc1C)C 62a_100009864548_100000210202 [0,1,0,0,0,0|3,0,0]=4 3701 B11R1.81 CCSc1ncc(cc1C)F 62a_100000210202_100009817009 [0,1,0,0,0,0|3,0,0]=4 3702 B11R1.81 CCSc1ncc(cc1C)F 62a_100009817009_100000210202 [0,1,0,0,0,0|3,0,0]=4 3703 B11R1.81 CCSc1ncc(cc1C)N 62a_100000210202_100000761747 [0,1,0,0,0,0|3,0,0]=4 3704 B11R1.81 CCSc1ncc(cc1C)N 62a_100000761747_100000210202 [0,1,0,0,0,0|3,0,0]=4 3705 B11R1.81 CCSc1ncc(cc1C)O 62a_100000210202_100012000486 [0,1,0,0,0,0|3,0,0]=4 3706 B11R1.81 CCSc1ncc(cc1C)O 62a_100012000486_100000210202 [0,1,0,0,0,0|3,0,0]=4 3707 B11R1.81 CCSc1ncc(cc1F)Br 62a_100000210202_100012348576 [0,1,0,0,0,0|3,0,0]=4 3708 B11R1.81 CCSc1ncc(cc1F)Br 62a_100012348576_100000210202 [0,1,0,0,0,0|3,0,0]=4 3709 B11R1.81 CCSc1ncc(cc1F)C 62a_100000210202_100009819633 [0,1,0,0,0,0|3,0,0]=4 3710 B11R1.81 CCSc1ncc(cc1F)C 62a_100009819633_100000210202 [0,1,0,0,0,0|3,0,0]=4 3711 B11R1.81 CCSc1ncc(cc1F)Cl 62a_100000210202_100012348686 [0,1,0,0,0,0|3,0,0]=4 3712 B11R1.81 CCSc1ncc(cc1F)Cl 62a_100012348686_100000210202 [0,1,0,0,0,0|3,0,0]=4 3713 B11R1.81 CCSc1ncc(cc1F)F 62a_100000210202_100011219543 [0,1,0,0,0,0|3,0,0]=4 3714 B11R1.81 CCSc1ncc(cc1F)F 62a_100011219543_100000210202 [0,1,0,0,0,0|3,0,0]=4 3715 B11R1.81 CCSc1ncc(cc1F)N 62a_100000210202_100010280766 [0,1,0,0,0,0|3,0,0]=4 3716 B11R1.81 CCSc1ncc(cc1F)N 62a_100010280766_100000210202 [0,1,0,0,0,0|3,0,0]=4 3717 B11R1.81 CCSc1ncc(cc1F)O 62a_100000210202_100000063512 [0,1,0,0,0,0|3,0,0]=4 3718 B11R1.81 CCSc1ncc(cc1N)Br 62a_100000210202_100010090555 [0,1,0,0,0,0|3,0,0]=4 3719 B11R1.81 CCSc1ncc(cc1N)Br 62a_100010090555_100000210202 [0,1,0,0,0,0|3,0,0]=4 3720 B11R1.81 CCSc1ncc(cc1N)C 62a_100000210202_100000733613 [0,1,0,0,0,0|3,0,0]=4 3721 B11R1.81 CCSc1ncc(cc1N)C 62a_100000733613_100000210202 [0,1,0,0,0,0|3,0,0]=4 3722 B11R1.81 CCSc1ncc(cc1N)F 62a_100000210202_100009817643 [0,1,0,0,0,0|3,0,0]=4 3723 B11R1.81 CCSc1ncc(cc1N)F 62a_100009817643_100000210202 [0,1,0,0,0,0|3,0,0]=4 3724 B11R1.81 CCSc1ncc(cc1N)N 62a_100000210202_200000093520 [0,1,0,0,0,0|3,0,0]=4 3725 B11R1.81 CCSc1ncc(cc1N)N 62a_200000093520_100000210202 [0,1,0,0,0,0|3,0,0]=4 3726 B11R1.81 CCSc1ncc(cc1O)Br 62a_100000210202_100010210634 [0,1,0,0,0,0|2,0,0]=3 3727 B11R1.81 CCSc1ncc(cc1O)Br 62a_100010210634_100000210202 [0,1,0,0,0,0|2,0,0]=3 3728 B11R1.81 CCSc1ncc(cc1O)C 62a_100000210202_100012000487 [0,1,0,0,0,0|2,0,0]=3 3729 B11R1.81 CCSc1ncc(cc1O)Cl 62a_100000210202_100010233512 [0,1,0,0,0,0|2,0,0]=3 3730 B11R1.81 CCSc1ncc(cc1O)Cl 62a_100010233512_100000210202 [0,1,0,0,0,0|2,0,0]=3 3731 B11R1.81 CCSc1ncc(cc1O)F 62a_100000210202_100000079967 [0,1,0,0,0,0|2,0,0]=3 3732 B11R1.81 CCSc1ncc(cc1O)F 62a_100009820119_100000210202 [0,1,0,0,0,0|2,0,0]=3 3733 B11R1.81 CNCc1ccc(cc1Br)Br 207a_100102657272_100012351556 [0,1,0,0,0,0|2,0,0]=3 3734 B11R1.81 CNCc1ccc(cc1Br)Br 2230a_106832991635_200012351560 [0,1,0,0,0,0|2,0,0]=3 3735 B11R1.81 CNCc1ccc(cc1Br)Br 26a_100102657272_100000188717 [0,1,0,0,0,0|2,0,0]=3 3736 B11R1.81 CNCc1ccc(cc1Br)Br 270004a_106832991635_100012351556 [0,1,0,0,0,0|2,0,0]=3 3737 B11R1.81 CNCc1ccc(cc1Br)Br 34a_100102657272_200012351560 [0,1,0,0,0,0|2,0,0]=3 3738 B11R1.81 CNCc1ccc(cc1Br)Br 7a_106832991635_200012351560 [0,1,0,0,0,0|2,0,0]=3 3739 B11R1.81 CNCc1ccc(cc1Br)C 207a_100102657272_100000692596 [0,1,0,0,0,0|2,0,0]=3 3740 B11R1.81 CNCc1ccc(cc1Br)C 26a_100102657272_100000210800 [0,1,0,0,0,0|2,0,0]=3 3741 B11R1.81 CNCc1ccc(cc1Br)C 270004a_106832991635_100000692596 [0,1,0,0,0,0|2,0,0]=3 3742 B11R1.81 CNCc1ccc(cc1Br)Cl 207a_100102657272_100000687667 [0,1,0,0,0,0|2,0,0]=3 3743 B11R1.81 CNCc1ccc(cc1Br)Cl 2230a_106832991635_100000755608 [0,1,0,0,0,0|2,0,0]=3 3744 B11R1.81 CNCc1ccc(cc1Br)Cl 26a_100102657272_100000211998 [0,1,0,0,0,0|2,0,0]=3 3745 B11R1.81 CNCc1ccc(cc1Br)Cl 270004a_106832991635_100000687667 [0,1,0,0,0,0|2,0,0]=3 3746 B11R1.81 CNCc1ccc(cc1Br)Cl 34a_100102657272_100000755608 [0,1,0,0,0,0|2,0,0]=3 3747 B11R1.81 CNCc1ccc(cc1Br)Cl 34a_100102692131_200000210301 [0,1,0,0,0,0|2,0,0]=3 3748 B11R1.81 CNCc1ccc(cc1Br)Cl 7a_106832991635_100000755608 [0,1,0,0,0,0|2,0,0]=3 3749 B11R1.81 CNCc1ccc(cc1Br)F 207a_100102657272_100000685661 [0,1,0,0,0,0|2,0,0]=3 3750 B11R1.81 CNCc1ccc(cc1Br)F 2230a_106832991635_100000243222 [0,1,0,0,0,0|2,0,0]=3 3751 B11R1.81 CNCc1ccc(cc1Br)F 26a_100102657272_100000211999 [0,1,0,0,0,0|2,0,0]=3 3752 B11R1.81 CNCc1ccc(cc1Br)F 270004a_106832991635_100000685661 [0,1,0,0,0,0|2,0,0]=3 3753 B11R1.81 CNCc1ccc(cc1Br)F 34a_100000708791_200000210301 [0,1,0,0,0,0|2,0,0]=3 3754 B11R1.81 CNCc1ccc(cc1Br)F 34a_100102657272_100000243222 [0,1,0,0,0,0|2,0,0]=3 3755 B11R1.81 CNCc1ccc(cc1Br)F 7a_106832991635_100000243222 [0,1,0,0,0,0|2,0,0]=3 3756 B11R1.81 CNCc1ccc(cc1Br)I 207a_100102657272_100010185650 [0,1,0,0,0,0|2,0,0]=3 3757 B11R1.81 CNCc1ccc(cc1Br)I 2230a_106832991635_100010146610 [0,1,0,0,0,0|2,0,0]=3 3758 B11R1.81 CNCc1ccc(cc1Br)I 26a_100102657272_100012361655 [0,1,0,0,0,0|2,0,0]=3 3759 B11R1.81 CNCc1ccc(cc1Br)I 34a_100102657272_100010146610 [0,1,0,0,0,0|2,0,0]=3 3760 B11R1.81 CNCc1ccc(cc1Br)I 7a_106832991635_100010146610 [0,1,0,0,0,0|2,0,0]=3 3761 B11R1.81 CNCc1ccc(cc1C)Br 207a_100102657272_100000687586 [0,1,0,0,0,0|2,0,0]=3 3762 B11R1.81 CNCc1ccc(cc1C)Br 2230a_106832991635_100000708836 [0,1,0,0,0,0|2,0,0]=3 3763 B11R1.81 CNCc1ccc(cc1C)Br 26a_100102657272_100000186361 [0,1,0,0,0,0|2,0,0]=3 3764 B11R1.81 CNCc1ccc(cc1C)Br 270004a_106832991635_100000687586 [0,1,0,0,0,0|2,0,0]=3 3765 B11R1.81 CNCc1ccc(cc1C)Br 34a_100000753881_200000210301 [0,1,0,0,0,0|2,0,0]=3 3766 B11R1.81 CNCc1ccc(cc1C)Br 34a_100102657272_100000708836 [0,1,0,0,0,0|2,0,0]=3 3767 B11R1.81 CNCc1ccc(cc1C)Br 7a_106832991635_100000708836 [0,1,0,0,0,0|2,0,0]=3 3768 B11R1.81 CNCc1ccc(cc1C)C 207a_100102657272_100000211342 [0,1,0,0,0,0|2,0,0]=3 3769 B11R1.81 CNCc1ccc(cc1C)C 2230a_106832991635_100011219618 [0,1,0,0,0,0|2,0,0]=3 3770 B11R1.81 CNCc1ccc(cc1C)C 270004a_106832991635_100000211342 [0,1,0,0,0,0|2,0,0]=3 3771 B11R1.81 CNCc1ccc(cc1C)C 34a_100000737523_200000210301 [0,1,0,0,0,0|2,0,0]=3 3772 B11R1.81 CNCc1ccc(cc1C)C 34a_100102657272_100011219618 [0,1,0,0,0,0|2,0,0]=3 3773 B11R1.81 CNCc1ccc(cc1C)C 7a_106832991635_100011219618 [0,1,0,0,0,0|2,0,0]=3 3774 B11R1.81 CNCc1ccc(cc1C)Cl 207a_100102657272_100000766358 [0,1,0,0,0,0|2,0,0]=3 3775 B11R1.81 CNCc1ccc(cc1C)Cl 2230a_106832991635_100012361307 [0,1,0,0,0,0|2,0,0]=3 3776 B11R1.81 CNCc1ccc(cc1C)Cl 270004a_106832991635_100000766358 [0,1,0,0,0,0|2,0,0]=3 3777 B11R1.81 CNCc1ccc(cc1C)Cl 34a_100102657272_100012361307 [0,1,0,0,0,0|2,0,0]=3 3778 B11R1.81 CNCc1ccc(cc1C)Cl 34a_103436540063_200000210301 [0,1,0,0,0,0|2,0,0]=3 3779 B11R1.81 CNCc1ccc(cc1C)Cl 7a_106832991635_100012361307 [0,1,0,0,0,0|2,0,0]=3 3780 B11R1.81 CNCc1ccc(cc1C)F 207a_100102657272_100000745986 [0,1,0,0,0,0|2,0,0]=3 3781 B11R1.81 CNCc1ccc(cc1C)F 2230a_106832991635_100000700533 [0,1,0,0,0,0|2,0,0]=3 3782 B11R1.81 CNCc1ccc(cc1C)F 270004a_106832991635_100000745986 [0,1,0,0,0,0|2,0,0]=3 3783 B11R1.81 CNCc1ccc(cc1C)F 34a_100102657272_100000700533 [0,1,0,0,0,0|2,0,0]=3 3784 B11R1.81 CNCc1ccc(cc1C)F 34a_100137329023_200000210301 [0,1,0,0,0,0|2,0,0]=3 3785 B11R1.81 CNCc1ccc(cc1C)F 7a_106832991635_100000700533 [0,1,0,0,0,0|2,0,0]=3 3786 B11R1.81 CNCc1ccc(cc1Cl)Br 207a_100102657272_100000764164 [0,1,0,0,0,0|2,0,0]=3 3787 B11R1.81 CNCc1ccc(cc1Cl)Br 2230a_106832991635_100011740631 [0,1,0,0,0,0|2,0,0]=3 3788 B11R1.81 CNCc1ccc(cc1Cl)Br 26a_100102657272_100000186472 [0,1,0,0,0,0|2,0,0]=3 3789 B11R1.81 CNCc1ccc(cc1Cl)Br 270004a_106832991635_100000764164 [0,1,0,0,0,0|2,0,0]=3 3790 B11R1.81 CNCc1ccc(cc1Cl)Br 34a_100020628970_200000210301 [0,1,0,0,0,0|2,0,0]=3 3791 B11R1.81 CNCc1ccc(cc1Cl)Br 34a_100102657272_100011740631 [0,1,0,0,0,0|2,0,0]=3 3792 B11R1.81 CNCc1ccc(cc1Cl)Br 7a_106832991635_100011740631 [0,1,0,0,0,0|2,0,0]=3 3793 B11R1.81 CNCc1ccc(cc1Cl)C 207a_100102657272_100011935181 [0,1,0,0,0,0|2,0,0]=3 3794 B11R1.81 CNCc1ccc(cc1Cl)C 2230a_106832991635_100012349684 [0,1,0,0,0,0|2,0,0]=3 3795 B11R1.81 CNCc1ccc(cc1Cl)C 26a_100102657272_100000749699 [0,1,0,0,0,0|2,0,0]=3 3796 B11R1.81 CNCc1ccc(cc1Cl)C 270004a_106832991635_100011935181 [0,1,0,0,0,0|2,0,0]=3 3797 B11R1.81 CNCc1ccc(cc1Cl)C 34a_100011997539_200000210301 [0,1,0,0,0,0|2,0,0]=3 3798 B11R1.81 CNCc1ccc(cc1Cl)C 34a_100102657272_100012349684 [0,1,0,0,0,0|2,0,0]=3 3799 B11R1.81 CNCc1ccc(cc1Cl)C 7a_106832991635_100012349684 [0,1,0,0,0,0|2,0,0]=3 3800 B11R1.81 CNCc1ccc(cc1Cl)Cl 207a_100102657272_100000188887 [0,1,0,0,0,0|2,0,0]=3 3801 B11R1.81 CNCc1ccc(cc1Cl)Cl 2230a_106832991635_100000188473 [0,1,0,0,0,0|2,0,0]=3 3802 B11R1.81 CNCc1ccc(cc1Cl)Cl 26a_100102657272_100015191787 [0,1,0,0,0,0|2,0,0]=3 3803 B11R1.81 CNCc1ccc(cc1Cl)Cl 270004a_106832991635_100000188887 [0,1,0,0,0,0|2,0,0]=3 3804 B11R1.81 CNCc1ccc(cc1Cl)Cl 34a_100000174880_200000210301 [0,1,0,0,0,0|2,0,0]=3 3805 B11R1.81 CNCc1ccc(cc1Cl)Cl 34a_100102657272_100000188473 [0,1,0,0,0,0|2,0,0]=3 3806 B11R1.81 CNCc1ccc(cc1Cl)Cl 7a_106832991635_100000188473 [0,1,0,0,0,0|2,0,0]=3 3807 B11R1.81 CNCc1ccc(cc1Cl)F 207a_100102657272_100000752949 [0,1,0,0,0,0|2,0,0]=3 3808 B11R1.81 CNCc1ccc(cc1Cl)F 2230a_106832991635_100011216360 [0,1,0,0,0,0|2,0,0]=3 3809 B11R1.81 CNCc1ccc(cc1Cl)F 26a_100102657272_100000212004 [0,1,0,0,0,0|2,0,0]=3 3810 B11R1.81 CNCc1ccc(cc1Cl)F 270004a_106832991635_100000752949 [0,1,0,0,0,0|2,0,0]=3 3811 B11R1.81 CNCc1ccc(cc1Cl)F 34a_100000174946_200000210301 [0,1,0,0,0,0|2,0,0]=3 3812 B11R1.81 CNCc1ccc(cc1Cl)F 34a_100102657272_100011216360 [0,1,0,0,0,0|2,0,0]=3 3813 B11R1.81 CNCc1ccc(cc1Cl)F 7a_106832991635_100011216360 [0,1,0,0,0,0|2,0,0]=3 3814 B11R1.81 CNCc1ccc(cc1Cl)I 207a_100102657272_100000727542 [0,1,0,0,0,0|2,0,0]=3 3815 B11R1.81 CNCc1ccc(cc1Cl)O 34a_200161156549_200000210301 [0,1,0,0,0,0|2,0,0]=3 3816 B11R1.81 CNCc1ccc(cc1F)Br 207a_100102657272_100000211676 [0,1,0,0,0,0|2,0,0]=3 3817 B11R1.81 CNCc1ccc(cc1F)Br 2230a_106832991635_100000211606 [0,1,0,0,0,0|2,0,0]=3 3818 B11R1.81 CNCc1ccc(cc1F)Br 26a_100102657272_100000185481 [0,1,0,0,0,0|2,0,0]=3 3819 B11R1.81 CNCc1ccc(cc1F)Br 270004a_106832991635_100000211676 [0,1,0,0,0,0|2,0,0]=3 3820 B11R1.81 CNCc1ccc(cc1F)Br 34a_100000754580_200000210301 [0,1,0,0,0,0|2,0,0]=3 3821 B11R1.81 CNCc1ccc(cc1F)Br 34a_100102657272_100000211606 [0,1,0,0,0,0|2,0,0]=3 3822 B11R1.81 CNCc1ccc(cc1F)Br 7a_106832991635_100000211606 [0,1,0,0,0,0|2,0,0]=3 3823 B11R1.81 CNCc1ccc(cc1F)C 207a_100102657272_100011217368 [0,1,0,0,0,0|2,0,0]=3 3824 B11R1.81 CNCc1ccc(cc1F)C 2230a_106832991635_100011217900 [0,1,0,0,0,0|2,0,0]=3 3825 B11R1.81 CNCc1ccc(cc1F)C 270004a_106832991635_100011217368 [0,1,0,0,0,0|2,0,0]=3 3826 B11R1.81 CNCc1ccc(cc1F)C 34a_100102657272_100012002367 [0,1,0,0,0,0|2,0,0]=3 3827 B11R1.81 CNCc1ccc(cc1F)C 34a_100102887089_200000210301 [0,1,0,0,0,0|2,0,0]=3 3828 B11R1.81 CNCc1ccc(cc1F)C 7a_106832991635_100012002367 [0,1,0,0,0,0|2,0,0]=3 3829 B11R1.81 CNCc1ccc(cc1F)Cl 207a_100102657272_100000697372 [0,1,0,0,0,0|2,0,0]=3 3830 B11R1.81 CNCc1ccc(cc1F)Cl 2230a_106832991635_100000709361 [0,1,0,0,0,0|2,0,0]=3 3831 B11R1.81 CNCc1ccc(cc1F)Cl 270004a_106832991635_100000697372 [0,1,0,0,0,0|2,0,0]=3 3832 B11R1.81 CNCc1ccc(cc1F)Cl 34a_100000708496_200000210301 [0,1,0,0,0,0|2,0,0]=3 3833 B11R1.81 CNCc1ccc(cc1F)Cl 34a_100102657272_100000709361 [0,1,0,0,0,0|2,0,0]=3 3834 B11R1.81 CNCc1ccc(cc1F)Cl 7a_106832991635_100000709361 [0,1,0,0,0,0|2,0,0]=3 3835 B11R1.81 CNCc1ccc(cc1F)F 207a_100102657272_100000211964 [0,1,0,0,0,0|2,0,0]=3 3836 B11R1.81 CNCc1ccc(cc1F)F 2230a_106832991635_100000748237 [0,1,0,0,0,0|2,0,0]=3 3837 B11R1.81 CNCc1ccc(cc1F)F 270004a_106832991635_100000211964 [0,1,0,0,0,0|2,0,0]=3 3838 B11R1.81 CNCc1ccc(cc1F)F 34a_100000737868_200000210301 [0,1,0,0,0,0|2,0,0]=3 3839 B11R1.81 CNCc1ccc(cc1F)F 34a_100102657272_100000748237 [0,1,0,0,0,0|2,0,0]=3 3840 B11R1.81 CNCc1ccc(cc1F)F 7a_106832991635_100000748237 [0,1,0,0,0,0|2,0,0]=3 3841 B11R1.81 CNCc1ccc(cc1F)I 207a_100102657272_100000050965 [0,1,0,0,0,0|2,0,0]=3 3842 B11R1.81 CNCc1ccc(cc1F)I 2230a_106832991635_100010244991 [0,1,0,0,0,0|2,0,0]=3 3843 B11R1.81 CNCc1ccc(cc1F)I 34a_100102657272_100010244991 [0,1,0,0,0,0|2,0,0]=3 3844 B11R1.81 CNCc1ccc(cc1F)I 7a_106832991635_100010244991 [0,1,0,0,0,0|2,0,0]=3 3845 B11R1.81 CNCc1ccc(cc1I)Br 207a_100102657272_100010146562 [0,1,0,0,0,0|2,0,0]=3 3846 B11R1.81 CNCc1ccc(cc1I)Br 2230a_106832991635_100010146615 [0,1,0,0,0,0|2,0,0]=3 3847 B11R1.81 CNCc1ccc(cc1I)Br 26a_100102657272_100012355227 [0,1,0,0,0,0|2,0,0]=3 3848 B11R1.81 CNCc1ccc(cc1I)Br 270004a_106832991635_100010146562 [0,1,0,0,0,0|2,0,0]=3 3849 B11R1.81 CNCc1ccc(cc1I)Br 34a_100102657272_100010146615 [0,1,0,0,0,0|2,0,0]=3 3850 B11R1.81 CNCc1ccc(cc1I)Br 7a_106832991635_100010146615 [0,1,0,0,0,0|2,0,0]=3 3851 B11R1.81 CNCc1ccc(cc1I)C 207a_100102657272_100010150104 [0,1,0,0,0,0|2,0,0]=3 3852 B11R1.81 CNCc1ccc(cc1I)C 270004a_106832991635_100010150104 [0,1,0,0,0,0|2,0,0]=3 3853 B11R1.81 CNCc1ccc(cc1I)Cl 2230a_106832991635_100010254388 [0,1,0,0,0,0|2,0,0]=3 3854 B11R1.81 CNCc1ccc(cc1I)Cl 34a_100102657272_100010254388 [0,1,0,0,0,0|2,0,0]=3 3855 B11R1.81 CNCc1ccc(cc1I)Cl 7a_106832991635_100010254388 [0,1,0,0,0,0|2,0,0]=3 3856 B11R1.81 CNCc1ccc(cc1I)F 207a_100102657272_100010254405 [0,1,0,0,0,0|2,0,0]=3 3857 B11R1.81 CNCc1ccc(cc1I)F 2230a_106832991635_100012354799 [0,1,0,0,0,0|2,0,0]=3 3858 B11R1.81 CNCc1ccc(cc1I)F 34a_100102657272_100012354799 [0,1,0,0,0,0|2,0,0]=3 3859 B11R1.81 CNCc1ccc(cc1I)F 7a_106832991635_100012354799 [0,1,0,0,0,0|2,0,0]=3 3860 B11R1.81 CNCc1ccc(cc1O)F 271570a_203496583355_200011192132 [0,1,0,0,0,0|1,0,0]=2 3861 B11R1.81 CNCc1ccc(nc1Br)C 2230a_106832991635_200010064658 [0,1,0,0,0,0|3,0,0]=4 3862 B11R1.81 CNCc1ccc(nc1Br)C 34a_100102657272_200010064658 [0,1,0,0,0,0|3,0,0]=4 3863 B11R1.81 CNCc1ccc(nc1Br)C 7a_106832991635_200010064658 [0,1,0,0,0,0|3,0,0]=4 3864 B11R1.81 CNCc1ccc(nc1C)C 207a_100102657272_100011794427 [0,1,0,0,0,0|3,0,0]=4 3865 B11R1.81 CNCc1ccc(nc1C)C 270004a_106832991635_100011794427 [0,1,0,0,0,0|3,0,0]=4 3866 B11R1.81 CNCc1ccc(nc1Cl)Cl 2230a_106832991635_100000722033 [0,1,0,0,0,0|3,0,0]=4 3867 B11R1.81 CNCc1ccc(nc1Cl)Cl 34a_100102657272_100000722033 [0,1,0,0,0,0|3,0,0]=4 3868 B11R1.81 CNCc1ccc(nc1Cl)Cl 7a_106832991635_100000722033 [0,1,0,0,0,0|3,0,0]=4 3869 B11R1.81 CNCc1cnc(cc1Br)Cl 270004a_106832991635_100009892795 [0,1,0,0,0,0|3,0,0]=4 3870 B11R1.81 CNCc1cnc(cc1C)C 207a_100102657272_200009869383 [0,1,0,0,0,0|3,0,0]=4 3871 B11R1.81 CNCc1cnc(cc1C)C 270004a_106832991635_200009869383 [0,1,0,0,0,0|3,0,0]=4 3872 B11R1.81 CNCc1cnc(cc1C)F 2230a_106832991635_100010382440 [0,1,0,0,0,0|3,0,0]=4 3873 B11R1.81 CNCc1cnc(cc1C)F 34a_100102657272_100010382440 [0,1,0,0,0,0|3,0,0]=4 3874 B11R1.81 CNCc1cnc(cc1C)F 7a_106832991635_100010382440 [0,1,0,0,0,0|3,0,0]=4 3875 B11R1.81 CNCc1cnc(cc1Cl)Cl 2230a_106832991635_100011997056 [0,1,0,0,0,0|3,0,0]=4 3876 B11R1.81 CNCc1cnc(cc1Cl)Cl 34a_100102657272_100011997056 [0,1,0,0,0,0|3,0,0]=4 3877 B11R1.81 CNCc1cnc(cc1Cl)Cl 7a_106832991635_100011997056 [0,1,0,0,0,0|3,0,0]=4 3878 B11R1.81 CNCc1ncc(cc1Br)Br 207a_100102657272_100000688198 [0,1,0,0,0,0|3,0,0]=4 3879 B11R1.81 CNCc1ncc(cc1Br)Br 270004a_106832991635_100000688198 [0,1,0,0,0,0|3,0,0]=4 3880 B11R1.81 CNCc1ncc(cc1Br)Cl 207a_100102657272_100010064872 [0,1,0,0,0,0|3,0,0]=4 3881 B11R1.81 CNCc1ncc(cc1Br)Cl 270004a_106832991635_100010064872 [0,1,0,0,0,0|3,0,0]=4 3882 B11R1.81 CNCc1ncc(cc1C)Br 207a_100102657272_100010185443 [0,1,0,0,0,0|3,0,0]=4 3883 B11R1.81 CNCc1ncc(cc1C)Br 270004a_106832991635_100010185443 [0,1,0,0,0,0|3,0,0]=4 3884 B11R1.81 CNCc1ncc(cc1C)C 2230a_106832991635_100016990036 [0,1,0,0,0,0|3,0,0]=4 3885 B11R1.81 CNCc1ncc(cc1C)C 34a_100102657272_100016990036 [0,1,0,0,0,0|3,0,0]=4 3886 B11R1.81 CNCc1ncc(cc1C)C 7a_106832991635_100016990036 [0,1,0,0,0,0|3,0,0]=4 3887 B11R1.81 CNCc1ncc(cc1C)Cl 207a_100102657272_200009887756 [0,1,0,0,0,0|3,0,0]=4 3888 B11R1.81 CNCc1ncc(cc1C)Cl 270004a_106832991635_200009887756 [0,1,0,0,0,0|3,0,0]=4 3889 B11R1.81 CNCc1ncc(cc1Cl)Br 207a_100102657272_100009814801 [0,1,0,0,0,0|3,0,0]=4 3890 B11R1.81 CNCc1ncc(cc1Cl)Br 270004a_106832991635_100009814801 [0,1,0,0,0,0|3,0,0]=4 3891 B11R1.81 CNCc1ncc(cc1Cl)Br 34a_100025703182_200000210301 [0,1,0,0,0,0|3,0,0]=4 3892 B11R1.81 CNCc1ncc(cc1Cl)Cl 207a_100102657272_100011361609 [0,1,0,0,0,0|3,0,0]=4 3893 B11R1.81 CNCc1ncc(cc1Cl)Cl 270004a_106832991635_100011361609 [0,1,0,0,0,0|3,0,0]=4 3894 B11R1.81 CNCc1ncc(cc1Cl)F 34a_100020639648_200000210301 [0,1,0,0,0,0|3,0,0]=4 3895 B11R1.81 CNCc1ncc(cc1F)Br 207a_100102657272_100010180630 [0,1,0,0,0,0|3,0,0]=4 3896 B11R1.81 CNCc1ncc(cc1F)Br 270004a_106832991635_100010180630 [0,1,0,0,0,0|3,0,0]=4 3897 B11R1.81 CNCc1ncc(cc1F)Br 34a_100015188786_200000210301 [0,1,0,0,0,0|3,0,0]=4 3898 B11R1.81 CNCc1ncc(cc1F)C 207a_100102657272_100009845184 [0,1,0,0,0,0|3,0,0]=4 3899 B11R1.81 CNCc1ncc(cc1F)C 270004a_106832991635_100009845184 [0,1,0,0,0,0|3,0,0]=4 3900 B11R1.81 CNCc1ncc(cc1F)Cl 207a_100102657272_100009858488 [0,1,0,0,0,0|3,0,0]=4 3901 B11R1.81 CNCc1ncc(cc1F)Cl 2230a_106832991635_200009879301 [0,1,0,0,0,0|3,0,0]=4 3902 B11R1.81 CNCc1ncc(cc1F)Cl 270004a_106832991635_100009858488 [0,1,0,0,0,0|3,0,0]=4 3903 B11R1.81 CNCc1ncc(cc1F)Cl 34a_100102657272_200009879301 [0,1,0,0,0,0|3,0,0]=4 3904 B11R1.81 CNCc1ncc(cc1F)Cl 7a_106832991635_200009879301 [0,1,0,0,0,0|3,0,0]=4 3905 B11R1.81 CNCc1ncc(cc1F)F 34a_100015188779_200000210301 [0,1,0,0,0,0|3,0,0]=4 3906 B11R1.81 COCc1ccc(cc1Br)Br 34a_100012357508_200000210301 [0,1,0,0,0,0|2,0,0]=3 3907 B11R1.81 COCc1ccc(cc1Br)Br 34a_100138415774_200012351560 [0,1,0,0,0,0|2,0,0]=3 3908 B11R1.81 COCc1ccc(cc1Br)Br 7a_100012357508_200000210301 [0,1,0,0,0,0|2,0,0]=3 3909 B11R1.81 COCc1ccc(cc1Br)Cl 34a_100000707881_200000210301 [0,1,0,0,0,0|2,0,0]=3 3910 B11R1.81 COCc1ccc(cc1Br)Cl 34a_100138415774_100000755608 [0,1,0,0,0,0|2,0,0]=3 3911 B11R1.81 COCc1ccc(cc1Br)Cl 7a_100000707881_200000210301 [0,1,0,0,0,0|2,0,0]=3 3912 B11R1.81 COCc1ccc(cc1Br)F 34a_100000744086_200000210301 [0,1,0,0,0,0|2,0,0]=3 3913 B11R1.81 COCc1ccc(cc1Br)F 34a_100138415774_100000243222 [0,1,0,0,0,0|2,0,0]=3 3914 B11R1.81 COCc1ccc(cc1Br)F 7a_100000744086_200000210301 [0,1,0,0,0,0|2,0,0]=3 3915 B11R1.81 COCc1ccc(cc1Br)I 34a_100138415774_100010146610 [0,1,0,0,0,0|2,0,0]=3 3916 B11R1.81 COCc1ccc(cc1Br)I 7a_100010240206_200000210301 [0,1,0,0,0,0|2,0,0]=3 3917 B11R1.81 COCc1ccc(cc1C)Br 34a_100000748258_200000210301 [0,1,0,0,0,0|2,0,0]=3 3918 B11R1.81 COCc1ccc(cc1C)Br 34a_100138415774_100000708836 [0,1,0,0,0,0|2,0,0]=3 3919 B11R1.81 COCc1ccc(cc1C)Br 7a_100000748258_200000210301 [0,1,0,0,0,0|2,0,0]=3 3920 B11R1.81 COCc1ccc(cc1C)C 34a_100011215341_200000210301 [0,1,0,0,0,0|2,0,0]=3 3921 B11R1.81 COCc1ccc(cc1C)C 34a_100138415774_100011219618 [0,1,0,0,0,0|2,0,0]=3 3922 B11R1.81 COCc1ccc(cc1C)C 7a_100011215341_200000210301 [0,1,0,0,0,0|2,0,0]=3 3923 B11R1.81 COCc1ccc(cc1C)Cl 34a_100000702939_200000210301 [0,1,0,0,0,0|2,0,0]=3 3924 B11R1.81 COCc1ccc(cc1C)Cl 34a_100138415774_100012361307 [0,1,0,0,0,0|2,0,0]=3 3925 B11R1.81 COCc1ccc(cc1C)Cl 7a_100000702939_200000210301 [0,1,0,0,0,0|2,0,0]=3 3926 B11R1.81 COCc1ccc(cc1C)F 34a_100000700136_200000210301 [0,1,0,0,0,0|2,0,0]=3 3927 B11R1.81 COCc1ccc(cc1C)F 34a_100138415774_100000700533 [0,1,0,0,0,0|2,0,0]=3 3928 B11R1.81 COCc1ccc(cc1C)F 7a_100000700136_200000210301 [0,1,0,0,0,0|2,0,0]=3 3929 B11R1.81 COCc1ccc(cc1C)N 34a_100000102464_200000210301 [0,1,0,0,0,0|2,0,0]=3 3930 B11R1.81 COCc1ccc(cc1C)N 7a_100000102464_200000210301 [0,1,0,0,0,0|2,0,0]=3 3931 B11R1.81 COCc1ccc(cc1Cl)Br 34a_100000756401_200000210301 [0,1,0,0,0,0|2,0,0]=3 3932 B11R1.81 COCc1ccc(cc1Cl)Br 34a_100138415774_100011740631 [0,1,0,0,0,0|2,0,0]=3 3933 B11R1.81 COCc1ccc(cc1Cl)Br 7a_100000756401_200000210301 [0,1,0,0,0,0|2,0,0]=3 3934 B11R1.81 COCc1ccc(cc1Cl)C 34a_100000720314_200000210301 [0,1,0,0,0,0|2,0,0]=3 3935 B11R1.81 COCc1ccc(cc1Cl)C 34a_100138415774_100012349684 [0,1,0,0,0,0|2,0,0]=3 3936 B11R1.81 COCc1ccc(cc1Cl)C 7a_100000720314_200000210301 [0,1,0,0,0,0|2,0,0]=3 3937 B11R1.81 COCc1ccc(cc1Cl)Cl 34a_100000215721_200000210301 [0,1,0,0,0,0|2,0,0]=3 3938 B11R1.81 COCc1ccc(cc1Cl)Cl 34a_100138415774_100000188473 [0,1,0,0,0,0|2,0,0]=3 3939 B11R1.81 COCc1ccc(cc1Cl)Cl 7a_100000215721_200000210301 [0,1,0,0,0,0|2,0,0]=3 3940 B11R1.81 COCc1ccc(cc1Cl)F 34a_100011219954_200000210301 [0,1,0,0,0,0|2,0,0]=3 3941 B11R1.81 COCc1ccc(cc1Cl)F 34a_100138415774_100011216360 [0,1,0,0,0,0|2,0,0]=3 3942 B11R1.81 COCc1ccc(cc1Cl)F 7a_100011219954_200000210301 [0,1,0,0,0,0|2,0,0]=3 3943 B11R1.81 COCc1ccc(cc1Cl)N 34a_100000689119_200000210301 [0,1,0,0,0,0|2,0,0]=3 3944 B11R1.81 COCc1ccc(cc1F)Br 34a_100011191541_200000210301 [0,1,0,0,0,0|2,0,0]=3 3945 B11R1.81 COCc1ccc(cc1F)Br 34a_100138415774_100000211606 [0,1,0,0,0,0|2,0,0]=3 3946 B11R1.81 COCc1ccc(cc1F)Br 7a_100011191541_200000210301 [0,1,0,0,0,0|2,0,0]=3 3947 B11R1.81 COCc1ccc(cc1F)C 34a_100011216587_200000210301 [0,1,0,0,0,0|2,0,0]=3 3948 B11R1.81 COCc1ccc(cc1F)C 34a_100138415774_100012002367 [0,1,0,0,0,0|2,0,0]=3 3949 B11R1.81 COCc1ccc(cc1F)C 7a_100011216587_200000210301 [0,1,0,0,0,0|2,0,0]=3 3950 B11R1.81 COCc1ccc(cc1F)Cl 34a_100011217562_200000210301 [0,1,0,0,0,0|2,0,0]=3 3951 B11R1.81 COCc1ccc(cc1F)Cl 34a_100138415774_100000709361 [0,1,0,0,0,0|2,0,0]=3 3952 B11R1.81 COCc1ccc(cc1F)Cl 7a_100011217562_200000210301 [0,1,0,0,0,0|2,0,0]=3 3953 B11R1.81 COCc1ccc(cc1F)F 34a_100011215441_200000210301 [0,1,0,0,0,0|2,0,0]=3 3954 B11R1.81 COCc1ccc(cc1F)F 34a_100138415774_100000748237 [0,1,0,0,0,0|2,0,0]=3 3955 B11R1.81 COCc1ccc(cc1F)F 7a_100011215441_200000210301 [0,1,0,0,0,0|2,0,0]=3 3956 B11R1.81 COCc1ccc(cc1F)I 34a_100138415774_100010244991 [0,1,0,0,0,0|2,0,0]=3 3957 B11R1.81 COCc1ccc(cc1F)I 34a_200010202041_200000210301 [0,1,0,0,0,0|2,0,0]=3 3958 B11R1.81 COCc1ccc(cc1F)I 7a_200010202041_200000210301 [0,1,0,0,0,0|2,0,0]=3 3959 B11R1.81 COCc1ccc(cc1I)Br 34a_100138415774_100010146615 [0,1,0,0,0,0|2,0,0]=3 3960 B11R1.81 COCc1ccc(cc1I)Br 7a_100010146605_200000210301 [0,1,0,0,0,0|2,0,0]=3 3961 B11R1.81 COCc1ccc(cc1I)Cl 34a_100000722340_200000210301 [0,1,0,0,0,0|2,0,0]=3 3962 B11R1.81 COCc1ccc(cc1I)Cl 34a_100138415774_100010254388 [0,1,0,0,0,0|2,0,0]=3 3963 B11R1.81 COCc1ccc(cc1I)Cl 7a_100000722340_200000210301 [0,1,0,0,0,0|2,0,0]=3 3964 B11R1.81 COCc1ccc(cc1I)F 34a_100011356828_200000210301 [0,1,0,0,0,0|2,0,0]=3 3965 B11R1.81 COCc1ccc(cc1I)F 34a_100138415774_100012354799 [0,1,0,0,0,0|2,0,0]=3 3966 B11R1.81 COCc1ccc(cc1I)F 7a_100011356828_200000210301 [0,1,0,0,0,0|2,0,0]=3 3967 B11R1.81 COCc1ccc(cc1N)Br 34a_100000718831_200000210301 [0,1,0,0,0,0|2,0,0]=3 3968 B11R1.81 COCc1ccc(cc1N)Br 7a_100000718831_200000210301 [0,1,0,0,0,0|2,0,0]=3 3969 B11R1.81 COCc1ccc(cc1N)C 34a_100000087799_200000210301 [0,1,0,0,0,0|2,0,0]=3 3970 B11R1.81 COCc1ccc(cc1N)C 7a_100000087799_200000210301 [0,1,0,0,0,0|2,0,0]=3 3971 B11R1.81 COCc1ccc(cc1N)Cl 34a_100000238622_200000210301 [0,1,0,0,0,0|2,0,0]=3 3972 B11R1.81 COCc1ccc(cc1N)Cl 7a_100000238622_200000210301 [0,1,0,0,0,0|2,0,0]=3 3973 B11R1.81 COCc1ccc(cc1N)F 34a_100011996588_200000210301 [0,1,0,0,0,0|2,0,0]=3 3974 B11R1.81 COCc1ccc(cc1N)O 271570a_203496583355_100013084866 [0,1,0,0,0,0|2,0,0]=3 3975 B11R1.81 COCc1ccc(nc1Br)Br 34a_200010005763_200000210301 [0,1,0,0,0,0|3,0,0]=4 3976 B11R1.81 COCc1ccc(nc1Br)Br 7a_200010005763_200000210301 [0,1,0,0,0,0|3,0,0]=4 3977 B11R1.81 COCc1ccc(nc1Br)C 34a_100138415774_200010064658 [0,1,0,0,0,0|3,0,0]=4 3978 B11R1.81 COCc1ccc(nc1C)C 34a_100011756430_200000210301 [0,1,0,0,0,0|3,0,0]=4 3979 B11R1.81 COCc1ccc(nc1C)C 7a_100011756430_200000210301 [0,1,0,0,0,0|3,0,0]=4 3980 B11R1.81 COCc1ccc(nc1C)F 34a_100000081978_200000210301 [0,1,0,0,0,0|3,0,0]=4 3981 B11R1.81 COCc1ccc(nc1C)F 7a_100000081978_200000210301 [0,1,0,0,0,0|3,0,0]=4 3982 B11R1.81 COCc1ccc(nc1Cl)C 34a_102495338573_200000210301 [0,1,0,0,0,0|3,0,0]=4 3983 B11R1.81 COCc1ccc(nc1Cl)C 7a_102495338573_200000210301 [0,1,0,0,0,0|3,0,0]=4 3984 B11R1.81 COCc1ccc(nc1Cl)Cl 34a_100000720492_200000210301 [0,1,0,0,0,0|3,0,0]=4 3985 B11R1.81 COCc1ccc(nc1Cl)Cl 34a_100138415774_100000722033 [0,1,0,0,0,0|3,0,0]=4 3986 B11R1.81 COCc1ccc(nc1Cl)Cl 7a_100000720492_200000210301 [0,1,0,0,0,0|3,0,0]=4 3987 B11R1.81 COCc1ccc(nc1F)Br 34a_100010065253_200000210301 [0,1,0,0,0,0|3,0,0]=4 3988 B11R1.81 COCc1ccc(nc1F)Br 7a_100010065253_200000210301 [0,1,0,0,0,0|3,0,0]=4 3989 B11R1.81 COCc1ccc(nc1F)Cl 34a_100009870654_200000210301 [0,1,0,0,0,0|3,0,0]=4 3990 B11R1.81 COCc1ccc(nc1F)Cl 7a_100009870654_200000210301 [0,1,0,0,0,0|3,0,0]=4 3991 B11R1.81 COCc1cnc(cc1C)Cl 34a_100010277336_200000210301 [0,1,0,0,0,0|3,0,0]=4 3992 B11R1.81 COCc1cnc(cc1C)Cl 7a_100010277336_200000210301 [0,1,0,0,0,0|3,0,0]=4 3993 B11R1.81 COCc1cnc(cc1C)F 34a_100138415774_100010382440 [0,1,0,0,0,0|3,0,0]=4 3994 B11R1.81 COCc1cnc(cc1Cl)Cl 34a_100000702863_200000210301 [0,1,0,0,0,0|3,0,0]=4 3995 B11R1.81 COCc1cnc(cc1Cl)Cl 34a_100138415774_100011997056 [0,1,0,0,0,0|3,0,0]=4 3996 B11R1.81 COCc1cnc(cc1Cl)Cl 7a_100000702863_200000210301 [0,1,0,0,0,0|3,0,0]=4 3997 B11R1.81 COCc1cnc(cc1N)C 34a_200012022818_200000210301 [0,1,0,0,0,0|3,0,0]=4 3998 B11R1.81 COCc1cnc(cc1N)Cl 34a_100009830438_200000210301 [0,1,0,0,0,0|3,0,0]=4 3999 B11R1.81 COCc1ncc(cc1Br)Br 34a_100012354961_200000210301 [0,1,0,0,0,0|3,0,0]=4 4000 B11R1.81 COCc1ncc(cc1Br)Br 7a_100012354961_200000210301 [0,1,0,0,0,0|3,0,0]=4 4001 B11R1.81 COCc1ncc(cc1Br)Cl 34a_100010065237_200000210301 [0,1,0,0,0,0|3,0,0]=4 4002 B11R1.81 COCc1ncc(cc1Br)Cl 7a_100010065237_200000210301 [0,1,0,0,0,0|3,0,0]=4 4003 B11R1.81 COCc1ncc(cc1C)Br 34a_100010116297_200000210301 [0,1,0,0,0,0|3,0,0]=4 4004 B11R1.81 COCc1ncc(cc1C)Br 7a_100010116297_200000210301 [0,1,0,0,0,0|3,0,0]=4 4005 B11R1.81 COCc1ncc(cc1C)C 34a_100012000483_200000210301 [0,1,0,0,0,0|3,0,0]=4 4006 B11R1.81 COCc1ncc(cc1C)C 34a_100138415774_100016990036 [0,1,0,0,0,0|3,0,0]=4 4007 B11R1.81 COCc1ncc(cc1C)C 7a_100012000483_200000210301 [0,1,0,0,0,0|3,0,0]=4 4008 B11R1.81 COCc1ncc(cc1Cl)Br 34a_100010065239_200000210301 [0,1,0,0,0,0|3,0,0]=4 4009 B11R1.81 COCc1ncc(cc1Cl)Br 7a_100010065239_200000210301 [0,1,0,0,0,0|3,0,0]=4 4010 B11R1.81 COCc1ncc(cc1Cl)Cl 34a_100103146734_200000210301 [0,1,0,0,0,0|3,0,0]=4 4011 B11R1.81 COCc1ncc(cc1Cl)Cl 7a_100103146734_200000210301 [0,1,0,0,0,0|3,0,0]=4 4012 B11R1.81 COCc1ncc(cc1F)Br 34a_100010065252_200000210301 [0,1,0,0,0,0|3,0,0]=4 4013 B11R1.81 COCc1ncc(cc1F)Br 7a_100010065252_200000210301 [0,1,0,0,0,0|3,0,0]=4 4014 B11R1.81 COCc1ncc(cc1F)Cl 34a_100009885607_200000210301 [0,1,0,0,0,0|3,0,0]=4 4015 B11R1.81 COCc1ncc(cc1F)Cl 34a_100138415774_200009879301 [0,1,0,0,0,0|3,0,0]=4 4016 B11R1.81 COCc1ncc(cc1F)Cl 7a_100009885607_200000210301 [0,1,0,0,0,0|3,0,0]=4 4017 B11R1.81 COCc1ncc(cc1F)F 34a_100000104222_200000210301 [0,1,0,0,0,0|3,0,0]=4 4018 B11R1.81 COCc1ncc(cc1F)F 7a_100000104222_200000210301 [0,1,0,0,0,0|3,0,0]=4 4019 B11R1.81 CSCc1ccc(cc1Br)Br 62a_200000210301_200012351560 [0,1,0,0,0,0|2,0,0]=3 4020 B11R1.81 CSCc1ccc(cc1Br)Br 62a_200012351560_200000210301 [0,1,0,0,0,0|2,0,0]=3 4021 B11R1.81 CSCc1ccc(cc1Br)Cl 62a_100000755608_200000210301 [0,1,0,0,0,0|2,0,0]=3 4022 B11R1.81 CSCc1ccc(cc1Br)Cl 62a_200000210301_100000755608 [0,1,0,0,0,0|2,0,0]=3 4023 B11R1.81 CSCc1ccc(cc1Br)F 62a_100000243222_200000210301 [0,1,0,0,0,0|2,0,0]=3 4024 B11R1.81 CSCc1ccc(cc1Br)F 62a_200000210301_100000243222 [0,1,0,0,0,0|2,0,0]=3 4025 B11R1.81 CSCc1ccc(cc1Br)I 62a_100010146610_200000210301 [0,1,0,0,0,0|2,0,0]=3 4026 B11R1.81 CSCc1ccc(cc1Br)I 62a_200000210301_100010146610 [0,1,0,0,0,0|2,0,0]=3 4027 B11R1.81 CSCc1ccc(cc1C)Br 62a_100000708836_200000210301 [0,1,0,0,0,0|2,0,0]=3 4028 B11R1.81 CSCc1ccc(cc1C)Br 62a_200000210301_100000708836 [0,1,0,0,0,0|2,0,0]=3 4029 B11R1.81 CSCc1ccc(cc1C)C 62a_100011219618_200000210301 [0,1,0,0,0,0|2,0,0]=3 4030 B11R1.81 CSCc1ccc(cc1C)C 62a_200000210301_100011219618 [0,1,0,0,0,0|2,0,0]=3 4031 B11R1.81 CSCc1ccc(cc1C)Cl 62a_100012361307_200000210301 [0,1,0,0,0,0|2,0,0]=3 4032 B11R1.81 CSCc1ccc(cc1C)Cl 62a_200000210301_100012361307 [0,1,0,0,0,0|2,0,0]=3 4033 B11R1.81 CSCc1ccc(cc1C)F 62a_100000700533_200000210301 [0,1,0,0,0,0|2,0,0]=3 4034 B11R1.81 CSCc1ccc(cc1C)F 62a_200000210301_100000700533 [0,1,0,0,0,0|2,0,0]=3 4035 B11R1.81 CSCc1ccc(cc1Cl)Br 62a_100011740631_200000210301 [0,1,0,0,0,0|2,0,0]=3 4036 B11R1.81 CSCc1ccc(cc1Cl)Br 62a_200000210301_100011740631 [0,1,0,0,0,0|2,0,0]=3 4037 B11R1.81 CSCc1ccc(cc1Cl)C 62a_100012349684_200000210301 [0,1,0,0,0,0|2,0,0]=3 4038 B11R1.81 CSCc1ccc(cc1Cl)C 62a_200000210301_100012349684 [0,1,0,0,0,0|2,0,0]=3 4039 B11R1.81 CSCc1ccc(cc1Cl)Cl 62a_100000188473_200000210301 [0,1,0,0,0,0|2,0,0]=3 4040 B11R1.81 CSCc1ccc(cc1Cl)Cl 62a_200000210301_100000188473 [0,1,0,0,0,0|2,0,0]=3 4041 B11R1.81 CSCc1ccc(cc1Cl)F 62a_100000187853_200000210301 [0,1,0,0,0,0|2,0,0]=3 4042 B11R1.81 CSCc1ccc(cc1Cl)F 62a_200000210301_100000187853 [0,1,0,0,0,0|2,0,0]=3 4043 B11R1.81 CSCc1ccc(cc1F)Br 62a_100000211606_200000210301 [0,1,0,0,0,0|2,0,0]=3 4044 B11R1.81 CSCc1ccc(cc1F)Br 62a_200000210301_100000211606 [0,1,0,0,0,0|2,0,0]=3 4045 B11R1.81 CSCc1ccc(cc1F)C 62a_100011217900_200000210301 [0,1,0,0,0,0|2,0,0]=3 4046 B11R1.81 CSCc1ccc(cc1F)C 62a_200000210301_100011217900 [0,1,0,0,0,0|2,0,0]=3 4047 B11R1.81 CSCc1ccc(cc1F)Cl 62a_100000709361_200000210301 [0,1,0,0,0,0|2,0,0]=3 4048 B11R1.81 CSCc1ccc(cc1F)Cl 62a_200000210301_100000709361 [0,1,0,0,0,0|2,0,0]=3 4049 B11R1.81 CSCc1ccc(cc1F)F 62a_100000748237_200000210301 [0,1,0,0,0,0|2,0,0]=3 4050 B11R1.81 CSCc1ccc(cc1F)F 62a_200000210301_100000748237 [0,1,0,0,0,0|2,0,0]=3 4051 B11R1.81 CSCc1ccc(cc1F)I 62a_100010244991_200000210301 [0,1,0,0,0,0|2,0,0]=3 4052 B11R1.81 CSCc1ccc(cc1F)I 62a_200000210301_100010244991 [0,1,0,0,0,0|2,0,0]=3 4053 B11R1.81 CSCc1ccc(cc1I)Br 62a_100010146615_200000210301 [0,1,0,0,0,0|2,0,0]=3 4054 B11R1.81 CSCc1ccc(cc1I)Br 62a_200000210301_100010146615 [0,1,0,0,0,0|2,0,0]=3 4055 B11R1.81 CSCc1ccc(cc1I)Cl 62a_100010254388_200000210301 [0,1,0,0,0,0|2,0,0]=3 4056 B11R1.81 CSCc1ccc(cc1I)Cl 62a_200000210301_100010254388 [0,1,0,0,0,0|2,0,0]=3 4057 B11R1.81 CSCc1ccc(cc1I)F 62a_100012354799_200000210301 [0,1,0,0,0,0|2,0,0]=3 4058 B11R1.81 CSCc1ccc(cc1I)F 62a_200000210301_100012354799 [0,1,0,0,0,0|2,0,0]=3 4059 B11R1.81 CSCc1ccc(nc1Br)C 62a_200000210301_200010064658 [0,1,0,0,0,0|3,0,0]=4 4060 B11R1.81 CSCc1ccc(nc1Br)C 62a_200010064658_200000210301 [0,1,0,0,0,0|3,0,0]=4 4061 B11R1.81 CSCc1ccc(nc1Cl)Cl 62a_100000722033_200000210301 [0,1,0,0,0,0|3,0,0]=4 4062 B11R1.81 CSCc1ccc(nc1Cl)Cl 62a_200000210301_100000722033 [0,1,0,0,0,0|3,0,0]=4 4063 B11R1.81 CSCc1cnc(cc1C)F 62a_100010382440_200000210301 [0,1,0,0,0,0|3,0,0]=4 4064 B11R1.81 CSCc1cnc(cc1C)F 62a_200000210301_100010382440 [0,1,0,0,0,0|3,0,0]=4 4065 B11R1.81 CSCc1cnc(cc1Cl)Cl 62a_100011997056_200000210301 [0,1,0,0,0,0|3,0,0]=4 4066 B11R1.81 CSCc1cnc(cc1Cl)Cl 62a_200000210301_100011997056 [0,1,0,0,0,0|3,0,0]=4 4067 B11R1.81 CSCc1ncc(cc1C)C 62a_100016990036_200000210301 [0,1,0,0,0,0|3,0,0]=4 4068 B11R1.81 CSCc1ncc(cc1C)C 62a_200000210301_100016990036 [0,1,0,0,0,0|3,0,0]=4 4069 B11R1.81 CSCc1ncc(cc1F)Cl 62a_200000210301_200009879301 [0,1,0,0,0,0|3,0,0]=4 4070 B11R1.81 CSCc1ncc(cc1F)Cl 62a_200009879301_200000210301 [0,1,0,0,0,0|3,0,0]=4 4071 B11R1.81 Cc1cc(c(cn1)CO[13CH3])N 34a_200012022818_200025704644 [0,1,0,0,0,0|3,0,0]=4 4072 B11R1.81 Cc1cc(c(cn1)SCF)O 62a_100011016184_100015361967 [0,1,0,0,0,0|3,0,0]=4 4073 B11R1.81 Cc1cc(c(cn1)SCF)O 62a_100015361967_100011016184 [0,1,0,0,0,0|3,0,0]=4 4074 B11R1.81 Cc1cc(ccc1CC#N)O 271570a_203496583355_100000697864 [0,1,0,0,0,0|2,0,1]=4 4075 B11R1.81 Cc1cc(ccc1CN[13CH3])Br 34a_100000753881_200025704644 [0,1,0,0,0,0|2,0,0]=3 4076 B11R1.81 Cc1cc(ccc1CN[13CH3])Cl 34a_103436540063_200025704644 [0,1,0,0,0,0|2,0,0]=3 4077 B11R1.81 Cc1cc(ccc1CN[13CH3])F 34a_100137329023_200025704644 [0,1,0,0,0,0|2,0,0]=3 4078 B11R1.81 Cc1cc(ccc1CO[13CH3])Br 34a_100000748258_200025704644 [0,1,0,0,0,0|2,0,0]=3 4079 B11R1.81 Cc1cc(ccc1CO[13CH3])Br 7a_100000748258_200025704644 [0,1,0,0,0,0|2,0,0]=3 4080 B11R1.81 Cc1cc(ccc1CO[13CH3])Cl 34a_100000702939_200025704644 [0,1,0,0,0,0|2,0,0]=3 4081 B11R1.81 Cc1cc(ccc1CO[13CH3])Cl 7a_100000702939_200025704644 [0,1,0,0,0,0|2,0,0]=3 4082 B11R1.81 Cc1cc(ccc1CO[13CH3])F 34a_100000700136_200025704644 [0,1,0,0,0,0|2,0,0]=3 4083 B11R1.81 Cc1cc(ccc1CO[13CH3])F 7a_100000700136_200025704644 [0,1,0,0,0,0|2,0,0]=3 4084 B11R1.81 Cc1cc(ccc1CO[13CH3])N 34a_100000102464_200025704644 [0,1,0,0,0,0|2,0,0]=3 4085 B11R1.81 Cc1cc(ccc1CO[13CH3])N 7a_100000102464_200025704644 [0,1,0,0,0,0|2,0,0]=3 4086 B11R1.81 Cc1cc(ccc1CS[13CH3])Br 62a_100000708836_200025704644 [0,1,0,0,0,0|2,0,0]=3 4087 B11R1.81 Cc1cc(ccc1CS[13CH3])Br 62a_200025704644_100000708836 [0,1,0,0,0,0|2,0,0]=3 4088 B11R1.81 Cc1cc(ccc1CS[13CH3])Cl 62a_100012361307_200025704644 [0,1,0,0,0,0|2,0,0]=3 4089 B11R1.81 Cc1cc(ccc1CS[13CH3])Cl 62a_200025704644_100012361307 [0,1,0,0,0,0|2,0,0]=3 4090 B11R1.81 Cc1cc(ccc1CS[13CH3])F 62a_100000700533_200025704644 [0,1,0,0,0,0|2,0,0]=3 4091 B11R1.81 Cc1cc(ccc1CS[13CH3])F 62a_200025704644_100000700533 [0,1,0,0,0,0|2,0,0]=3 4092 B11R1.81 Cc1cc(ccc1NCF)Br 34a_100000211769_100015361967 [0,1,0,0,0,0|3,0,0]=4 4093 B11R1.81 Cc1cc(ccc1NCF)Br 7a_100000211769_100015361967 [0,1,0,0,0,0|3,0,0]=4 4094 B11R1.81 Cc1cc(ccc1NCF)Cl 34a_100000210418_100015361967 [0,1,0,0,0,0|3,0,0]=4 4095 B11R1.81 Cc1cc(ccc1NCF)Cl 7a_100000210418_100015361967 [0,1,0,0,0,0|3,0,0]=4 4096 B11R1.81 Cc1cc(ccc1NCF)F 34a_100000211637_100015361967 [0,1,0,0,0,0|3,0,0]=4 4097 B11R1.81 Cc1cc(ccc1NCF)F 7a_100000211637_100015361967 [0,1,0,0,0,0|3,0,0]=4 4098 B11R1.81 Cc1cc(ccc1NCF)I 34a_100000184554_100015361967 [0,1,0,0,0,0|3,0,0]=4 4099 B11R1.81 Cc1cc(ccc1NCF)I 7a_100000184554_100015361967 [0,1,0,0,0,0|3,0,0]=4 4100 B11R1.81 Cc1cc(ccc1NCF)O 34a_100000756630_100015361967 [0,1,0,0,0,0|3,0,0]=4 4101 B11R1.81 Cc1cc(ccc1OCF)Br 34a_100000186361_100015361967 [0,1,0,0,0,0|3,0,0]=4 4102 B11R1.81 Cc1cc(ccc1OCF)Br 7a_100000186361_100015361967 [0,1,0,0,0,0|3,0,0]=4 4103 B11R1.81 Cc1cc(ccc1OCF)Cl 34a_100000211091_100015361967 [0,1,0,0,0,0|3,0,0]=4 4104 B11R1.81 Cc1cc(ccc1OCF)Cl 7a_100000211091_100015361967 [0,1,0,0,0,0|3,0,0]=4 4105 B11R1.81 Cc1cc(ccc1OCF)F 34a_100000764316_100015361967 [0,1,0,0,0,0|3,0,0]=4 4106 B11R1.81 Cc1cc(ccc1OCF)F 7a_100000764316_100015361967 [0,1,0,0,0,0|3,0,0]=4 4107 B11R1.81 Cc1cc(ccc1OCF)I 34a_100011218673_100015361967 [0,1,0,0,0,0|3,0,0]=4 4108 B11R1.81 Cc1cc(ccc1OCF)I 7a_100011218673_100015361967 [0,1,0,0,0,0|3,0,0]=4 4109 B11R1.81 Cc1cc(ccc1OCF)N 34a_100011218179_100015361967 [0,1,0,0,0,0|3,0,0]=4 4110 B11R1.81 Cc1cc(ccc1OCF)N 7a_100011218179_100015361967 [0,1,0,0,0,0|3,0,0]=4 4111 B11R1.81 Cc1cc(ccc1SCF)Br 62a_100000701812_100015361967 [0,1,0,0,0,0|3,0,0]=4 4112 B11R1.81 Cc1cc(ccc1SCF)Br 62a_100015361967_100000701812 [0,1,0,0,0,0|3,0,0]=4 4113 B11R1.81 Cc1cc(ccc1SCF)Cl 62a_100011219607_100015361967 [0,1,0,0,0,0|3,0,0]=4 4114 B11R1.81 Cc1cc(ccc1SCF)Cl 62a_100015361967_100011219607 [0,1,0,0,0,0|3,0,0]=4 4115 B11R1.81 Cc1cc(ccc1SCF)F 62a_100011205405_100015361967 [0,1,0,0,0,0|3,0,0]=4 4116 B11R1.81 Cc1cc(ccc1SCF)F 62a_100015361967_100011205405 [0,1,0,0,0,0|3,0,0]=4 4117 B11R1.81 Cc1cc(ccc1SCF)N 62a_100000210723_100015361967 [0,1,0,0,0,0|3,0,0]=4 4118 B11R1.81 Cc1cc(ccc1SCF)N 62a_100015361967_100000210723 [0,1,0,0,0,0|3,0,0]=4 4119 B11R1.81 Cc1cc(ccc1SCF)O 62a_100015361967_100000690111 [0,1,0,0,0,0|3,0,0]=4 4120 B11R1.81 Cc1cc(cnc1CO[13CH3])Br 34a_100010116297_200025704644 [0,1,0,0,0,0|3,0,0]=4 4121 B11R1.81 Cc1cc(cnc1CO[13CH3])Br 7a_100010116297_200025704644 [0,1,0,0,0,0|3,0,0]=4 4122 B11R1.81 Cc1cc(ncc1CO[13CH3])Cl 34a_100010277336_200025704644 [0,1,0,0,0,0|3,0,0]=4 4123 B11R1.81 Cc1cc(ncc1CO[13CH3])Cl 7a_100010277336_200025704644 [0,1,0,0,0,0|3,0,0]=4 4124 B11R1.81 Cc1cc(ncc1CS[13CH3])F 62a_100010382440_200025704644 [0,1,0,0,0,0|3,0,0]=4 4125 B11R1.81 Cc1cc(ncc1CS[13CH3])F 62a_200025704644_100010382440 [0,1,0,0,0,0|3,0,0]=4 4126 B11R1.81 Cc1ccc(c(c1)Br)NCF 34a_100000210942_100015361967 [0,1,0,0,0,0|3,0,0]=4 4127 B11R1.81 Cc1ccc(c(c1)Br)OCF 34a_100000210800_100015361967 [0,1,0,0,0,0|3,0,0]=4 4128 B11R1.81 Cc1ccc(c(c1)Br)OCF 7a_100000210800_100015361967 [0,1,0,0,0,0|3,0,0]=4 4129 B11R1.81 Cc1ccc(c(c1)Br)SCF 62a_100009813563_100015361967 [0,1,0,0,0,0|3,0,0]=4 4130 B11R1.81 Cc1ccc(c(c1)Br)SCF 62a_100015361967_100009813563 [0,1,0,0,0,0|3,0,0]=4 4131 B11R1.81 Cc1ccc(c(c1)C)CN[13CH3] 34a_100000737523_200025704644 [0,1,0,0,0,0|2,0,0]=3 4132 B11R1.81 Cc1ccc(c(c1)C)CO[13CH3] 34a_100011215341_200025704644 [0,1,0,0,0,0|2,0,0]=3 4133 B11R1.81 Cc1ccc(c(c1)C)CO[13CH3] 7a_100011215341_200025704644 [0,1,0,0,0,0|2,0,0]=3 4134 B11R1.81 Cc1ccc(c(c1)C)CS[13CH3] 62a_100011219618_200025704644 [0,1,0,0,0,0|2,0,0]=3 4135 B11R1.81 Cc1ccc(c(c1)C)CS[13CH3] 62a_200025704644_100011219618 [0,1,0,0,0,0|2,0,0]=3 4136 B11R1.81 Cc1ccc(c(c1)C)NCF 34a_100000736561_100015361967 [0,1,0,0,0,0|3,0,0]=4 4137 B11R1.81 Cc1ccc(c(c1)C)NCF 7a_100000736561_100015361967 [0,1,0,0,0,0|3,0,0]=4 4138 B11R1.81 Cc1ccc(c(c1)C)OCF 34a_100000211776_100015361967 [0,1,0,0,0,0|3,0,0]=4 4139 B11R1.81 Cc1ccc(c(c1)C)OCF 7a_100000211776_100015361967 [0,1,0,0,0,0|3,0,0]=4 4140 B11R1.81 Cc1ccc(c(c1)C)SCF 62a_100011217332_100015361967 [0,1,0,0,0,0|3,0,0]=4 4141 B11R1.81 Cc1ccc(c(c1)C)SCF 62a_100015361967_100011217332 [0,1,0,0,0,0|3,0,0]=4 4142 B11R1.81 Cc1ccc(c(c1)Cl)CN[13CH3] 34a_100011997539_200025704644 [0,1,0,0,0,0|2,0,0]=3 4143 B11R1.81 Cc1ccc(c(c1)Cl)CO[13CH3] 34a_100000720314_200025704644 [0,1,0,0,0,0|2,0,0]=3 4144 B11R1.81 Cc1ccc(c(c1)Cl)CO[13CH3] 7a_100000720314_200025704644 [0,1,0,0,0,0|2,0,0]=3 4145 B11R1.81 Cc1ccc(c(c1)Cl)CS[13CH3] 62a_100012349684_200025704644 [0,1,0,0,0,0|2,0,0]=3 4146 B11R1.81 Cc1ccc(c(c1)Cl)CS[13CH3] 62a_200025704644_100012349684 [0,1,0,0,0,0|2,0,0]=3 4147 B11R1.81 Cc1ccc(c(c1)Cl)NCF 34a_100000210522_100015361967 [0,1,0,0,0,0|3,0,0]=4 4148 B11R1.81 Cc1ccc(c(c1)Cl)OCF 34a_100000749699_100015361967 [0,1,0,0,0,0|3,0,0]=4 4149 B11R1.81 Cc1ccc(c(c1)Cl)OCF 7a_100000749699_100015361967 [0,1,0,0,0,0|3,0,0]=4 4150 B11R1.81 Cc1ccc(c(c1)Cl)SCF 62a_100011263221_100015361967 [0,1,0,0,0,0|3,0,0]=4 4151 B11R1.81 Cc1ccc(c(c1)Cl)SCF 62a_100015361967_100011263221 [0,1,0,0,0,0|3,0,0]=4 4152 B11R1.81 Cc1ccc(c(c1)F)CN[13CH3] 34a_100102887089_200025704644 [0,1,0,0,0,0|2,0,0]=3 4153 B11R1.81 Cc1ccc(c(c1)F)CO[13CH3] 34a_100011216587_200025704644 [0,1,0,0,0,0|2,0,0]=3 4154 B11R1.81 Cc1ccc(c(c1)F)CO[13CH3] 7a_100011216587_200025704644 [0,1,0,0,0,0|2,0,0]=3 4155 B11R1.81 Cc1ccc(c(c1)F)CS[13CH3] 62a_100011217900_200025704644 [0,1,0,0,0,0|2,0,0]=3 4156 B11R1.81 Cc1ccc(c(c1)F)CS[13CH3] 62a_200025704644_100011217900 [0,1,0,0,0,0|2,0,0]=3 4157 B11R1.81 Cc1ccc(c(c1)F)NCF 34a_100000211023_100015361967 [0,1,0,0,0,0|3,0,0]=4 4158 B11R1.81 Cc1ccc(c(c1)F)OCF 34a_100011216688_100015361967 [0,1,0,0,0,0|3,0,0]=4 4159 B11R1.81 Cc1ccc(c(c1)F)OCF 7a_100011216688_100015361967 [0,1,0,0,0,0|3,0,0]=4 4160 B11R1.81 Cc1ccc(c(c1)F)SCF 62a_100011216119_100015361967 [0,1,0,0,0,0|3,0,0]=4 4161 B11R1.81 Cc1ccc(c(c1)F)SCF 62a_100015361967_100011216119 [0,1,0,0,0,0|3,0,0]=4 4162 B11R1.81 Cc1ccc(c(c1)I)NCF 34a_100011356834_100015361967 [0,1,0,0,0,0|3,0,0]=4 4163 B11R1.81 Cc1ccc(c(c1)I)OCF 34a_100000765521_100015361967 [0,1,0,0,0,0|3,0,0]=4 4164 B11R1.81 Cc1ccc(c(c1)I)OCF 7a_100000765521_100015361967 [0,1,0,0,0,0|3,0,0]=4 4165 B11R1.81 Cc1ccc(c(c1)N)CO[13CH3] 34a_100000087799_200025704644 [0,1,0,0,0,0|2,0,0]=3 4166 B11R1.81 Cc1ccc(c(c1)N)CO[13CH3] 7a_100000087799_200025704644 [0,1,0,0,0,0|2,0,0]=3 4167 B11R1.81 Cc1ccc(c(c1)N)OCF 34a_100011215204_100015361967 [0,1,0,0,0,0|3,0,0]=4 4168 B11R1.81 Cc1ccc(c(c1)N)OCF 7a_100011215204_100015361967 [0,1,0,0,0,0|3,0,0]=4 4169 B11R1.81 Cc1ccc(c(c1)N)SCF 62a_100011216686_100015361967 [0,1,0,0,0,0|3,0,0]=4 4170 B11R1.81 Cc1ccc(c(c1)N)SCF 62a_100015361967_100011216686 [0,1,0,0,0,0|3,0,0]=4 4171 B11R1.81 Cc1ccc(c(c1)O)NCF 34a_100000211527_100015361967 [0,1,0,0,0,0|2,0,0]=3 4172 B11R1.81 Cc1ccc(c(c1)O)SCF 62a_100012002257_100015361967 [0,1,0,0,0,0|2,0,0]=3 4173 B11R1.81 Cc1ccc(c(c1)O)SCF 62a_100015361967_100012002257 [0,1,0,0,0,0|2,0,0]=3 4174 B11R1.81 Cc1ccc(c(n1)Br)CS[13CH3] 62a_200010064658_200025704644 [0,1,0,0,0,0|3,0,0]=4 4175 B11R1.81 Cc1ccc(c(n1)Br)CS[13CH3] 62a_200025704644_200010064658 [0,1,0,0,0,0|3,0,0]=4 4176 B11R1.81 Cc1ccc(c(n1)C)CO[13CH3] 34a_100011756430_200025704644 [0,1,0,0,0,0|3,0,0]=4 4177 B11R1.81 Cc1ccc(c(n1)C)CO[13CH3] 7a_100011756430_200025704644 [0,1,0,0,0,0|3,0,0]=4 4178 B11R1.81 Cc1ccc(c(n1)Cl)CO[13CH3] 34a_102495338573_200025704644 [0,1,0,0,0,0|3,0,0]=4 4179 B11R1.81 Cc1ccc(c(n1)Cl)CO[13CH3] 7a_102495338573_200025704644 [0,1,0,0,0,0|3,0,0]=4 4180 B11R1.81 Cc1ccc(c(n1)O)SCF 62a_100009817604_100015361967 [0,1,0,0,0,0|3,0,0]=4 4181 B11R1.81 Cc1ccc(c(n1)O)SCF 62a_100015361967_100009817604 [0,1,0,0,0,0|3,0,0]=4 4182 B11R1.81 Cc1cnc(c(c1)C)CO[13CH3] 34a_100012000483_200025704644 [0,1,0,0,0,0|3,0,0]=4 4183 B11R1.81 Cc1cnc(c(c1)C)CO[13CH3] 7a_100012000483_200025704644 [0,1,0,0,0,0|3,0,0]=4 4184 B11R1.81 Cc1cnc(c(c1)C)CS[13CH3] 62a_100016990036_200025704644 [0,1,0,0,0,0|3,0,0]=4 4185 B11R1.81 Cc1cnc(c(c1)C)CS[13CH3] 62a_200025704644_100016990036 [0,1,0,0,0,0|3,0,0]=4 4186 B11R1.81 Cc1cnc(c(c1)O)SCF 62a_100015361967_100012000487 [0,1,0,0,0,0|3,0,0]=4 4187 B11R1.81 Cc1nc(ccc1CO[13CH3])F 34a_100000081978_200025704644 [0,1,0,0,0,0|3,0,0]=4 4188 B11R1.81 Cc1nc(ccc1CO[13CH3])F 7a_100000081978_200025704644 [0,1,0,0,0,0|3,0,0]=4 4189 B11R1.81 FCNc1ccc(cc1Br)Br 34a_100000211012_100015361967 [0,1,0,0,0,0|3,0,0]=4 4190 B11R1.81 FCNc1ccc(cc1Br)Cl 34a_100000752454_100015361967 [0,1,0,0,0,0|3,0,0]=4 4191 B11R1.81 FCNc1ccc(cc1Br)F 34a_100000738039_100015361967 [0,1,0,0,0,0|3,0,0]=4 4192 B11R1.81 FCNc1ccc(cc1Cl)Br 34a_100000211467_100015361967 [0,1,0,0,0,0|3,0,0]=4 4193 B11R1.81 FCNc1ccc(cc1Cl)Cl 34a_100000185861_100015361967 [0,1,0,0,0,0|3,0,0]=4 4194 B11R1.81 FCNc1ccc(cc1Cl)F 34a_100000212003_100015361967 [0,1,0,0,0,0|3,0,0]=4 4195 B11R1.81 FCNc1ccc(cc1Cl)I 34a_100011218065_100015361967 [0,1,0,0,0,0|3,0,0]=4 4196 B11R1.81 FCNc1ccc(cc1F)Br 34a_100000210722_100015361967 [0,1,0,0,0,0|3,0,0]=4 4197 B11R1.81 FCNc1ccc(cc1F)Cl 34a_100000211020_100015361967 [0,1,0,0,0,0|3,0,0]=4 4198 B11R1.81 FCNc1ccc(cc1F)F 34a_100000210720_100015361967 [0,1,0,0,0,0|3,0,0]=4 4199 B11R1.81 FCNc1ccc(cc1F)I 34a_100011215594_100015361967 [0,1,0,0,0,0|3,0,0]=4 4200 B11R1.81 FCNc1ccc(cc1I)Br 34a_100000187925_100015361967 [0,1,0,0,0,0|3,0,0]=4 4201 B11R1.81 FCNc1ccc(cc1I)Cl 34a_100000761889_100015361967 [0,1,0,0,0,0|3,0,0]=4 4202 B11R1.81 FCNc1ccc(cc1I)F 34a_100000760547_100015361967 [0,1,0,0,0,0|3,0,0]=4 4203 B11R1.81 FCOc1ccc(cc1Br)Br 34a_100000188717_100015361967 [0,1,0,0,0,0|3,0,0]=4 4204 B11R1.81 FCOc1ccc(cc1Br)Br 7a_100000188717_100015361967 [0,1,0,0,0,0|3,0,0]=4 4205 B11R1.81 FCOc1ccc(cc1Br)Cl 34a_100000211998_100015361967 [0,1,0,0,0,0|3,0,0]=4 4206 B11R1.81 FCOc1ccc(cc1Br)Cl 7a_100000211998_100015361967 [0,1,0,0,0,0|3,0,0]=4 4207 B11R1.81 FCOc1ccc(cc1Br)F 34a_100000211999_100015361967 [0,1,0,0,0,0|3,0,0]=4 4208 B11R1.81 FCOc1ccc(cc1Br)F 7a_100000211999_100015361967 [0,1,0,0,0,0|3,0,0]=4 4209 B11R1.81 FCOc1ccc(cc1Br)I 34a_100012361655_100015361967 [0,1,0,0,0,0|3,0,0]=4 4210 B11R1.81 FCOc1ccc(cc1Br)I 7a_100012361655_100015361967 [0,1,0,0,0,0|3,0,0]=4 4211 B11R1.81 FCOc1ccc(cc1Cl)Br 34a_100000186472_100015361967 [0,1,0,0,0,0|3,0,0]=4 4212 B11R1.81 FCOc1ccc(cc1Cl)Br 7a_100000186472_100015361967 [0,1,0,0,0,0|3,0,0]=4 4213 B11R1.81 FCOc1ccc(cc1Cl)Cl 34a_100015191787_100015361967 [0,1,0,0,0,0|3,0,0]=4 4214 B11R1.81 FCOc1ccc(cc1Cl)Cl 7a_100015191787_100015361967 [0,1,0,0,0,0|3,0,0]=4 4215 B11R1.81 FCOc1ccc(cc1Cl)F 34a_100000212004_100015361967 [0,1,0,0,0,0|3,0,0]=4 4216 B11R1.81 FCOc1ccc(cc1Cl)F 7a_100000212004_100015361967 [0,1,0,0,0,0|3,0,0]=4 4217 B11R1.81 FCOc1ccc(cc1Cl)I 34a_100012360047_100015361967 [0,1,0,0,0,0|3,0,0]=4 4218 B11R1.81 FCOc1ccc(cc1Cl)I 7a_100012360047_100015361967 [0,1,0,0,0,0|3,0,0]=4 4219 B11R1.81 FCOc1ccc(cc1F)Br 34a_100000185481_100015361967 [0,1,0,0,0,0|3,0,0]=4 4220 B11R1.81 FCOc1ccc(cc1F)Br 7a_100000185481_100015361967 [0,1,0,0,0,0|3,0,0]=4 4221 B11R1.81 FCOc1ccc(cc1F)Cl 34a_100000230166_100015361967 [0,1,0,0,0,0|3,0,0]=4 4222 B11R1.81 FCOc1ccc(cc1F)Cl 7a_100000230166_100015361967 [0,1,0,0,0,0|3,0,0]=4 4223 B11R1.81 FCOc1ccc(cc1F)F 34a_100000230127_100015361967 [0,1,0,0,0,0|3,0,0]=4 4224 B11R1.81 FCOc1ccc(cc1F)F 7a_100000230127_100015361967 [0,1,0,0,0,0|3,0,0]=4 4225 B11R1.81 FCOc1ccc(cc1F)I 34a_100011356965_100015361967 [0,1,0,0,0,0|3,0,0]=4 4226 B11R1.81 FCOc1ccc(cc1F)I 7a_100011356965_100015361967 [0,1,0,0,0,0|3,0,0]=4 4227 B11R1.81 FCOc1ccc(cc1I)Br 34a_100012355227_100015361967 [0,1,0,0,0,0|3,0,0]=4 4228 B11R1.81 FCOc1ccc(cc1I)Br 7a_100012355227_100015361967 [0,1,0,0,0,0|3,0,0]=4 4229 B11R1.81 FCOc1ccc(cc1I)Cl 34a_100011356953_100015361967 [0,1,0,0,0,0|3,0,0]=4 4230 B11R1.81 FCOc1ccc(cc1I)Cl 7a_100011356953_100015361967 [0,1,0,0,0,0|3,0,0]=4 4231 B11R1.81 FCOc1ccc(cc1I)F 34a_100012355409_100015361967 [0,1,0,0,0,0|3,0,0]=4 4232 B11R1.81 FCOc1ccc(cc1I)F 7a_100012355409_100015361967 [0,1,0,0,0,0|3,0,0]=4 4233 B11R1.81 FCOc1ccc(cc1I)I 7a_100010001573_100015361967 [0,1,0,0,0,0|3,0,0]=4 4234 B11R1.81 FCSc1ccc(cc1Br)Br 62a_100011484698_100015361967 [0,1,0,0,0,0|3,0,0]=4 4235 B11R1.81 FCSc1ccc(cc1Br)Br 62a_100015361967_100011484698 [0,1,0,0,0,0|3,0,0]=4 4236 B11R1.81 FCSc1ccc(cc1Br)Cl 62a_100011219703_100015361967 [0,1,0,0,0,0|3,0,0]=4 4237 B11R1.81 FCSc1ccc(cc1Br)Cl 62a_100015361967_100011219703 [0,1,0,0,0,0|3,0,0]=4 4238 B11R1.81 FCSc1ccc(cc1Br)F 62a_100011217111_100015361967 [0,1,0,0,0,0|3,0,0]=4 4239 B11R1.81 FCSc1ccc(cc1Br)F 62a_100015361967_100011217111 [0,1,0,0,0,0|3,0,0]=4 4240 B11R1.81 FCSc1ccc(cc1Cl)Br 62a_100011216062_100015361967 [0,1,0,0,0,0|3,0,0]=4 4241 B11R1.81 FCSc1ccc(cc1Cl)Br 62a_100015361967_100011216062 [0,1,0,0,0,0|3,0,0]=4 4242 B11R1.81 FCSc1ccc(cc1Cl)Cl 62a_100000699841_100015361967 [0,1,0,0,0,0|3,0,0]=4 4243 B11R1.81 FCSc1ccc(cc1Cl)Cl 62a_100015361967_100000699841 [0,1,0,0,0,0|3,0,0]=4 4244 B11R1.81 FCSc1ccc(cc1Cl)F 62a_100000733362_100015361967 [0,1,0,0,0,0|3,0,0]=4 4245 B11R1.81 FCSc1ccc(cc1Cl)F 62a_100015361967_100000733362 [0,1,0,0,0,0|3,0,0]=4 4246 B11R1.81 FCSc1ccc(cc1F)Br 62a_100009814013_100015361967 [0,1,0,0,0,0|3,0,0]=4 4247 B11R1.81 FCSc1ccc(cc1F)Br 62a_100015361967_100009814013 [0,1,0,0,0,0|3,0,0]=4 4248 B11R1.81 FCSc1ccc(cc1F)Cl 62a_100011216042_100015361967 [0,1,0,0,0,0|3,0,0]=4 4249 B11R1.81 FCSc1ccc(cc1F)Cl 62a_100015361967_100011216042 [0,1,0,0,0,0|3,0,0]=4 4250 B11R1.81 FCSc1ccc(cc1F)F 62a_100000750030_100015361967 [0,1,0,0,0,0|3,0,0]=4 4251 B11R1.81 FCSc1ccc(cc1F)F 62a_100015361967_100000750030 [0,1,0,0,0,0|3,0,0]=4 4252 B11R1.81 N#CCc1ccc(cc1F)O 271570a_203496583355_100011295474 [0,1,0,0,0,0|2,0,1]=4 4253 B11R1.81 N#CCc1ccc(cc1O)F 271570a_203496583355_100011207962 [0,1,0,0,0,0|1,0,1]=3 4254 B11R1.81 N#CSc1ccc(cc1O)F 271570a_203496583355_100025703547 [0,1,0,0,0,0|2,0,1]=4 4255 B11R1.81 N#CSc1ccc(cc1O)N 271570a_203496583355_200012361504 [0,1,0,0,0,0|2,0,1]=4 4256 B11R1.81 Nc1cc(ccc1OCF)Br 34a_100000752626_100015361967 [0,1,0,0,0,0|3,0,0]=4 4257 B11R1.81 Nc1cc(ccc1OCF)Br 7a_100000752626_100015361967 [0,1,0,0,0,0|3,0,0]=4 4258 B11R1.81 Nc1cc(ccc1OCF)Cl 34a_100000210500_100015361967 [0,1,0,0,0,0|3,0,0]=4 4259 B11R1.81 Nc1cc(ccc1OCF)Cl 7a_100000210500_100015361967 [0,1,0,0,0,0|3,0,0]=4 4260 B11R1.81 Nc1cc(ccc1OCF)F 34a_100000759472_100015361967 [0,1,0,0,0,0|3,0,0]=4 4261 B11R1.81 Nc1cc(ccc1OCF)F 7a_100000759472_100015361967 [0,1,0,0,0,0|3,0,0]=4 4262 B11R1.81 Nc1cc(ccc1OCF)I 34a_100000753495_100015361967 [0,1,0,0,0,0|3,0,0]=4 4263 B11R1.81 Nc1cc(ccc1OCF)I 7a_100000753495_100015361967 [0,1,0,0,0,0|3,0,0]=4 4264 B11R1.81 Nc1cc(ccc1SCF)Br 62a_100000743836_100015361967 [0,1,0,0,0,0|3,0,0]=4 4265 B11R1.81 Nc1cc(ccc1SCF)Br 62a_100015361967_100000743836 [0,1,0,0,0,0|3,0,0]=4 4266 B11R1.81 Nc1cc(ccc1SCF)Cl 62a_100000761886_100015361967 [0,1,0,0,0,0|3,0,0]=4 4267 B11R1.81 Nc1cc(ccc1SCF)Cl 62a_100015361967_100000761886 [0,1,0,0,0,0|3,0,0]=4 4268 B11R1.81 Nc1cc(ccc1SCF)F 62a_100000687223_100015361967 [0,1,0,0,0,0|3,0,0]=4 4269 B11R1.81 Nc1cc(ccc1SCF)F 62a_100015361967_100000687223 [0,1,0,0,0,0|3,0,0]=4 4270 B11R1.81 Nc1cc(ccc1SCF)O 62a_100011999798_100015361967 [0,1,0,0,0,0|3,0,0]=4 4271 B11R1.81 Nc1cc(ccc1SCF)O 62a_100015361967_100011999798 [0,1,0,0,0,0|3,0,0]=4 4272 B11R1.81 Nc1ccc(c(c1)Br)OCF 34a_100011534360_100015361967 [0,1,0,0,0,0|3,0,0]=4 4273 B11R1.81 Nc1ccc(c(c1)Br)OCF 7a_100011534360_100015361967 [0,1,0,0,0,0|3,0,0]=4 4274 B11R1.81 Nc1ccc(c(c1)Br)SCF 62a_100000750458_100015361967 [0,1,0,0,0,0|3,0,0]=4 4275 B11R1.81 Nc1ccc(c(c1)Br)SCF 62a_100015361967_100000750458 [0,1,0,0,0,0|3,0,0]=4 4276 B11R1.81 Nc1ccc(c(c1)Cl)OCF 34a_100000744943_100015361967 [0,1,0,0,0,0|3,0,0]=4 4277 B11R1.81 Nc1ccc(c(c1)Cl)OCF 7a_100000744943_100015361967 [0,1,0,0,0,0|3,0,0]=4 4278 B11R1.81 Nc1ccc(c(c1)Cl)SCF 62a_100000761885_100015361967 [0,1,0,0,0,0|3,0,0]=4 4279 B11R1.81 Nc1ccc(c(c1)Cl)SCF 62a_100015361967_100000761885 [0,1,0,0,0,0|3,0,0]=4 4280 B11R1.81 Nc1ccc(c(c1)F)OCF 34a_100011220035_100015361967 [0,1,0,0,0,0|3,0,0]=4 4281 B11R1.81 Nc1ccc(c(c1)F)OCF 7a_100011220035_100015361967 [0,1,0,0,0,0|3,0,0]=4 4282 B11R1.81 Nc1ccc(c(c1)F)SCF 62a_100011356925_100015361967 [0,1,0,0,0,0|3,0,0]=4 4283 B11R1.81 Nc1ccc(c(c1)F)SCF 62a_100015361967_100011356925 [0,1,0,0,0,0|3,0,0]=4 4284 B11R1.81 Nc1ccc(c(c1)N)OCF 34a_100000725306_100015361967 [0,1,0,0,0,0|3,0,0]=4 4285 B11R1.81 Nc1ccc(c(c1)N)SCF 62a_100015361967_200012175722 [0,1,0,0,0,0|3,0,0]=4 4286 B11R1.81 Nc1ccc(c(c1)N)SCF 62a_200012175722_100015361967 [0,1,0,0,0,0|3,0,0]=4 4287 B11R1.81 OCCc1ccc(cc1F)O 271570a_203496583355_100011962869 [0,1,0,0,0,0|2,0,0]=3 4288 B11R1.81 Oc1cc(ccc1NCF)Br 34a_100000739049_100015361967 [0,1,0,0,0,0|2,0,0]=3 4289 B11R1.81 Oc1cc(ccc1NCF)Cl 34a_100000185728_100015361967 [0,1,0,0,0,0|2,0,0]=3 4290 B11R1.81 Oc1cc(ccc1NCF)F 34a_100000753323_100015361967 [0,1,0,0,0,0|2,0,0]=3 4291 B11R1.81 Oc1cc(ccc1SCF)Br 62a_100012344904_100015361967 [0,1,0,0,0,0|2,0,0]=3 4292 B11R1.81 Oc1cc(ccc1SCF)Br 62a_100015361967_100012344904 [0,1,0,0,0,0|2,0,0]=3 4293 B11R1.81 Oc1cc(ccc1SCF)Cl 62a_100000050036_100015361967 [0,1,0,0,0,0|2,0,0]=3 4294 B11R1.81 Oc1cc(ccc1SCF)Cl 62a_100015361967_100000050036 [0,1,0,0,0,0|2,0,0]=3 4295 B11R1.81 Oc1cc(ccc1SCF)F 62a_100000690578_100015361967 [0,1,0,0,0,0|2,0,0]=3 4296 B11R1.81 Oc1cc(ccc1SCF)F 62a_100015361967_100000690578 [0,1,0,0,0,0|2,0,0]=3 4297 B11R1.81 Oc1cc(cnc1SCF)Br 62a_100010210634_100015361967 [0,1,0,0,0,0|3,0,0]=4 4298 B11R1.81 Oc1cc(cnc1SCF)Br 62a_100015361967_100010210634 [0,1,0,0,0,0|3,0,0]=4 4299 B11R1.81 Oc1cc(cnc1SCF)Cl 62a_100010233512_100015361967 [0,1,0,0,0,0|3,0,0]=4 4300 B11R1.81 Oc1cc(cnc1SCF)Cl 62a_100015361967_100010233512 [0,1,0,0,0,0|3,0,0]=4 4301 B11R1.81 Oc1cc(cnc1SCF)F 62a_100009820119_100015361967 [0,1,0,0,0,0|3,0,0]=4 4302 B11R1.81 Oc1cc(cnc1SCF)F 62a_100015361967_100000079967 [0,1,0,0,0,0|3,0,0]=4 4303 B11R1.81 Oc1ccc(c(c1)Br)NCF 34a_100012001276_100015361967 [0,1,0,0,0,0|3,0,0]=4 4304 B11R1.81 Oc1ccc(c(c1)Br)SCF 62a_100000701344_100015361967 [0,1,0,0,0,0|3,0,0]=4 4305 B11R1.81 Oc1ccc(c(c1)Br)SCF 62a_100015361967_100000701344 [0,1,0,0,0,0|3,0,0]=4 4306 B11R1.81 Oc1ccc(c(c1)Cl)NCF 34a_100011215599_100015361967 [0,1,0,0,0,0|3,0,0]=4 4307 B11R1.81 Oc1ccc(c(c1)Cl)SCF 62a_100000047559_100015361967 [0,1,0,0,0,0|3,0,0]=4 4308 B11R1.81 Oc1ccc(c(c1)Cl)SCF 62a_100015361967_100000047559 [0,1,0,0,0,0|3,0,0]=4 4309 B11R1.81 Oc1ccc(c(c1)F)NCF 34a_100000759473_100015361967 [0,1,0,0,0,0|3,0,0]=4 4310 B11R1.81 Oc1ccc(c(c1)F)SCF 62a_100000755031_100015361967 [0,1,0,0,0,0|3,0,0]=4 4311 B11R1.81 Oc1ccc(c(c1)F)SCF 62a_100015361967_100000755031 [0,1,0,0,0,0|3,0,0]=4 4312 B11R1.81 Oc1ccc(c(c1)I)NCF 34a_100010084370_100015361967 [0,1,0,0,0,0|3,0,0]=4 4313 B11R1.81 Oc1ccc(c(c1)O)NCF 34a_100000106777_100015361967 [0,1,0,0,0,0|2,0,0]=3 4314 B11R1.81 Oc1ccc(c(c1)O)SCF 62a_100015361967_100009813921 [0,1,0,0,0,0|2,0,0]=3 4315 B11R1.81 [13CH3]NCc1ccc(cc1Br)Cl 34a_100102692131_200025704644 [0,1,0,0,0,0|2,0,0]=3 4316 B11R1.81 [13CH3]NCc1ccc(cc1Br)F 34a_100000708791_200025704644 [0,1,0,0,0,0|2,0,0]=3 4317 B11R1.81 [13CH3]NCc1ccc(cc1Cl)Br 34a_100020628970_200025704644 [0,1,0,0,0,0|2,0,0]=3 4318 B11R1.81 [13CH3]NCc1ccc(cc1Cl)Cl 34a_100000174880_200025704644 [0,1,0,0,0,0|2,0,0]=3 4319 B11R1.81 [13CH3]NCc1ccc(cc1Cl)F 34a_100000174946_200025704644 [0,1,0,0,0,0|2,0,0]=3 4320 B11R1.81 [13CH3]NCc1ccc(cc1Cl)O 34a_200161156549_200025704644 [0,1,0,0,0,0|2,0,0]=3 4321 B11R1.81 [13CH3]NCc1ccc(cc1F)Br 34a_100000754580_200025704644 [0,1,0,0,0,0|2,0,0]=3 4322 B11R1.81 [13CH3]NCc1ccc(cc1F)Cl 34a_100000708496_200025704644 [0,1,0,0,0,0|2,0,0]=3 4323 B11R1.81 [13CH3]NCc1ccc(cc1F)F 34a_100000737868_200025704644 [0,1,0,0,0,0|2,0,0]=3 4324 B11R1.81 [13CH3]NCc1ncc(cc1Cl)Br 34a_100025703182_200025704644 [0,1,0,0,0,0|3,0,0]=4 4325 B11R1.81 [13CH3]NCc1ncc(cc1Cl)F 34a_100020639648_200025704644 [0,1,0,0,0,0|3,0,0]=4 4326 B11R1.81 [13CH3]NCc1ncc(cc1F)Br 34a_100015188786_200025704644 [0,1,0,0,0,0|3,0,0]=4 4327 B11R1.81 [13CH3]NCc1ncc(cc1F)F 34a_100015188779_200025704644 [0,1,0,0,0,0|3,0,0]=4 4328 B11R1.81 [13CH3]OCc1ccc(cc1Br)Br 34a_100012357508_200025704644 [0,1,0,0,0,0|2,0,0]=3 4329 B11R1.81 [13CH3]OCc1ccc(cc1Br)Br 7a_100012357508_200025704644 [0,1,0,0,0,0|2,0,0]=3 4330 B11R1.81 [13CH3]OCc1ccc(cc1Br)Cl 34a_100000707881_200025704644 [0,1,0,0,0,0|2,0,0]=3 4331 B11R1.81 [13CH3]OCc1ccc(cc1Br)Cl 7a_100000707881_200025704644 [0,1,0,0,0,0|2,0,0]=3 4332 B11R1.81 [13CH3]OCc1ccc(cc1Br)F 34a_100000744086_200025704644 [0,1,0,0,0,0|2,0,0]=3 4333 B11R1.81 [13CH3]OCc1ccc(cc1Br)F 7a_100000744086_200025704644 [0,1,0,0,0,0|2,0,0]=3 4334 B11R1.81 [13CH3]OCc1ccc(cc1Br)I 7a_100010240206_200025704644 [0,1,0,0,0,0|2,0,0]=3 4335 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Br 34a_100000756401_200025704644 [0,1,0,0,0,0|2,0,0]=3 4336 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Br 7a_100000756401_200025704644 [0,1,0,0,0,0|2,0,0]=3 4337 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Cl 34a_100000215721_200025704644 [0,1,0,0,0,0|2,0,0]=3 4338 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Cl 7a_100000215721_200025704644 [0,1,0,0,0,0|2,0,0]=3 4339 B11R1.81 [13CH3]OCc1ccc(cc1Cl)F 34a_100011219954_200025704644 [0,1,0,0,0,0|2,0,0]=3 4340 B11R1.81 [13CH3]OCc1ccc(cc1Cl)F 7a_100011219954_200025704644 [0,1,0,0,0,0|2,0,0]=3 4341 B11R1.81 [13CH3]OCc1ccc(cc1Cl)N 34a_100000689119_200025704644 [0,1,0,0,0,0|2,0,0]=3 4342 B11R1.81 [13CH3]OCc1ccc(cc1F)Br 34a_100011191541_200025704644 [0,1,0,0,0,0|2,0,0]=3 4343 B11R1.81 [13CH3]OCc1ccc(cc1F)Br 7a_100011191541_200025704644 [0,1,0,0,0,0|2,0,0]=3 4344 B11R1.81 [13CH3]OCc1ccc(cc1F)Cl 34a_100011217562_200025704644 [0,1,0,0,0,0|2,0,0]=3 4345 B11R1.81 [13CH3]OCc1ccc(cc1F)Cl 7a_100011217562_200025704644 [0,1,0,0,0,0|2,0,0]=3 4346 B11R1.81 [13CH3]OCc1ccc(cc1F)F 34a_100011215441_200025704644 [0,1,0,0,0,0|2,0,0]=3 4347 B11R1.81 [13CH3]OCc1ccc(cc1F)F 7a_100011215441_200025704644 [0,1,0,0,0,0|2,0,0]=3 4348 B11R1.81 [13CH3]OCc1ccc(cc1F)I 34a_200010202041_200025704644 [0,1,0,0,0,0|2,0,0]=3 4349 B11R1.81 [13CH3]OCc1ccc(cc1F)I 7a_200010202041_200025704644 [0,1,0,0,0,0|2,0,0]=3 4350 B11R1.81 [13CH3]OCc1ccc(cc1I)Br 7a_100010146605_200025704644 [0,1,0,0,0,0|2,0,0]=3 4351 B11R1.81 [13CH3]OCc1ccc(cc1I)Cl 34a_100000722340_200025704644 [0,1,0,0,0,0|2,0,0]=3 4352 B11R1.81 [13CH3]OCc1ccc(cc1I)Cl 7a_100000722340_200025704644 [0,1,0,0,0,0|2,0,0]=3 4353 B11R1.81 [13CH3]OCc1ccc(cc1I)F 34a_100011356828_200025704644 [0,1,0,0,0,0|2,0,0]=3 4354 B11R1.81 [13CH3]OCc1ccc(cc1I)F 7a_100011356828_200025704644 [0,1,0,0,0,0|2,0,0]=3 4355 B11R1.81 [13CH3]OCc1ccc(cc1N)Br 34a_100000718831_200025704644 [0,1,0,0,0,0|2,0,0]=3 4356 B11R1.81 [13CH3]OCc1ccc(cc1N)Br 7a_100000718831_200025704644 [0,1,0,0,0,0|2,0,0]=3 4357 B11R1.81 [13CH3]OCc1ccc(cc1N)Cl 34a_100000238622_200025704644 [0,1,0,0,0,0|2,0,0]=3 4358 B11R1.81 [13CH3]OCc1ccc(cc1N)Cl 7a_100000238622_200025704644 [0,1,0,0,0,0|2,0,0]=3 4359 B11R1.81 [13CH3]OCc1ccc(cc1N)F 34a_100011996588_200025704644 [0,1,0,0,0,0|2,0,0]=3 4360 B11R1.81 [13CH3]OCc1ccc(nc1Br)Br 34a_200010005763_200025704644 [0,1,0,0,0,0|3,0,0]=4 4361 B11R1.81 [13CH3]OCc1ccc(nc1Br)Br 7a_200010005763_200025704644 [0,1,0,0,0,0|3,0,0]=4 4362 B11R1.81 [13CH3]OCc1ccc(nc1Cl)Cl 34a_100000720492_200025704644 [0,1,0,0,0,0|3,0,0]=4 4363 B11R1.81 [13CH3]OCc1ccc(nc1Cl)Cl 7a_100000720492_200025704644 [0,1,0,0,0,0|3,0,0]=4 4364 B11R1.81 [13CH3]OCc1ccc(nc1F)Br 34a_100010065253_200025704644 [0,1,0,0,0,0|3,0,0]=4 4365 B11R1.81 [13CH3]OCc1ccc(nc1F)Br 7a_100010065253_200025704644 [0,1,0,0,0,0|3,0,0]=4 4366 B11R1.81 [13CH3]OCc1ccc(nc1F)Cl 34a_100009870654_200025704644 [0,1,0,0,0,0|3,0,0]=4 4367 B11R1.81 [13CH3]OCc1ccc(nc1F)Cl 7a_100009870654_200025704644 [0,1,0,0,0,0|3,0,0]=4 4368 B11R1.81 [13CH3]OCc1cnc(cc1Cl)Cl 34a_100000702863_200025704644 [0,1,0,0,0,0|3,0,0]=4 4369 B11R1.81 [13CH3]OCc1cnc(cc1Cl)Cl 7a_100000702863_200025704644 [0,1,0,0,0,0|3,0,0]=4 4370 B11R1.81 [13CH3]OCc1cnc(cc1N)Cl 34a_100009830438_200025704644 [0,1,0,0,0,0|3,0,0]=4 4371 B11R1.81 [13CH3]OCc1ncc(cc1Br)Br 34a_100012354961_200025704644 [0,1,0,0,0,0|3,0,0]=4 4372 B11R1.81 [13CH3]OCc1ncc(cc1Br)Br 7a_100012354961_200025704644 [0,1,0,0,0,0|3,0,0]=4 4373 B11R1.81 [13CH3]OCc1ncc(cc1Br)Cl 34a_100010065237_200025704644 [0,1,0,0,0,0|3,0,0]=4 4374 B11R1.81 [13CH3]OCc1ncc(cc1Br)Cl 7a_100010065237_200025704644 [0,1,0,0,0,0|3,0,0]=4 4375 B11R1.81 [13CH3]OCc1ncc(cc1Cl)Br 34a_100010065239_200025704644 [0,1,0,0,0,0|3,0,0]=4 4376 B11R1.81 [13CH3]OCc1ncc(cc1Cl)Br 7a_100010065239_200025704644 [0,1,0,0,0,0|3,0,0]=4 4377 B11R1.81 [13CH3]OCc1ncc(cc1Cl)Cl 34a_100103146734_200025704644 [0,1,0,0,0,0|3,0,0]=4 4378 B11R1.81 [13CH3]OCc1ncc(cc1Cl)Cl 7a_100103146734_200025704644 [0,1,0,0,0,0|3,0,0]=4 4379 B11R1.81 [13CH3]OCc1ncc(cc1F)Br 34a_100010065252_200025704644 [0,1,0,0,0,0|3,0,0]=4 4380 B11R1.81 [13CH3]OCc1ncc(cc1F)Br 7a_100010065252_200025704644 [0,1,0,0,0,0|3,0,0]=4 4381 B11R1.81 [13CH3]OCc1ncc(cc1F)Cl 34a_100009885607_200025704644 [0,1,0,0,0,0|3,0,0]=4 4382 B11R1.81 [13CH3]OCc1ncc(cc1F)Cl 7a_100009885607_200025704644 [0,1,0,0,0,0|3,0,0]=4 4383 B11R1.81 [13CH3]OCc1ncc(cc1F)F 34a_100000104222_200025704644 [0,1,0,0,0,0|3,0,0]=4 4384 B11R1.81 [13CH3]OCc1ncc(cc1F)F 7a_100000104222_200025704644 [0,1,0,0,0,0|3,0,0]=4 4385 B11R1.81 [13CH3]SCc1ccc(cc1Br)Br 62a_200012351560_200025704644 [0,1,0,0,0,0|2,0,0]=3 4386 B11R1.81 [13CH3]SCc1ccc(cc1Br)Br 62a_200025704644_200012351560 [0,1,0,0,0,0|2,0,0]=3 4387 B11R1.81 [13CH3]SCc1ccc(cc1Br)Cl 62a_100000755608_200025704644 [0,1,0,0,0,0|2,0,0]=3 4388 B11R1.81 [13CH3]SCc1ccc(cc1Br)Cl 62a_200025704644_100000755608 [0,1,0,0,0,0|2,0,0]=3 4389 B11R1.81 [13CH3]SCc1ccc(cc1Br)F 62a_100000243222_200025704644 [0,1,0,0,0,0|2,0,0]=3 4390 B11R1.81 [13CH3]SCc1ccc(cc1Br)F 62a_200025704644_100000243222 [0,1,0,0,0,0|2,0,0]=3 4391 B11R1.81 [13CH3]SCc1ccc(cc1Br)I 62a_100010146610_200025704644 [0,1,0,0,0,0|2,0,0]=3 4392 B11R1.81 [13CH3]SCc1ccc(cc1Br)I 62a_200025704644_100010146610 [0,1,0,0,0,0|2,0,0]=3 4393 B11R1.81 [13CH3]SCc1ccc(cc1Cl)Br 62a_100011740631_200025704644 [0,1,0,0,0,0|2,0,0]=3 4394 B11R1.81 [13CH3]SCc1ccc(cc1Cl)Br 62a_200025704644_100011740631 [0,1,0,0,0,0|2,0,0]=3 4395 B11R1.81 [13CH3]SCc1ccc(cc1Cl)Cl 62a_100000188473_200025704644 [0,1,0,0,0,0|2,0,0]=3 4396 B11R1.81 [13CH3]SCc1ccc(cc1Cl)Cl 62a_200025704644_100000188473 [0,1,0,0,0,0|2,0,0]=3 4397 B11R1.81 [13CH3]SCc1ccc(cc1Cl)F 62a_100000187853_200025704644 [0,1,0,0,0,0|2,0,0]=3 4398 B11R1.81 [13CH3]SCc1ccc(cc1Cl)F 62a_200025704644_100000187853 [0,1,0,0,0,0|2,0,0]=3 4399 B11R1.81 [13CH3]SCc1ccc(cc1F)Br 62a_100000211606_200025704644 [0,1,0,0,0,0|2,0,0]=3 4400 B11R1.81 [13CH3]SCc1ccc(cc1F)Br 62a_200025704644_100000211606 [0,1,0,0,0,0|2,0,0]=3 4401 B11R1.81 [13CH3]SCc1ccc(cc1F)Cl 62a_100000709361_200025704644 [0,1,0,0,0,0|2,0,0]=3 4402 B11R1.81 [13CH3]SCc1ccc(cc1F)Cl 62a_200025704644_100000709361 [0,1,0,0,0,0|2,0,0]=3 4403 B11R1.81 [13CH3]SCc1ccc(cc1F)F 62a_100000748237_200025704644 [0,1,0,0,0,0|2,0,0]=3 4404 B11R1.81 [13CH3]SCc1ccc(cc1F)F 62a_200025704644_100000748237 [0,1,0,0,0,0|2,0,0]=3 4405 B11R1.81 [13CH3]SCc1ccc(cc1F)I 62a_100010244991_200025704644 [0,1,0,0,0,0|2,0,0]=3 4406 B11R1.81 [13CH3]SCc1ccc(cc1F)I 62a_200025704644_100010244991 [0,1,0,0,0,0|2,0,0]=3 4407 B11R1.81 [13CH3]SCc1ccc(cc1I)Br 62a_100010146615_200025704644 [0,1,0,0,0,0|2,0,0]=3 4408 B11R1.81 [13CH3]SCc1ccc(cc1I)Br 62a_200025704644_100010146615 [0,1,0,0,0,0|2,0,0]=3 4409 B11R1.81 [13CH3]SCc1ccc(cc1I)Cl 62a_100010254388_200025704644 [0,1,0,0,0,0|2,0,0]=3 4410 B11R1.81 [13CH3]SCc1ccc(cc1I)Cl 62a_200025704644_100010254388 [0,1,0,0,0,0|2,0,0]=3 4411 B11R1.81 [13CH3]SCc1ccc(cc1I)F 62a_100012354799_200025704644 [0,1,0,0,0,0|2,0,0]=3 4412 B11R1.81 [13CH3]SCc1ccc(cc1I)F 62a_200025704644_100012354799 [0,1,0,0,0,0|2,0,0]=3 4413 B11R1.81 [13CH3]SCc1ccc(nc1Cl)Cl 62a_100000722033_200025704644 [0,1,0,0,0,0|3,0,0]=4 4414 B11R1.81 [13CH3]SCc1ccc(nc1Cl)Cl 62a_200025704644_100000722033 [0,1,0,0,0,0|3,0,0]=4 4415 B11R1.81 [13CH3]SCc1cnc(cc1Cl)Cl 62a_100011997056_200025704644 [0,1,0,0,0,0|3,0,0]=4 4416 B11R1.81 [13CH3]SCc1cnc(cc1Cl)Cl 62a_200025704644_100011997056 [0,1,0,0,0,0|3,0,0]=4 4417 B11R1.81 [13CH3]SCc1ncc(cc1F)Cl 62a_200009879301_200025704644 [0,1,0,0,0,0|3,0,0]=4 4418 B11R1.81 [13CH3]SCc1ncc(cc1F)Cl 62a_200025704644_200009879301 [0,1,0,0,0,0|3,0,0]=4 4419 B11R1.86 CC(=Cc1ccccc1Br)C 271570a_100102525489_100000695589 [0,1,0,0,0,0|1,0,2]=4 4420 B11R1.86 CC(=Cc1ccccc1C)C 271570a_100102525489_100000210755 [0,1,0,0,0,0|1,0,2]=4 4421 B11R1.86 CC(=Cc1ccccc1Cl)C 271570a_100102525489_100000764095 [0,1,0,0,0,0|1,0,2]=4 4422 B11R1.86 CC(=Cc1ccccc1F)C 271570a_100102525489_100011215700 [0,1,0,0,0,0|1,0,2]=4 4423 B11R1.86 CC(=Cc1ccccc1N)C 271570a_100102525489_100000210017 [0,1,0,0,0,0|1,0,2]=4 4424 B11R1.86 CC(=Cc1ccccc1O)C 271570a_100102525489_100000739446 [0,1,0,0,0,0|0,0,2]=3 4425 B11R1.86 CC(=Cc1ccncc1O)C 271570a_100102525489_100009817591 [0,1,0,0,0,0|1,0,2]=4 4426 B11R1.86 CC(=Cc1ncccc1O)C 271570a_100102525489_100000034122 [0,1,0,0,0,0|1,0,2]=4 4427 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000070787_100000184730 [0,1,0,0,0,0|1,0,1]=3 4428 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000751119_200000210301 [0,1,0,0,0,0|1,0,1]=3 4429 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000070787_100000211839 [0,1,0,0,0,0|1,0,1]=3 4430 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000212180_200000210301 [0,1,0,0,0,0|1,0,1]=3 4431 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000070787_100000187162 [0,1,0,0,0,0|1,0,1]=3 4432 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000183793_200000210301 [0,1,0,0,0,0|1,0,1]=3 4433 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000070787_100000187165 [0,1,0,0,0,0|1,0,1]=3 4434 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000212012_200000210301 [0,1,0,0,0,0|1,0,1]=3 4435 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000036491_200000210301 [0,1,0,0,0,0|1,0,1]=3 4436 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000070787_100011216222 [0,1,0,0,0,0|1,0,1]=3 4437 B11R1.86 CC(=O)Cc1ccccc1O 1458a_100000743006_200000210301 [0,1,0,0,0,0|0,0,1]=2 4438 B11R1.86 CC(=O)Cc1ccccc1O 271570a_203496583355_100011350739 [0,1,0,0,0,0|0,0,1]=2 4439 B11R1.86 CC(=O)Cc1cccnc1Br 1458a_100000070787_100010140945 [0,1,0,0,0,0|2,0,1]=4 4440 B11R1.86 CC(=O)Cc1cccnc1C 1458a_100000070787_100000732876 [0,1,0,0,0,0|2,0,1]=4 4441 B11R1.86 CC(=O)Cc1cccnc1Cl 1458a_100000070787_100000045678 [0,1,0,0,0,0|2,0,1]=4 4442 B11R1.86 CC(=O)Cc1cccnc1Cl 1458a_100000093521_200000210301 [0,1,0,0,0,0|2,0,1]=4 4443 B11R1.86 CC(=O)Cc1cccnc1F 1458a_100000070787_100000099810 [0,1,0,0,0,0|2,0,1]=4 4444 B11R1.86 CC(=O)Cc1ccncc1C 1458a_100000070787_100020672808 [0,1,0,0,0,0|2,0,1]=4 4445 B11R1.86 CC(=O)Cc1ccncc1Cl 1458a_100000070787_100000763264 [0,1,0,0,0,0|2,0,1]=4 4446 B11R1.86 CC(=O)Cc1cnccc1C 1458a_100000070787_100000690890 [0,1,0,0,0,0|2,0,1]=4 4447 B11R1.86 CC(=O)Cc1ncccc1Br 1458a_100000070787_100025702911 [0,1,0,0,0,0|2,0,1]=4 4448 B11R1.86 CC(=O)Cc1ncccc1Br 1458a_200012357574_200000210301 [0,1,0,0,0,0|2,0,1]=4 4449 B11R1.86 CC(=O)Cc1ncccc1C 1458a_100000070787_100000696600 [0,1,0,0,0,0|2,0,1]=4 4450 B11R1.86 CC(=O)Cc1ncccc1C 1458a_200000722269_200000210301 [0,1,0,0,0,0|2,0,1]=4 4451 B11R1.86 CC(=O)Cc1ncccc1Cl 1458a_100000070787_100000099807 [0,1,0,0,0,0|2,0,1]=4 4452 B11R1.86 CC(=O)Cc1ncccc1Cl 1458a_100011998755_200000210301 [0,1,0,0,0,0|2,0,1]=4 4453 B11R1.86 CC(=O)Cc1ncccc1F 1458a_100000070787_100000104219 [0,1,0,0,0,0|2,0,1]=4 4454 B11R1.86 CC(=O)Cc1ncccc1O 1458a_100000070787_200020655725 [0,1,0,0,0,0|1,0,1]=3 4455 B11R1.86 CC(=O)Cn1ccccc1=O 1458a_100000189665_200000210301 [0,1,0,0,0,0|1,0,2]=4 4456 B11R1.86 CC(=O)Nc1ccccc1Br 11a_100000210017_100015343762 [0,1,0,0,0,0|2,0,1]=4 4457 B11R1.86 CC(=O)Nc1ccccc1Br 1626a_100000210017_100015343762 [0,1,0,0,0,0|2,0,1]=4 4458 B11R1.86 CC(=O)Nc1ccccc1C 11a_100015192222_100015343762 [0,1,0,0,0,0|2,0,1]=4 4459 B11R1.86 CC(=O)Nc1ccccc1C 1626a_100015192222_100015343762 [0,1,0,0,0,0|2,0,1]=4 4460 B11R1.86 CC(=O)Nc1ccccc1C 22a_100015192222_100000070787 [0,1,0,0,0,0|2,0,1]=4 4461 B11R1.86 CC(=O)Nc1ccccc1C 527a_100015192222_100103153847 [0,1,0,0,0,0|2,0,1]=4 4462 B11R1.86 CC(=O)Nc1ccccc1Cl 11a_100000185783_100015343762 [0,1,0,0,0,0|2,0,1]=4 4463 B11R1.86 CC(=O)Nc1ccccc1Cl 1626a_100000185783_100015343762 [0,1,0,0,0,0|2,0,1]=4 4464 B11R1.86 CC(=O)Nc1ccccc1Cl 22a_100000185783_100000070787 [0,1,0,0,0,0|2,0,1]=4 4465 B11R1.86 CC(=O)Nc1ccccc1Cl 527a_100000185783_100103153847 [0,1,0,0,0,0|2,0,1]=4 4466 B11R1.86 CC(=O)Nc1ccccc1F 11a_100000210422_100015343762 [0,1,0,0,0,0|2,0,1]=4 4467 B11R1.86 CC(=O)Nc1ccccc1F 1626a_100000210422_100015343762 [0,1,0,0,0,0|2,0,1]=4 4468 B11R1.86 CC(=O)Nc1ccccc1F 22a_100000210422_100000070787 [0,1,0,0,0,0|2,0,1]=4 4469 B11R1.86 CC(=O)Nc1ccccc1F 527a_100000210422_100103153847 [0,1,0,0,0,0|2,0,1]=4 4470 B11R1.86 CC(=O)Nc1ccccc1I 11a_100000210053_100015343762 [0,1,0,0,0,0|2,0,1]=4 4471 B11R1.86 CC(=O)Nc1ccccc1I 1626a_100000210053_100015343762 [0,1,0,0,0,0|2,0,1]=4 4472 B11R1.86 CC(=O)Nc1ccccc1O 22a_100000185747_100000070787 [0,1,0,0,0,0|1,0,1]=3 4473 B11R1.86 CC(=O)Nc1ccccc1O 271570a_203496583355_100000153524 [0,1,0,0,0,0|1,0,1]=3 4474 B11R1.86 CC(=O)Nc1ccccc1O 527a_100000185747_100103153847 [0,1,0,0,0,0|1,0,1]=3 4475 B11R1.86 CC(=O)Nc1ccncc1O 271570a_203496583355_100016132053 [0,1,0,0,0,0|2,0,1]=4 4476 B11R1.86 CC(=O)Oc1ccccc1O 271570a_203496583355_100000051690 [0,1,0,0,0,0|1,0,1]=3 4477 B11R1.86 CC(=O)Oc1cccnc1O 271570a_203496583355_200009815371 [0,1,0,0,0,0|2,0,1]=4 4478 B11R1.86 CC(C)Nc1ccccc1Br 34a_100000210017_100000210206 [0,1,0,0,0,0|2,0,0]=3 4479 B11R1.86 CC(C)Nc1ccccc1Cl 34a_100000185783_100000210206 [0,1,0,0,0,0|2,0,0]=3 4480 B11R1.86 CC(C)Nc1ccccc1F 34a_100000210422_100000210206 [0,1,0,0,0,0|2,0,0]=3 4481 B11R1.86 CC(C)Nc1ccccc1I 34a_100000210053_100000210206 [0,1,0,0,0,0|2,0,0]=3 4482 B11R1.86 CC(C)Nc1ccccc1O 271570a_203496583355_100000219599 [0,1,0,0,0,0|1,0,0]=2 4483 B11R1.86 CC(C)Nc1ccccc1O 34a_100000185747_100000210206 [0,1,0,0,0,0|1,0,0]=2 4484 B11R1.86 CC(C)Nc1ccncc1Br 27a_100138425928_100000726257 [0,1,0,0,0,0|3,0,0]=4 4485 B11R1.86 CC(C)Nc1ccncc1F 27a_100138425928_100000035921 [0,1,0,0,0,0|3,0,0]=4 4486 B11R1.86 CC(C)Nc1ncccc1Br 27a_100138425928_100000696092 [0,1,0,0,0,0|3,0,0]=4 4487 B11R1.86 CC(C)Oc1cccc[n+]1[O-] 7a_100000211761_100000210206 [0,1,0,0,0,0|2,0,1]=4 4488 B11R1.86 CC(C)Oc1ccccc1Br 34a_100000181306_100000210206 [0,1,0,0,0,0|2,0,0]=3 4489 B11R1.86 CC(C)Oc1ccccc1Br 7a_100000181306_100000210206 [0,1,0,0,0,0|2,0,0]=3 4490 B11R1.86 CC(C)Oc1ccccc1Cl 34a_100000210172_100000210206 [0,1,0,0,0,0|2,0,0]=3 4491 B11R1.86 CC(C)Oc1ccccc1Cl 7a_100000210172_100000210206 [0,1,0,0,0,0|2,0,0]=3 4492 B11R1.86 CC(C)Oc1ccccc1F 34a_100000210171_100000210206 [0,1,0,0,0,0|2,0,0]=3 4493 B11R1.86 CC(C)Oc1ccccc1F 7a_100000210171_100000210206 [0,1,0,0,0,0|2,0,0]=3 4494 B11R1.86 CC(C)Oc1ccccc1I 34a_100000739446_100000210206 [0,1,0,0,0,0|2,0,0]=3 4495 B11R1.86 CC(C)Oc1ccccc1I 7a_100000739446_100000210206 [0,1,0,0,0,0|2,0,0]=3 4496 B11R1.86 CC(C)Oc1ccccc1N 34a_100000185747_100000210206 [0,1,0,0,0,0|2,0,0]=3 4497 B11R1.86 CC(C)Oc1ccccc1N 7a_100000185747_100000210206 [0,1,0,0,0,0|2,0,0]=3 4498 B11R1.86 CC(C)Oc1ccccc1O 271570a_203496583355_100000173919 [0,1,0,0,0,0|1,0,0]=2 4499 B11R1.86 CC(C)Oc1cccnc1Br 34a_100000744436_100000210206 [0,1,0,0,0,0|3,0,0]=4 4500 B11R1.86 CC(C)Oc1cccnc1Br 7a_100000744436_100000210206 [0,1,0,0,0,0|3,0,0]=4 4501 B11R1.86 CC(C)Oc1cccnc1Cl 34a_100000757616_100000210206 [0,1,0,0,0,0|3,0,0]=4 4502 B11R1.86 CC(C)Oc1cccnc1Cl 7a_100000757616_100000210206 [0,1,0,0,0,0|3,0,0]=4 4503 B11R1.86 CC(C)Oc1cccnc1F 34a_100000061740_100000210206 [0,1,0,0,0,0|3,0,0]=4 4504 B11R1.86 CC(C)Oc1cccnc1F 7a_100000061740_100000210206 [0,1,0,0,0,0|3,0,0]=4 4505 B11R1.86 CC(C)Oc1cccnc1I 34a_100000034122_100000210206 [0,1,0,0,0,0|3,0,0]=4 4506 B11R1.86 CC(C)Oc1cccnc1I 7a_100000034122_100000210206 [0,1,0,0,0,0|3,0,0]=4 4507 B11R1.86 CC(C)Oc1cccnc1N 34a_100000211975_100000210206 [0,1,0,0,0,0|3,0,0]=4 4508 B11R1.86 CC(C)Oc1cccnc1N 7a_100000211975_100000210206 [0,1,0,0,0,0|3,0,0]=4 4509 B11R1.86 CC(C)Oc1cccoc1=O 34a_100000077404_100000210206 [0,1,0,0,0,0|2,0,1]=4 4510 B11R1.86 CC(C)Oc1cccoc1=O 7a_100000077404_100000210206 [0,1,0,0,0,0|2,0,1]=4 4511 B11R1.86 CC(C)Oc1ccncc1Br 34a_100011996408_100000210206 [0,1,0,0,0,0|3,0,0]=4 4512 B11R1.86 CC(C)Oc1ccncc1Cl 34a_100011997054_100000210206 [0,1,0,0,0,0|3,0,0]=4 4513 B11R1.86 CC(C)Oc1ccncc1F 34a_200000081243_100000210206 [0,1,0,0,0,0|3,0,0]=4 4514 B11R1.86 CC(C)Oc1cnccc1Cl 34a_100011996695_100000210206 [0,1,0,0,0,0|3,0,0]=4 4515 B11R1.86 CC(C)Oc1cnccc1I 34a_100000050107_100000210206 [0,1,0,0,0,0|3,0,0]=4 4516 B11R1.86 CC(C)Oc1cnccc1N 34a_100000753702_100000210206 [0,1,0,0,0,0|3,0,0]=4 4517 B11R1.86 CC(C)Oc1coccc1=O 34a_100000060831_100000210206 [0,1,0,0,0,0|2,0,1]=4 4518 B11R1.86 CC(C)Oc1ncccc1Cl 34a_100011290957_100000210206 [0,1,0,0,0,0|3,0,0]=4 4519 B11R1.86 CC(C)Oc1ncccc1F 34a_100011219419_100000210206 [0,1,0,0,0,0|3,0,0]=4 4520 B11R1.86 CC(C)Oc1ncccc1N 34a_100000746358_100000210206 [0,1,0,0,0,0|3,0,0]=4 4521 B11R1.86 CC(C)Oc1ncccc1O 271570a_203496583355_200011465186 [0,1,0,0,0,0|2,0,0]=3 4522 B11R1.86 CC(C)Sc1c[nH]ccc1=O 62a_100000210206_100009998708 [0,1,0,0,0,0|2,0,1]=4 4523 B11R1.86 CC(C)Sc1c[nH]ccc1=O 62a_100009998708_100000210206 [0,1,0,0,0,0|2,0,1]=4 4524 B11R1.86 CC(C)Sc1c[nH]ccc1=S 62a_100000210206_200012280681 [0,1,0,0,0,0|2,1,0]=4 4525 B11R1.86 CC(C)Sc1c[nH]ccc1=S 62a_200012280681_100000210206 [0,1,0,0,0,0|2,1,0]=4 4526 B11R1.86 CC(C)Sc1cccc[n+]1C 62a_100000210206_100000212160 [0,1,0,0,0,0|3,0,0]=4 4527 B11R1.86 CC(C)Sc1cccc[n+]1[O-] 62a_100000210206_200000042595 [0,1,0,0,0,0|2,0,1]=4 4528 B11R1.86 CC(C)Sc1ccccc1Br 62a_100000210206_100000695589 [0,1,0,0,0,0|2,0,0]=3 4529 B11R1.86 CC(C)Sc1ccccc1Br 62a_100000695589_100000210206 [0,1,0,0,0,0|2,0,0]=3 4530 B11R1.86 CC(C)Sc1ccccc1Cl 62a_100000210206_100000764095 [0,1,0,0,0,0|2,0,0]=3 4531 B11R1.86 CC(C)Sc1ccccc1Cl 62a_100000764095_100000210206 [0,1,0,0,0,0|2,0,0]=3 4532 B11R1.86 CC(C)Sc1ccccc1F 62a_100000210206_100011215700 [0,1,0,0,0,0|2,0,0]=3 4533 B11R1.86 CC(C)Sc1ccccc1F 62a_100011215700_100000210206 [0,1,0,0,0,0|2,0,0]=3 4534 B11R1.86 CC(C)Sc1ccccc1N 62a_100000210017_100000210206 [0,1,0,0,0,0|2,0,0]=3 4535 B11R1.86 CC(C)Sc1ccccc1N 62a_100000210206_100000210017 [0,1,0,0,0,0|2,0,0]=3 4536 B11R1.86 CC(C)Sc1ccccc1O 62a_100000210206_100000739446 [0,1,0,0,0,0|1,0,0]=2 4537 B11R1.86 CC(C)Sc1ccccc1O 62a_100000739446_100000210206 [0,1,0,0,0,0|1,0,0]=2 4538 B11R1.86 CC(C)Sc1cccnc1Br 62a_100000210206_100010202626 [0,1,0,0,0,0|3,0,0]=4 4539 B11R1.86 CC(C)Sc1cccnc1Br 62a_100010202626_100000210206 [0,1,0,0,0,0|3,0,0]=4 4540 B11R1.86 CC(C)Sc1cccnc1Cl 62a_100000036424_100000210206 [0,1,0,0,0,0|3,0,0]=4 4541 B11R1.86 CC(C)Sc1cccnc1Cl 62a_100000210206_100000036424 [0,1,0,0,0,0|3,0,0]=4 4542 B11R1.86 CC(C)Sc1cccnc1F 62a_100000210206_100009816115 [0,1,0,0,0,0|3,0,0]=4 4543 B11R1.86 CC(C)Sc1cccnc1F 62a_100009816115_100000210206 [0,1,0,0,0,0|3,0,0]=4 4544 B11R1.86 CC(C)Sc1cccnc1N 62a_100000045569_100000210206 [0,1,0,0,0,0|3,0,0]=4 4545 B11R1.86 CC(C)Sc1cccnc1N 62a_100000210206_100000045569 [0,1,0,0,0,0|3,0,0]=4 4546 B11R1.86 CC(C)Sc1cccnc1O 62a_100000210206_100000760158 [0,1,0,0,0,0|2,0,0]=3 4547 B11R1.86 CC(C)Sc1cccnc1O 62a_100000760158_100000210206 [0,1,0,0,0,0|2,0,0]=3 4548 B11R1.86 CC(C)Sc1ccncc1Br 62a_100000210206_100000726257 [0,1,0,0,0,0|3,0,0]=4 4549 B11R1.86 CC(C)Sc1ccncc1Br 62a_100000726257_100000210206 [0,1,0,0,0,0|3,0,0]=4 4550 B11R1.86 CC(C)Sc1ccncc1Cl 62a_100000210206_100000708259 [0,1,0,0,0,0|3,0,0]=4 4551 B11R1.86 CC(C)Sc1ccncc1Cl 62a_100000708259_100000210206 [0,1,0,0,0,0|3,0,0]=4 4552 B11R1.86 CC(C)Sc1ccncc1F 62a_100000047030_100000210206 [0,1,0,0,0,0|3,0,0]=4 4553 B11R1.86 CC(C)Sc1ccncc1F 62a_100000210206_100000047030 [0,1,0,0,0,0|3,0,0]=4 4554 B11R1.86 CC(C)Sc1ccncc1N 62a_100000210206_100000756074 [0,1,0,0,0,0|3,0,0]=4 4555 B11R1.86 CC(C)Sc1ccncc1N 62a_100000756074_100000210206 [0,1,0,0,0,0|3,0,0]=4 4556 B11R1.86 CC(C)Sc1ccncc1O 62a_100000210206_100009817591 [0,1,0,0,0,0|2,0,0]=3 4557 B11R1.86 CC(C)Sc1ccncc1O 62a_100009817591_100000210206 [0,1,0,0,0,0|2,0,0]=3 4558 B11R1.86 CC(C)Sc1cnccc1Br 62a_100000210206_100010138639 [0,1,0,0,0,0|3,0,0]=4 4559 B11R1.86 CC(C)Sc1cnccc1Br 62a_100010138639_100000210206 [0,1,0,0,0,0|3,0,0]=4 4560 B11R1.86 CC(C)Sc1cnccc1Cl 62a_100000210206_100009995489 [0,1,0,0,0,0|3,0,0]=4 4561 B11R1.86 CC(C)Sc1cnccc1Cl 62a_100009995489_100000210206 [0,1,0,0,0,0|3,0,0]=4 4562 B11R1.86 CC(C)Sc1cnccc1F 62a_100000210206_100009820683 [0,1,0,0,0,0|3,0,0]=4 4563 B11R1.86 CC(C)Sc1cnccc1F 62a_100009820683_100000210206 [0,1,0,0,0,0|3,0,0]=4 4564 B11R1.86 CC(C)Sc1cnccc1N 62a_100000047001_100000210206 [0,1,0,0,0,0|3,0,0]=4 4565 B11R1.86 CC(C)Sc1cnccc1N 62a_100000210206_100000047001 [0,1,0,0,0,0|3,0,0]=4 4566 B11R1.86 CC(C)Sc1cncnc1O 62a_100000210206_100000751107 [0,1,0,0,0,0|3,0,0]=4 4567 B11R1.86 CC(C)Sc1cncnc1O 62a_100000751107_100000210206 [0,1,0,0,0,0|3,0,0]=4 4568 B11R1.86 CC(C)Sc1ncccc1Br 62a_100000210206_100000696092 [0,1,0,0,0,0|3,0,0]=4 4569 B11R1.86 CC(C)Sc1ncccc1Br 62a_100000696092_100000210206 [0,1,0,0,0,0|3,0,0]=4 4570 B11R1.86 CC(C)Sc1ncccc1Cl 62a_100000210206_100011356963 [0,1,0,0,0,0|3,0,0]=4 4571 B11R1.86 CC(C)Sc1ncccc1Cl 62a_100011356963_100000210206 [0,1,0,0,0,0|3,0,0]=4 4572 B11R1.86 CC(C)Sc1ncccc1F 62a_100000210206_100000685392 [0,1,0,0,0,0|3,0,0]=4 4573 B11R1.86 CC(C)Sc1ncccc1F 62a_100000685392_100000210206 [0,1,0,0,0,0|3,0,0]=4 4574 B11R1.86 CC(C)Sc1ncccc1N 62a_100000210206_100000688686 [0,1,0,0,0,0|3,0,0]=4 4575 B11R1.86 CC(C)Sc1ncccc1N 62a_100000688686_100000210206 [0,1,0,0,0,0|3,0,0]=4 4576 B11R1.86 CC(C)Sc1ncccc1O 62a_100000034122_100000210206 [0,1,0,0,0,0|2,0,0]=3 4577 B11R1.86 CC(C)Sc1ncccc1O 62a_100000210206_100000034122 [0,1,0,0,0,0|2,0,0]=3 4578 B11R1.86 CN(C)Cc1ccccc1Br 2230a_100000184654_200000210301 [0,1,0,0,0,0|2,0,0]=3 4579 B11R1.86 CN(C)Cc1ccccc1Br 2230a_100102631434_100000184730 [0,1,0,0,0,0|2,0,0]=3 4580 B11R1.86 CN(C)Cc1ccccc1Br 269982a_100000184654_200000210301 [0,1,0,0,0,0|2,0,0]=3 4581 B11R1.86 CN(C)Cc1ccccc1Br 269982a_100102631434_100000184730 [0,1,0,0,0,0|2,0,0]=3 4582 B11R1.86 CN(C)Cc1ccccc1Br 270004a_100102631434_100000211189 [0,1,0,0,0,0|2,0,0]=3 4583 B11R1.86 CN(C)Cc1ccccc1Cl 2230a_100000184507_200000210301 [0,1,0,0,0,0|2,0,0]=3 4584 B11R1.86 CN(C)Cc1ccccc1Cl 2230a_100102631434_100000187162 [0,1,0,0,0,0|2,0,0]=3 4585 B11R1.86 CN(C)Cc1ccccc1Cl 269982a_100000184507_200000210301 [0,1,0,0,0,0|2,0,0]=3 4586 B11R1.86 CN(C)Cc1ccccc1Cl 269982a_100102631434_100000187162 [0,1,0,0,0,0|2,0,0]=3 4587 B11R1.86 CN(C)Cc1ccccc1Cl 270004a_100102631434_100000210073 [0,1,0,0,0,0|2,0,0]=3 4588 B11R1.86 CN(C)Cc1ccccc1F 2230a_100000742528_200000210301 [0,1,0,0,0,0|2,0,0]=3 4589 B11R1.86 CN(C)Cc1ccccc1F 2230a_100102631434_100000211605 [0,1,0,0,0,0|2,0,0]=3 4590 B11R1.86 CN(C)Cc1ccccc1F 269982a_100000742528_200000210301 [0,1,0,0,0,0|2,0,0]=3 4591 B11R1.86 CN(C)Cc1ccccc1F 269982a_100102631434_100000211605 [0,1,0,0,0,0|2,0,0]=3 4592 B11R1.86 CN(C)Cc1ccccc1F 270004a_100102631434_100000210811 [0,1,0,0,0,0|2,0,0]=3 4593 B11R1.86 CN(C)Cc1ccccc1F 34a_100000742528_200000210301 [0,1,0,0,0,0|2,0,0]=3 4594 B11R1.86 CN(C)Cc1ccccc1I 2230a_100102631434_100011215278 [0,1,0,0,0,0|2,0,0]=3 4595 B11R1.86 CN(C)Cc1ccccc1I 269982a_100102631434_100011215278 [0,1,0,0,0,0|2,0,0]=3 4596 B11R1.86 CN(C)Cc1ccccc1I 270004a_100102631434_100000010305 [0,1,0,0,0,0|2,0,0]=3 4597 B11R1.86 CN(C)Cc1ccccc1O 2230a_100015189988_200000210301 [0,1,0,0,0,0|1,0,0]=2 4598 B11R1.86 CN(C)Cc1ccccc1O 269982a_100015189988_200000210301 [0,1,0,0,0,0|1,0,0]=2 4599 B11R1.86 CN(C)Cc1ccccc1O 271570a_203496583355_100000174758 [0,1,0,0,0,0|1,0,0]=2 4600 B11R1.86 CN(C)Cc1cccnc1Br 2230a_100102631434_100010140945 [0,1,0,0,0,0|3,0,0]=4 4601 B11R1.86 CN(C)Cc1cccnc1Br 269982a_100102631434_100010140945 [0,1,0,0,0,0|3,0,0]=4 4602 B11R1.86 CN(C)Cc1cccnc1Cl 2230a_100102631434_100000045678 [0,1,0,0,0,0|3,0,0]=4 4603 B11R1.86 CN(C)Cc1cccnc1Cl 2230a_103496529121_200000210301 [0,1,0,0,0,0|3,0,0]=4 4604 B11R1.86 CN(C)Cc1cccnc1Cl 269982a_100102631434_100000045678 [0,1,0,0,0,0|3,0,0]=4 4605 B11R1.86 CN(C)Cc1cccnc1Cl 269982a_103496529121_200000210301 [0,1,0,0,0,0|3,0,0]=4 4606 B11R1.86 CN(C)Cc1cccnc1F 2230a_100102631434_100000099810 [0,1,0,0,0,0|3,0,0]=4 4607 B11R1.86 CN(C)Cc1cccnc1F 269982a_100102631434_100000099810 [0,1,0,0,0,0|3,0,0]=4 4608 B11R1.86 CN(C)Cc1cccnc1O 270004a_100102631434_100011998315 [0,1,0,0,0,0|2,0,0]=3 4609 B11R1.86 CN(C)Cc1ccncc1Br 270004a_100102631434_100000755692 [0,1,0,0,0,0|3,0,0]=4 4610 B11R1.86 CN(C)Cc1ccncc1Cl 2230a_100102631434_100000763264 [0,1,0,0,0,0|3,0,0]=4 4611 B11R1.86 CN(C)Cc1ccncc1Cl 269982a_100102631434_100000763264 [0,1,0,0,0,0|3,0,0]=4 4612 B11R1.86 CN(C)Cc1ccncc1Cl 270004a_100102631434_100011934409 [0,1,0,0,0,0|3,0,0]=4 4613 B11R1.86 CN(C)Cc1cnccc1Br 270004a_100102631434_100009816821 [0,1,0,0,0,0|3,0,0]=4 4614 B11R1.86 CN(C)Cc1cnccc1Cl 270004a_100102631434_100000050567 [0,1,0,0,0,0|3,0,0]=4 4615 B11R1.86 CN(C)Cc1ncccc1Br 2230a_100102631434_100025702911 [0,1,0,0,0,0|3,0,0]=4 4616 B11R1.86 CN(C)Cc1ncccc1Br 270004a_100102631434_100011934733 [0,1,0,0,0,0|3,0,0]=4 4617 B11R1.86 CN(C)Cc1ncccc1Cl 2230a_100102631434_100000099807 [0,1,0,0,0,0|3,0,0]=4 4618 B11R1.86 CN(C)Cc1ncccc1Cl 269982a_100102631434_100000099807 [0,1,0,0,0,0|3,0,0]=4 4619 B11R1.86 CN(C)Cc1ncccc1Cl 270004a_100102631434_100012001307 [0,1,0,0,0,0|3,0,0]=4 4620 B11R1.86 CN(C)Cc1ncccc1F 2230a_100102631434_100000104219 [0,1,0,0,0,0|3,0,0]=4 4621 B11R1.86 CN(C)Cc1ncccc1F 269982a_100102631434_100000104219 [0,1,0,0,0,0|3,0,0]=4 4622 B11R1.86 CN(C)Cc1ncccc1F 270004a_100102631434_100011934734 [0,1,0,0,0,0|3,0,0]=4 4623 B11R1.86 CN([13CH3])Cc1ccccc1Br 2230a_100000184654_200025704644 [0,1,0,0,0,0|2,0,0]=3 4624 B11R1.86 CN([13CH3])Cc1ccccc1Br 269982a_100000184654_200025704644 [0,1,0,0,0,0|2,0,0]=3 4625 B11R1.86 CN([13CH3])Cc1ccccc1Cl 2230a_100000184507_200025704644 [0,1,0,0,0,0|2,0,0]=3 4626 B11R1.86 CN([13CH3])Cc1ccccc1Cl 269982a_100000184507_200025704644 [0,1,0,0,0,0|2,0,0]=3 4627 B11R1.86 CN([13CH3])Cc1ccccc1F 2230a_100000742528_200025704644 [0,1,0,0,0,0|2,0,0]=3 4628 B11R1.86 CN([13CH3])Cc1ccccc1F 269982a_100000742528_200025704644 [0,1,0,0,0,0|2,0,0]=3 4629 B11R1.86 CN([13CH3])Cc1ccccc1F 34a_100000742528_200025704644 [0,1,0,0,0,0|2,0,0]=3 4630 B11R1.86 CN([13CH3])Cc1ccccc1O 2230a_100015189988_200025704644 [0,1,0,0,0,0|1,0,0]=2 4631 B11R1.86 CN([13CH3])Cc1ccccc1O 269982a_100015189988_200025704644 [0,1,0,0,0,0|1,0,0]=2 4632 B11R1.86 CN([13CH3])Cc1cccnc1Cl 2230a_103496529121_200025704644 [0,1,0,0,0,0|3,0,0]=4 4633 B11R1.86 CN([13CH3])Cc1cccnc1Cl 269982a_103496529121_200025704644 [0,1,0,0,0,0|3,0,0]=4 4634 B11R1.86 Cc1ccccc1CC(=O)[13CH3] 1458a_100000212180_200025704644 [0,1,0,0,0,0|1,0,1]=3 4635 B11R1.86 Cc1ccccc1CN(C)C 2230a_100000184421_200000210301 [0,1,0,0,0,0|2,0,0]=3 4636 B11R1.86 Cc1ccccc1CN(C)C 2230a_100102631434_100000211839 [0,1,0,0,0,0|2,0,0]=3 4637 B11R1.86 Cc1ccccc1CN(C)C 269982a_100000184421_200000210301 [0,1,0,0,0,0|2,0,0]=3 4638 B11R1.86 Cc1ccccc1CN(C)C 269982a_100102631434_100000211839 [0,1,0,0,0,0|2,0,0]=3 4639 B11R1.86 Cc1ccccc1CN(C)C 270004a_100102631434_100000211143 [0,1,0,0,0,0|2,0,0]=3 4640 B11R1.86 Cc1ccccc1CN(C)[13CH3] 2230a_100000184421_200025704644 [0,1,0,0,0,0|2,0,0]=3 4641 B11R1.86 Cc1ccccc1CN(C)[13CH3] 269982a_100000184421_200025704644 [0,1,0,0,0,0|2,0,0]=3 4642 B11R1.86 Cc1ccccc1NC(C)C 34a_100015192222_100000210206 [0,1,0,0,0,0|2,0,0]=3 4643 B11R1.86 Cc1ccccc1OC(C)C 34a_100000210338_100000210206 [0,1,0,0,0,0|2,0,0]=3 4644 B11R1.86 Cc1ccccc1OC(C)C 7a_100000210338_100000210206 [0,1,0,0,0,0|2,0,0]=3 4645 B11R1.86 Cc1ccccc1SC(C)C 62a_100000210206_100000210755 [0,1,0,0,0,0|2,0,0]=3 4646 B11R1.86 Cc1ccccc1SC(C)C 62a_100000210755_100000210206 [0,1,0,0,0,0|2,0,0]=3 4647 B11R1.86 Cc1cccnc1CC(=O)[13CH3] 1458a_200000722269_200025704644 [0,1,0,0,0,0|2,0,1]=4 4648 B11R1.86 Cc1cccnc1CN(C)C 2230a_100102631434_100000696600 [0,1,0,0,0,0|3,0,0]=4 4649 B11R1.86 Cc1cccnc1CN(C)C 269982a_100102631434_100000696600 [0,1,0,0,0,0|3,0,0]=4 4650 B11R1.86 Cc1cccnc1CN(C)C 270004a_100102631434_100000698913 [0,1,0,0,0,0|3,0,0]=4 4651 B11R1.86 Cc1cccnc1SC(C)C 62a_100000210206_100000751373 [0,1,0,0,0,0|3,0,0]=4 4652 B11R1.86 Cc1cccnc1SC(C)C 62a_100000751373_100000210206 [0,1,0,0,0,0|3,0,0]=4 4653 B11R1.86 Cc1ccncc1CN(C)C 2230a_100102631434_100000690890 [0,1,0,0,0,0|3,0,0]=4 4654 B11R1.86 Cc1ccncc1CN(C)C 269982a_100102631434_100000690890 [0,1,0,0,0,0|3,0,0]=4 4655 B11R1.86 Cc1ccncc1CN(C)C 270004a_100102631434_100000685662 [0,1,0,0,0,0|3,0,0]=4 4656 B11R1.86 Cc1ccncc1OC(C)C 34a_100011997053_100000210206 [0,1,0,0,0,0|3,0,0]=4 4657 B11R1.86 Cc1ccncc1OC(C)C 7a_100011997053_100000210206 [0,1,0,0,0,0|3,0,0]=4 4658 B11R1.86 Cc1ccncc1SC(C)C 62a_100000210206_100000761580 [0,1,0,0,0,0|3,0,0]=4 4659 B11R1.86 Cc1ccncc1SC(C)C 62a_100000761580_100000210206 [0,1,0,0,0,0|3,0,0]=4 4660 B11R1.86 Cc1cnccc1CN(C)C 2230a_100015187836_200000210301 [0,1,0,0,0,0|3,0,0]=4 4661 B11R1.86 Cc1cnccc1CN(C)C 2230a_100102631434_100020672808 [0,1,0,0,0,0|3,0,0]=4 4662 B11R1.86 Cc1cnccc1CN(C)C 269982a_100015187836_200000210301 [0,1,0,0,0,0|3,0,0]=4 4663 B11R1.86 Cc1cnccc1CN(C)C 269982a_100102631434_100020672808 [0,1,0,0,0,0|3,0,0]=4 4664 B11R1.86 Cc1cnccc1CN(C)[13CH3] 2230a_100015187836_200025704644 [0,1,0,0,0,0|3,0,0]=4 4665 B11R1.86 Cc1cnccc1CN(C)[13CH3] 269982a_100015187836_200025704644 [0,1,0,0,0,0|3,0,0]=4 4666 B11R1.86 Cc1cnccc1NC(C)C 27a_100138425928_100000765111 [0,1,0,0,0,0|3,0,0]=4 4667 B11R1.86 Cc1cnccc1OC(C)C 34a_100000694293_100000210206 [0,1,0,0,0,0|3,0,0]=4 4668 B11R1.86 Cc1cnccc1SC(C)C 62a_100000210206_100000765111 [0,1,0,0,0,0|3,0,0]=4 4669 B11R1.86 Cc1cnccc1SC(C)C 62a_100000765111_100000210206 [0,1,0,0,0,0|3,0,0]=4 4670 B11R1.86 Cc1ncccc1CN(C)C 2230a_100102631434_100000732876 [0,1,0,0,0,0|3,0,0]=4 4671 B11R1.86 Cc1ncccc1CN(C)C 2230a_200011875998_200000210301 [0,1,0,0,0,0|3,0,0]=4 4672 B11R1.86 Cc1ncccc1CN(C)C 269982a_100102631434_100000732876 [0,1,0,0,0,0|3,0,0]=4 4673 B11R1.86 Cc1ncccc1CN(C)C 269982a_200011875998_200000210301 [0,1,0,0,0,0|3,0,0]=4 4674 B11R1.86 Cc1ncccc1CN(C)C 270004a_100102631434_100000751968 [0,1,0,0,0,0|3,0,0]=4 4675 B11R1.86 Cc1ncccc1CN(C)[13CH3] 2230a_200011875998_200025704644 [0,1,0,0,0,0|3,0,0]=4 4676 B11R1.86 Cc1ncccc1CN(C)[13CH3] 269982a_200011875998_200025704644 [0,1,0,0,0,0|3,0,0]=4 4677 B11R1.86 Cc1ncccc1OC(C)C 34a_100000745507_100000210206 [0,1,0,0,0,0|3,0,0]=4 4678 B11R1.86 Cc1ncccc1OC(C)C 7a_100000745507_100000210206 [0,1,0,0,0,0|3,0,0]=4 4679 B11R1.86 Cc1ncccc1SC(C)C 62a_100000210206_100000751574 [0,1,0,0,0,0|3,0,0]=4 4680 B11R1.86 Cc1ncccc1SC(C)C 62a_100000751574_100000210206 [0,1,0,0,0,0|3,0,0]=4 4681 B11R1.86 NC(=O)Cc1ccccc1O 271570a_203496583355_200009814924 [0,1,0,0,0,0|1,0,1]=3 4682 B11R1.86 NC(=O)Nc1ccccc1O 271570a_203496583355_100000742221 [0,1,0,0,0,0|2,0,1]=4 4683 B11R1.86 Oc1ccccc1OC(F)F 271570a_203496583355_100000742724 [0,1,0,0,0,0|2,0,0]=3 4684 B11R1.86 Oc1ncccc1OC(F)F 271570a_203496583355_100000697348 [0,1,0,0,0,0|3,0,0]=4 4685 B11R1.86 [13CH3]C(=O)Cc1ccccc1Br 1458a_100000751119_200025704644 [0,1,0,0,0,0|1,0,1]=3 4686 B11R1.86 [13CH3]C(=O)Cc1ccccc1Cl 1458a_100000183793_200025704644 [0,1,0,0,0,0|1,0,1]=3 4687 B11R1.86 [13CH3]C(=O)Cc1ccccc1F 1458a_100000212012_200025704644 [0,1,0,0,0,0|1,0,1]=3 4688 B11R1.86 [13CH3]C(=O)Cc1ccccc1I 1458a_100000036491_200025704644 [0,1,0,0,0,0|1,0,1]=3 4689 B11R1.86 [13CH3]C(=O)Cc1ccccc1O 1458a_100000743006_200025704644 [0,1,0,0,0,0|0,0,1]=2 4690 B11R1.86 [13CH3]C(=O)Cc1cccnc1Cl 1458a_100000093521_200025704644 [0,1,0,0,0,0|2,0,1]=4 4691 B11R1.86 [13CH3]C(=O)Cc1ncccc1Br 1458a_200012357574_200025704644 [0,1,0,0,0,0|2,0,1]=4 4692 B11R1.86 [13CH3]C(=O)Cc1ncccc1Cl 1458a_100011998755_200025704644 [0,1,0,0,0,0|2,0,1]=4 4693 B11R1.86 [13CH3]C(=O)Cn1ccccc1=O 1458a_100000189665_200025704644 [0,1,0,0,0,0|1,0,2]=4 4694 B11R1.182 C=C=Cc1cc(ccc1O)Br 271570a_100015277604_100012355227 [0,1,0,0,0,0|0,0,3]=4 4695 B11R1.182 C=C=Cc1cc(ccc1O)C 271570a_100015277604_100000765521 [0,1,0,0,0,0|0,0,3]=4 4696 B11R1.182 C=C=Cc1cc(ccc1O)Cl 271570a_100015277604_100011356953 [0,1,0,0,0,0|0,0,3]=4 4697 B11R1.182 C=C=Cc1cc(ccc1O)F 271570a_100015277604_100000211999 [0,1,0,0,0,0|0,0,3]=4 4698 B11R1.182 C=C=Cc1cc(ccc1O)N 271570a_100015277604_100011534360 [0,1,0,0,0,0|0,0,3]=4 4699 B11R1.182 C=C=Cc1cc(ccc1O)O 271570a_100015277604_100009813629 [0,1,0,0,0,0|0,0,3]=4 4700 B11R1.182 CC=Cc1cc(ccc1Br)Br 271570a_100016259895_100011483371 [0,1,0,0,0,0|1,0,2]=4 4701 B11R1.182 CC=Cc1cc(ccc1Br)C 271570a_100016259895_100012353751 [0,1,0,0,0,0|1,0,2]=4 4702 B11R1.182 CC=Cc1cc(ccc1Br)Cl 271570a_100016259895_100012339723 [0,1,0,0,0,0|1,0,2]=4 4703 B11R1.182 CC=Cc1cc(ccc1Br)F 271570a_100016259895_100011217576 [0,1,0,0,0,0|1,0,2]=4 4704 B11R1.182 CC=Cc1cc(ccc1Br)N 271570a_100016259895_100000750459 [0,1,0,0,0,0|1,0,2]=4 4705 B11R1.182 CC=Cc1cc(ccc1Br)O 271570a_100016259895_100012339312 [0,1,0,0,0,0|1,0,2]=4 4706 B11R1.182 CC=Cc1cc(ccc1C)Br 271570a_100016259895_100011344865 [0,1,0,0,0,0|1,0,2]=4 4707 B11R1.182 CC=Cc1cc(ccc1C)C 271570a_100016259895_100000210833 [0,1,0,0,0,0|1,0,2]=4 4708 B11R1.182 CC=Cc1cc(ccc1C)Cl 271570a_100016259895_100011263213 [0,1,0,0,0,0|1,0,2]=4 4709 B11R1.182 CC=Cc1cc(ccc1C)F 271570a_100016259895_100011218078 [0,1,0,0,0,0|1,0,2]=4 4710 B11R1.182 CC=Cc1cc(ccc1C)N 271570a_100016259895_100000736455 [0,1,0,0,0,0|1,0,2]=4 4711 B11R1.182 CC=Cc1cc(ccc1C)O 271570a_100016259895_100011380479 [0,1,0,0,0,0|1,0,2]=4 4712 B11R1.182 CC=Cc1cc(ccc1Cl)Br 271570a_100016259895_100011772130 [0,1,0,0,0,0|1,0,2]=4 4713 B11R1.182 CC=Cc1cc(ccc1Cl)C 271570a_100016259895_100012356289 [0,1,0,0,0,0|1,0,2]=4 4714 B11R1.182 CC=Cc1cc(ccc1Cl)Cl 271570a_100016259895_100000707729 [0,1,0,0,0,0|1,0,2]=4 4715 B11R1.182 CC=Cc1cc(ccc1Cl)F 271570a_100016259895_100011217299 [0,1,0,0,0,0|1,0,2]=4 4716 B11R1.182 CC=Cc1cc(ccc1Cl)N 271570a_100016259895_100012360549 [0,1,0,0,0,0|1,0,2]=4 4717 B11R1.182 CC=Cc1cc(ccc1Cl)O 271570a_100016259895_100000049588 [0,1,0,0,0,0|1,0,2]=4 4718 B11R1.182 CC=Cc1cc(ccc1F)Br 271570a_100016259895_100011217312 [0,1,0,0,0,0|1,0,2]=4 4719 B11R1.182 CC=Cc1cc(ccc1F)C 271570a_100016259895_100000736223 [0,1,0,0,0,0|1,0,2]=4 4720 B11R1.182 CC=Cc1cc(ccc1F)Cl 271570a_100016259895_100011218116 [0,1,0,0,0,0|1,0,2]=4 4721 B11R1.182 CC=Cc1cc(ccc1F)F 271570a_100016259895_100000750033 [0,1,0,0,0,0|1,0,2]=4 4722 B11R1.182 CC=Cc1cc(ccc1F)N 271570a_100016259895_100000760356 [0,1,0,0,0,0|1,0,2]=4 4723 B11R1.182 CC=Cc1cc(ccc1F)O 271570a_100016259895_100000693481 [0,1,0,0,0,0|1,0,2]=4 4724 B11R1.182 CC=Cc1cc(ccc1N)Br 271570a_100016259895_100000187925 [0,1,0,0,0,0|1,0,2]=4 4725 B11R1.182 CC=Cc1cc(ccc1N)C 271570a_100016259895_100000210942 [0,1,0,0,0,0|1,0,2]=4 4726 B11R1.182 CC=Cc1cc(ccc1N)Cl 271570a_100016259895_100000761889 [0,1,0,0,0,0|1,0,2]=4 4727 B11R1.182 CC=Cc1cc(ccc1N)F 271570a_100016259895_100000760547 [0,1,0,0,0,0|1,0,2]=4 4728 B11R1.182 CC=Cc1cc(ccc1N)N 271570a_100016259895_100011534242 [0,1,0,0,0,0|1,0,2]=4 4729 B11R1.182 CC=Cc1cc(ccc1N)O 271570a_100016259895_100012001276 [0,1,0,0,0,0|1,0,2]=4 4730 B11R1.182 CC=Cc1cc(ccc1O)Br 271570a_100016259895_100012355227 [0,1,0,0,0,0|0,0,2]=3 4731 B11R1.182 CC=Cc1cc(ccc1O)C 271570a_100016259895_100000765521 [0,1,0,0,0,0|0,0,2]=3 4732 B11R1.182 CC=Cc1cc(ccc1O)Cl 271570a_100016259895_100011356953 [0,1,0,0,0,0|0,0,2]=3 4733 B11R1.182 CC=Cc1cc(ccc1O)F 271570a_100016259895_100000211999 [0,1,0,0,0,0|0,0,2]=3 4734 B11R1.182 CC=Cc1cc(ccc1O)N 271570a_100016259895_100011534360 [0,1,0,0,0,0|0,0,2]=3 4735 B11R1.182 CC=Cc1cc(ccc1O)O 271570a_100016259895_100009813629 [0,1,0,0,0,0|0,0,2]=3 4736 B11R1.182 CC=Cc1cc(cnc1O)Br 271570a_100016259895_100010197142 [0,1,0,0,0,0|1,0,2]=4 4737 B11R1.182 CC=Cc1cc(cnc1O)C 271570a_100016259895_100000049931 [0,1,0,0,0,0|1,0,2]=4 4738 B11R1.182 CC=Cc1cc(cnc1O)Cl 271570a_100016259895_100010188700 [0,1,0,0,0,0|1,0,2]=4 4739 B11R1.182 CC=Cc1cc(ncc1O)C 271570a_100016259895_100009843476 [0,1,0,0,0,0|1,0,2]=4 4740 B11R1.182 CC=Cc1cc(ncc1O)Cl 271570a_100016259895_100000698892 [0,1,0,0,0,0|1,0,2]=4 4741 B11R1.182 CC=Cc1nc(ccc1O)Br 271570a_100016259895_100010253912 [0,1,0,0,0,0|1,0,2]=4 4742 B11R1.182 CC=Cc1nc(ccc1O)C 271570a_100016259895_100000702858 [0,1,0,0,0,0|1,0,2]=4 4743 B11R1.182 CC=Cc1nc(ccc1O)Cl 271570a_100016259895_100000696390 [0,1,0,0,0,0|1,0,2]=4 4744 B11R1.182 CC=Cc1nc(ccc1O)F 271570a_100016259895_100010382442 [0,1,0,0,0,0|1,0,2]=4 4745 B11R1.182 CCNc1cc(ccc1Br)Br 34a_100000737762_100000210202 [0,1,0,0,0,0|2,0,0]=3 4746 B11R1.182 CCNc1cc(ccc1Br)C 34a_100000745044_100000210202 [0,1,0,0,0,0|2,0,0]=3 4747 B11R1.182 CCNc1cc(ccc1Br)Cl 34a_100000687073_100000210202 [0,1,0,0,0,0|2,0,0]=3 4748 B11R1.182 CCNc1cc(ccc1Br)F 34a_100000687223_100000210202 [0,1,0,0,0,0|2,0,0]=3 4749 B11R1.182 CCNc1cc(ccc1Br)O 34a_100011999798_100000210202 [0,1,0,0,0,0|2,0,0]=3 4750 B11R1.182 CCNc1cc(ccc1C)Br 34a_100000741167_100000210202 [0,1,0,0,0,0|2,0,0]=3 4751 B11R1.182 CCNc1cc(ccc1C)Br 7a_100000741167_100000210202 [0,1,0,0,0,0|2,0,0]=3 4752 B11R1.182 CCNc1cc(ccc1C)C 2230a_100000185781_100000210202 [0,1,0,0,0,0|2,0,0]=3 4753 B11R1.182 CCNc1cc(ccc1C)C 34a_100000185781_100000210202 [0,1,0,0,0,0|2,0,0]=3 4754 B11R1.182 CCNc1cc(ccc1C)C 7a_100000185781_100000210202 [0,1,0,0,0,0|2,0,0]=3 4755 B11R1.182 CCNc1cc(ccc1C)Cl 34a_100000211374_100000210202 [0,1,0,0,0,0|2,0,0]=3 4756 B11R1.182 CCNc1cc(ccc1C)Cl 7a_100000211374_100000210202 [0,1,0,0,0,0|2,0,0]=3 4757 B11R1.182 CCNc1cc(ccc1C)F 34a_100000211107_100000210202 [0,1,0,0,0,0|2,0,0]=3 4758 B11R1.182 CCNc1cc(ccc1C)F 7a_100000211107_100000210202 [0,1,0,0,0,0|2,0,0]=3 4759 B11R1.182 CCNc1cc(ccc1C)I 7a_100000761890_100000210202 [0,1,0,0,0,0|2,0,0]=3 4760 B11R1.182 CCNc1cc(ccc1C)O 34a_100011216113_100000210202 [0,1,0,0,0,0|2,0,0]=3 4761 B11R1.182 CCNc1cc(ccc1Cl)Br 34a_100000750497_100000210202 [0,1,0,0,0,0|2,0,0]=3 4762 B11R1.182 CCNc1cc(ccc1Cl)C 34a_100011215360_100000210202 [0,1,0,0,0,0|2,0,0]=3 4763 B11R1.182 CCNc1cc(ccc1Cl)Cl 34a_100000184485_100000210202 [0,1,0,0,0,0|2,0,0]=3 4764 B11R1.182 CCNc1cc(ccc1Cl)F 34a_100000751338_100000210202 [0,1,0,0,0,0|2,0,0]=3 4765 B11R1.182 CCNc1cc(ccc1Cl)I 34a_200000761891_100000210202 [0,1,0,0,0,0|2,0,0]=3 4766 B11R1.182 CCNc1cc(ccc1Cl)O 34a_100011934297_100000210202 [0,1,0,0,0,0|2,0,0]=3 4767 B11R1.182 CCNc1cc(ccc1F)Br 34a_100000740924_100000210202 [0,1,0,0,0,0|2,0,0]=3 4768 B11R1.182 CCNc1cc(ccc1F)C 34a_100000211285_100000210202 [0,1,0,0,0,0|2,0,0]=3 4769 B11R1.182 CCNc1cc(ccc1F)Cl 34a_100000212115_100000210202 [0,1,0,0,0,0|2,0,0]=3 4770 B11R1.182 CCNc1cc(ccc1F)F 34a_100000210742_100000210202 [0,1,0,0,0,0|2,0,0]=3 4771 B11R1.182 CCNc1cc(ccc1F)I 34a_100011464823_100000210202 [0,1,0,0,0,0|2,0,0]=3 4772 B11R1.182 CCNc1cc(ccc1F)O 34a_100012017239_100000210202 [0,1,0,0,0,0|2,0,0]=3 4773 B11R1.182 CCNc1cc(ccc1I)Br 34a_100000743836_100000210202 [0,1,0,0,0,0|2,0,0]=3 4774 B11R1.182 CCNc1cc(ccc1I)C 34a_100011216686_100000210202 [0,1,0,0,0,0|2,0,0]=3 4775 B11R1.182 CCNc1cc(ccc1I)Cl 34a_100000761886_100000210202 [0,1,0,0,0,0|2,0,0]=3 4776 B11R1.182 CCNc1cc(ccc1I)F 34a_100011218093_100000210202 [0,1,0,0,0,0|2,0,0]=3 4777 B11R1.182 CCNc1cc(ccc1N)O 271570a_203496583355_100000696630 [0,1,0,0,0,0|2,0,0]=3 4778 B11R1.182 CCNc1cc(ccc1O)Br 34a_100000752626_100000210202 [0,1,0,0,0,0|1,0,0]=2 4779 B11R1.182 CCNc1cc(ccc1O)C 34a_100011215204_100000210202 [0,1,0,0,0,0|1,0,0]=2 4780 B11R1.182 CCNc1cc(ccc1O)Cl 34a_100000210500_100000210202 [0,1,0,0,0,0|1,0,0]=2 4781 B11R1.182 CCNc1cc(ccc1O)F 34a_100000759472_100000210202 [0,1,0,0,0,0|1,0,0]=2 4782 B11R1.182 CCNc1cc(cnc1F)Br 27a_100015525214_100010172738 [0,1,0,0,0,0|3,0,0]=4 4783 B11R1.182 CCNc1cc(cnc1F)C 27a_100015525214_100009820679 [0,1,0,0,0,0|3,0,0]=4 4784 B11R1.182 CCNc1cc(cnc1F)Cl 27a_100015525214_100010188783 [0,1,0,0,0,0|3,0,0]=4 4785 B11R1.182 CCNc1cc(ncc1Br)Br 27a_100015525214_100010171693 [0,1,0,0,0,0|3,0,0]=4 4786 B11R1.182 CCNc1cc(ncc1C)F 27a_100015525214_100000049870 [0,1,0,0,0,0|3,0,0]=4 4787 B11R1.182 CCNc1cc(ncc1Cl)F 27a_100015525214_100009892587 [0,1,0,0,0,0|3,0,0]=4 4788 B11R1.182 CCNc1cc(ncc1F)C 27a_100015525214_100009867690 [0,1,0,0,0,0|3,0,0]=4 4789 B11R1.182 CCNc1cc(ncc1F)F 27a_100015525214_100010233071 [0,1,0,0,0,0|3,0,0]=4 4790 B11R1.182 CCNc1nc(ccc1F)F 27a_100015525214_100010997973 [0,1,0,0,0,0|3,0,0]=4 4791 B11R1.182 CCNc1nc(ccc1N)F 27a_100015525214_100009879877 [0,1,0,0,0,0|3,0,0]=4 4792 B11R1.182 CCOc1cc(=O)[nH]cc1Cl 34a_100000069390_100000210202 [0,1,0,0,0,0|3,0,0]=4 4793 B11R1.182 CCOc1cc(ccc1Br)Br 34a_100011220040_100000210202 [0,1,0,0,0,0|2,0,0]=3 4794 B11R1.182 CCOc1cc(ccc1Br)Br 7a_100011220040_100000210202 [0,1,0,0,0,0|2,0,0]=3 4795 B11R1.182 CCOc1cc(ccc1Br)C 34a_100012002257_100000210202 [0,1,0,0,0,0|2,0,0]=3 4796 B11R1.182 CCOc1cc(ccc1Br)C 7a_100012002257_100000210202 [0,1,0,0,0,0|2,0,0]=3 4797 B11R1.182 CCOc1cc(ccc1Br)Cl 34a_100012339455_100000210202 [0,1,0,0,0,0|2,0,0]=3 4798 B11R1.182 CCOc1cc(ccc1Br)Cl 7a_100012339455_100000210202 [0,1,0,0,0,0|2,0,0]=3 4799 B11R1.182 CCOc1cc(ccc1Br)F 34a_100000690578_100000210202 [0,1,0,0,0,0|2,0,0]=3 4800 B11R1.182 CCOc1cc(ccc1Br)F 7a_100000690578_100000210202 [0,1,0,0,0,0|2,0,0]=3 4801 B11R1.182 CCOc1cc(ccc1Br)I 34a_100012356990_100000210202 [0,1,0,0,0,0|2,0,0]=3 4802 B11R1.182 CCOc1cc(ccc1Br)I 7a_100012356990_100000210202 [0,1,0,0,0,0|2,0,0]=3 4803 B11R1.182 CCOc1cc(ccc1C)Br 34a_100000685420_100000210202 [0,1,0,0,0,0|2,0,0]=3 4804 B11R1.182 CCOc1cc(ccc1C)Br 7a_100000685420_100000210202 [0,1,0,0,0,0|2,0,0]=3 4805 B11R1.182 CCOc1cc(ccc1C)C 34a_100000210931_100000210202 [0,1,0,0,0,0|2,0,0]=3 4806 B11R1.182 CCOc1cc(ccc1C)C 7a_100000210931_100000210202 [0,1,0,0,0,0|2,0,0]=3 4807 B11R1.182 CCOc1cc(ccc1C)Cl 34a_100000756515_100000210202 [0,1,0,0,0,0|2,0,0]=3 4808 B11R1.182 CCOc1cc(ccc1C)Cl 7a_100000756515_100000210202 [0,1,0,0,0,0|2,0,0]=3 4809 B11R1.182 CCOc1cc(ccc1C)F 34a_100000690566_100000210202 [0,1,0,0,0,0|2,0,0]=3 4810 B11R1.182 CCOc1cc(ccc1C)F 7a_100000690566_100000210202 [0,1,0,0,0,0|2,0,0]=3 4811 B11R1.182 CCOc1cc(ccc1C)I 7a_100000766334_100000210202 [0,1,0,0,0,0|2,0,0]=3 4812 B11R1.182 CCOc1cc(ccc1C)N 34a_100000759471_100000210202 [0,1,0,0,0,0|2,0,0]=3 4813 B11R1.182 CCOc1cc(ccc1C)N 7a_100000759471_100000210202 [0,1,0,0,0,0|2,0,0]=3 4814 B11R1.182 CCOc1cc(ccc1C)O 271570a_203496583355_100012361169 [0,1,0,0,0,0|2,0,0]=3 4815 B11R1.182 CCOc1cc(ccc1Cl)Br 34a_100000738945_100000210202 [0,1,0,0,0,0|2,0,0]=3 4816 B11R1.182 CCOc1cc(ccc1Cl)Br 7a_100000738945_100000210202 [0,1,0,0,0,0|2,0,0]=3 4817 B11R1.182 CCOc1cc(ccc1Cl)C 34a_100000211493_100000210202 [0,1,0,0,0,0|2,0,0]=3 4818 B11R1.182 CCOc1cc(ccc1Cl)C 7a_100000211493_100000210202 [0,1,0,0,0,0|2,0,0]=3 4819 B11R1.182 CCOc1cc(ccc1Cl)Cl 34a_100000211422_100000210202 [0,1,0,0,0,0|2,0,0]=3 4820 B11R1.182 CCOc1cc(ccc1Cl)Cl 7a_100000211422_100000210202 [0,1,0,0,0,0|2,0,0]=3 4821 B11R1.182 CCOc1cc(ccc1Cl)F 34a_100000692107_100000210202 [0,1,0,0,0,0|2,0,0]=3 4822 B11R1.182 CCOc1cc(ccc1Cl)F 7a_100000692107_100000210202 [0,1,0,0,0,0|2,0,0]=3 4823 B11R1.182 CCOc1cc(ccc1Cl)I 34a_100011356854_100000210202 [0,1,0,0,0,0|2,0,0]=3 4824 B11R1.182 CCOc1cc(ccc1Cl)I 7a_100011356854_100000210202 [0,1,0,0,0,0|2,0,0]=3 4825 B11R1.182 CCOc1cc(ccc1Cl)N 34a_100011934209_100000210202 [0,1,0,0,0,0|2,0,0]=3 4826 B11R1.182 CCOc1cc(ccc1F)Br 34a_100000686035_100000210202 [0,1,0,0,0,0|2,0,0]=3 4827 B11R1.182 CCOc1cc(ccc1F)Br 7a_100000686035_100000210202 [0,1,0,0,0,0|2,0,0]=3 4828 B11R1.182 CCOc1cc(ccc1F)C 34a_100000759540_100000210202 [0,1,0,0,0,0|2,0,0]=3 4829 B11R1.182 CCOc1cc(ccc1F)C 7a_100000759540_100000210202 [0,1,0,0,0,0|2,0,0]=3 4830 B11R1.182 CCOc1cc(ccc1F)Cl 34a_100000757397_100000210202 [0,1,0,0,0,0|2,0,0]=3 4831 B11R1.182 CCOc1cc(ccc1F)Cl 7a_100000757397_100000210202 [0,1,0,0,0,0|2,0,0]=3 4832 B11R1.182 CCOc1cc(ccc1F)F 34a_100000752141_100000210202 [0,1,0,0,0,0|2,0,0]=3 4833 B11R1.182 CCOc1cc(ccc1F)F 7a_100000752141_100000210202 [0,1,0,0,0,0|2,0,0]=3 4834 B11R1.182 CCOc1cc(ccc1F)I 34a_100009958187_100000210202 [0,1,0,0,0,0|2,0,0]=3 4835 B11R1.182 CCOc1cc(ccc1F)I 7a_100009958187_100000210202 [0,1,0,0,0,0|2,0,0]=3 4836 B11R1.182 CCOc1cc(ccc1F)N 34a_100012017398_100000210202 [0,1,0,0,0,0|2,0,0]=3 4837 B11R1.182 CCOc1cc(ccc1F)N 7a_100012017398_100000210202 [0,1,0,0,0,0|2,0,0]=3 4838 B11R1.182 CCOc1cc(ccc1F)O 271570a_203496583355_200012344967 [0,1,0,0,0,0|2,0,0]=3 4839 B11R1.182 CCOc1cc(ccc1I)Br 34a_100012344904_100000210202 [0,1,0,0,0,0|2,0,0]=3 4840 B11R1.182 CCOc1cc(ccc1I)Br 7a_100012344904_100000210202 [0,1,0,0,0,0|2,0,0]=3 4841 B11R1.182 CCOc1cc(ccc1I)Cl 34a_100000050036_100000210202 [0,1,0,0,0,0|2,0,0]=3 4842 B11R1.182 CCOc1cc(ccc1I)Cl 7a_100000050036_100000210202 [0,1,0,0,0,0|2,0,0]=3 4843 B11R1.182 CCOc1cc(ccc1I)F 34a_100010084537_100000210202 [0,1,0,0,0,0|2,0,0]=3 4844 B11R1.182 CCOc1cc(ccc1I)F 7a_100010084537_100000210202 [0,1,0,0,0,0|2,0,0]=3 4845 B11R1.182 CCOc1cc(ccc1N)Br 34a_100000739049_100000210202 [0,1,0,0,0,0|2,0,0]=3 4846 B11R1.182 CCOc1cc(ccc1N)Br 7a_100000739049_100000210202 [0,1,0,0,0,0|2,0,0]=3 4847 B11R1.182 CCOc1cc(ccc1N)C 34a_100000211527_100000210202 [0,1,0,0,0,0|2,0,0]=3 4848 B11R1.182 CCOc1cc(ccc1N)C 7a_100000211527_100000210202 [0,1,0,0,0,0|2,0,0]=3 4849 B11R1.182 CCOc1cc(ccc1N)Cl 34a_100000185728_100000210202 [0,1,0,0,0,0|2,0,0]=3 4850 B11R1.182 CCOc1cc(ccc1N)Cl 7a_100000185728_100000210202 [0,1,0,0,0,0|2,0,0]=3 4851 B11R1.182 CCOc1cc(ccc1N)F 34a_100000753323_100000210202 [0,1,0,0,0,0|2,0,0]=3 4852 B11R1.182 CCOc1cc(ccc1N)F 7a_100000753323_100000210202 [0,1,0,0,0,0|2,0,0]=3 4853 B11R1.182 CCOc1cc(ccc1N)I 34a_100000057187_100000210202 [0,1,0,0,0,0|2,0,0]=3 4854 B11R1.182 CCOc1cc(ccc1N)I 7a_100000057187_100000210202 [0,1,0,0,0,0|2,0,0]=3 4855 B11R1.182 CCOc1cc(ccc1N)N 34a_100025717382_100000210202 [0,1,0,0,0,0|2,0,0]=3 4856 B11R1.182 CCOc1cc(ccc1N)O 271570a_203496583355_100000688918 [0,1,0,0,0,0|2,0,0]=3 4857 B11R1.182 CCOc1cc(ccc1O)C 271570a_203496583355_200010713166 [0,1,0,0,0,0|1,0,0]=2 4858 B11R1.182 CCOc1cc(ccc1O)F 271570a_203496583355_200012340411 [0,1,0,0,0,0|1,0,0]=2 4859 B11R1.182 CCOc1cc(ccc1O)N 271570a_203496583355_200016990551 [0,1,0,0,0,0|1,0,0]=2 4860 B11R1.182 CCOc1cc(cnc1Br)Cl 34a_100000697010_100000210202 [0,1,0,0,0,0|3,0,0]=4 4861 B11R1.182 CCOc1cc(cnc1Br)Cl 7a_100000697010_100000210202 [0,1,0,0,0,0|3,0,0]=4 4862 B11R1.182 CCOc1cc(cnc1Br)F 34a_100009820119_100000210202 [0,1,0,0,0,0|3,0,0]=4 4863 B11R1.182 CCOc1cc(cnc1Br)F 7a_100009820119_100000210202 [0,1,0,0,0,0|3,0,0]=4 4864 B11R1.182 CCOc1cc(cnc1C)Br 34a_100009864810_100000210202 [0,1,0,0,0,0|3,0,0]=4 4865 B11R1.182 CCOc1cc(cnc1C)Br 7a_100009864810_100000210202 [0,1,0,0,0,0|3,0,0]=4 4866 B11R1.182 CCOc1cc(cnc1Cl)Br 34a_100012354860_100000210202 [0,1,0,0,0,0|3,0,0]=4 4867 B11R1.182 CCOc1cc(cnc1Cl)Br 7a_100012354860_100000210202 [0,1,0,0,0,0|3,0,0]=4 4868 B11R1.182 CCOc1cc(cnc1Cl)C 34a_100012000487_100000210202 [0,1,0,0,0,0|3,0,0]=4 4869 B11R1.182 CCOc1cc(cnc1Cl)C 7a_100012000487_100000210202 [0,1,0,0,0,0|3,0,0]=4 4870 B11R1.182 CCOc1cc(cnc1Cl)F 34a_100000079967_100000210202 [0,1,0,0,0,0|3,0,0]=4 4871 B11R1.182 CCOc1cc(cnc1Cl)F 7a_100000079967_100000210202 [0,1,0,0,0,0|3,0,0]=4 4872 B11R1.182 CCOc1cc(cnc1F)Br 34a_100009819871_100000210202 [0,1,0,0,0,0|3,0,0]=4 4873 B11R1.182 CCOc1cc(cnc1F)Br 7a_100009819871_100000210202 [0,1,0,0,0,0|3,0,0]=4 4874 B11R1.182 CCOc1cc(cnc1F)C 34a_100009849810_100000210202 [0,1,0,0,0,0|3,0,0]=4 4875 B11R1.182 CCOc1cc(cnc1F)C 7a_100009849810_100000210202 [0,1,0,0,0,0|3,0,0]=4 4876 B11R1.182 CCOc1cc(cnc1F)Cl 34a_100000094372_100000210202 [0,1,0,0,0,0|3,0,0]=4 4877 B11R1.182 CCOc1cc(cnc1F)Cl 7a_100000094372_100000210202 [0,1,0,0,0,0|3,0,0]=4 4878 B11R1.182 CCOc1cc(cnc1F)O 271570a_203496583355_100010732568 [0,1,0,0,0,0|3,0,0]=4 4879 B11R1.182 CCOc1cc(cnc1I)Br 34a_100010210634_100000210202 [0,1,0,0,0,0|3,0,0]=4 4880 B11R1.182 CCOc1cc(cnc1I)Br 7a_100010210634_100000210202 [0,1,0,0,0,0|3,0,0]=4 4881 B11R1.182 CCOc1cc(cnc1I)Cl 34a_100010233512_100000210202 [0,1,0,0,0,0|3,0,0]=4 4882 B11R1.182 CCOc1cc(cnc1I)Cl 7a_100010233512_100000210202 [0,1,0,0,0,0|3,0,0]=4 4883 B11R1.182 CCOc1cc(cnc1I)F 34a_100015624800_100000210202 [0,1,0,0,0,0|3,0,0]=4 4884 B11R1.182 CCOc1cc(cnc1I)F 7a_100015624800_100000210202 [0,1,0,0,0,0|3,0,0]=4 4885 B11R1.182 CCOc1cc(cnc1N)Br 34a_100009819042_100000210202 [0,1,0,0,0,0|3,0,0]=4 4886 B11R1.182 CCOc1cc(cnc1N)Br 7a_100009819042_100000210202 [0,1,0,0,0,0|3,0,0]=4 4887 B11R1.182 CCOc1cc(cnc1N)Cl 34a_100000123674_100000210202 [0,1,0,0,0,0|3,0,0]=4 4888 B11R1.182 CCOc1cc(cnc1N)Cl 7a_100000123674_100000210202 [0,1,0,0,0,0|3,0,0]=4 4889 B11R1.182 CCOc1cc(cnc1N)F 34a_100000094369_100000210202 [0,1,0,0,0,0|3,0,0]=4 4890 B11R1.182 CCOc1cc(cnc1N)F 7a_100000094369_100000210202 [0,1,0,0,0,0|3,0,0]=4 4891 B11R1.182 CCOc1cc(ncc1Br)Br 34a_100010235016_100000210202 [0,1,0,0,0,0|3,0,0]=4 4892 B11R1.182 CCOc1cc(ncc1Br)C 34a_100011016184_100000210202 [0,1,0,0,0,0|3,0,0]=4 4893 B11R1.182 CCOc1cc(ncc1Br)Cl 34a_100010173860_100000210202 [0,1,0,0,0,0|3,0,0]=4 4894 B11R1.182 CCOc1cc(ncc1C)Br 34a_100000704368_100000210202 [0,1,0,0,0,0|3,0,0]=4 4895 B11R1.182 CCOc1cc(ncc1C)Br 7a_100000704368_100000210202 [0,1,0,0,0,0|3,0,0]=4 4896 B11R1.182 CCOc1cc(ncc1Cl)Br 34a_100010173861_100000210202 [0,1,0,0,0,0|3,0,0]=4 4897 B11R1.182 CCOc1cc(ncc1F)Br 34a_100009854642_100000210202 [0,1,0,0,0,0|3,0,0]=4 4898 B11R1.182 CCOc1cc(ncc1F)Cl 34a_100009851168_100000210202 [0,1,0,0,0,0|3,0,0]=4 4899 B11R1.182 CCOc1cc(ncc1N)O 271570a_203496583355_100015764953 [0,1,0,0,0,0|3,0,0]=4 4900 B11R1.182 CCOc1nc(ccc1Br)C 34a_100009817604_100000210202 [0,1,0,0,0,0|3,0,0]=4 4901 B11R1.182 CCOc1nc(ccc1F)Cl 34a_100010729010_100000210202 [0,1,0,0,0,0|3,0,0]=4 4902 B11R1.182 CCOc1nc(ccc1N)C 34a_100000687486_100000210202 [0,1,0,0,0,0|3,0,0]=4 4903 B11R1.182 CCSc1cc(=O)[nH]cc1F 62a_100000210202_100009817642 [0,1,0,0,0,0|3,0,0]=4 4904 B11R1.182 CCSc1cc(=O)[nH]cc1F 62a_100009817642_100000210202 [0,1,0,0,0,0|3,0,0]=4 4905 B11R1.182 CCSc1cc(c[nH]c1=O)F 62a_100000210202_100009817720 [0,1,0,0,0,0|2,0,1]=4 4906 B11R1.182 CCSc1cc(c[nH]c1=O)F 62a_100009817720_100000210202 [0,1,0,0,0,0|2,0,1]=4 4907 B11R1.182 CCSc1cc(ccc1Br)Br 62a_100000210202_100011483371 [0,1,0,0,0,0|2,0,0]=3 4908 B11R1.182 CCSc1cc(ccc1Br)Br 62a_100011483371_100000210202 [0,1,0,0,0,0|2,0,0]=3 4909 B11R1.182 CCSc1cc(ccc1Br)C 62a_100000210202_100012353751 [0,1,0,0,0,0|2,0,0]=3 4910 B11R1.182 CCSc1cc(ccc1Br)C 62a_100012353751_100000210202 [0,1,0,0,0,0|2,0,0]=3 4911 B11R1.182 CCSc1cc(ccc1Br)Cl 62a_100000210202_100012339723 [0,1,0,0,0,0|2,0,0]=3 4912 B11R1.182 CCSc1cc(ccc1Br)Cl 62a_100012339723_100000210202 [0,1,0,0,0,0|2,0,0]=3 4913 B11R1.182 CCSc1cc(ccc1Br)F 62a_100000210202_100011217576 [0,1,0,0,0,0|2,0,0]=3 4914 B11R1.182 CCSc1cc(ccc1Br)F 62a_100011217576_100000210202 [0,1,0,0,0,0|2,0,0]=3 4915 B11R1.182 CCSc1cc(ccc1Br)N 62a_100000210202_100000750459 [0,1,0,0,0,0|2,0,0]=3 4916 B11R1.182 CCSc1cc(ccc1Br)N 62a_100000750459_100000210202 [0,1,0,0,0,0|2,0,0]=3 4917 B11R1.182 CCSc1cc(ccc1Br)O 62a_100000210202_100012339312 [0,1,0,0,0,0|2,0,0]=3 4918 B11R1.182 CCSc1cc(ccc1Br)O 62a_100012339312_100000210202 [0,1,0,0,0,0|2,0,0]=3 4919 B11R1.182 CCSc1cc(ccc1C)Br 62a_100000210202_100011344865 [0,1,0,0,0,0|2,0,0]=3 4920 B11R1.182 CCSc1cc(ccc1C)Br 62a_100011344865_100000210202 [0,1,0,0,0,0|2,0,0]=3 4921 B11R1.182 CCSc1cc(ccc1C)C 62a_100000210202_100000210833 [0,1,0,0,0,0|2,0,0]=3 4922 B11R1.182 CCSc1cc(ccc1C)C 62a_100000210833_100000210202 [0,1,0,0,0,0|2,0,0]=3 4923 B11R1.182 CCSc1cc(ccc1C)Cl 62a_100000210202_100011263213 [0,1,0,0,0,0|2,0,0]=3 4924 B11R1.182 CCSc1cc(ccc1C)Cl 62a_100011263213_100000210202 [0,1,0,0,0,0|2,0,0]=3 4925 B11R1.182 CCSc1cc(ccc1C)F 62a_100000210202_100011218078 [0,1,0,0,0,0|2,0,0]=3 4926 B11R1.182 CCSc1cc(ccc1C)F 62a_100011218078_100000210202 [0,1,0,0,0,0|2,0,0]=3 4927 B11R1.182 CCSc1cc(ccc1C)N 62a_100000210202_100000736455 [0,1,0,0,0,0|2,0,0]=3 4928 B11R1.182 CCSc1cc(ccc1C)N 62a_100000736455_100000210202 [0,1,0,0,0,0|2,0,0]=3 4929 B11R1.182 CCSc1cc(ccc1C)O 62a_100000210202_100011380479 [0,1,0,0,0,0|2,0,0]=3 4930 B11R1.182 CCSc1cc(ccc1C)O 62a_100011380479_100000210202 [0,1,0,0,0,0|2,0,0]=3 4931 B11R1.182 CCSc1cc(ccc1Cl)Br 62a_100000210202_100011772130 [0,1,0,0,0,0|2,0,0]=3 4932 B11R1.182 CCSc1cc(ccc1Cl)Br 62a_100011772130_100000210202 [0,1,0,0,0,0|2,0,0]=3 4933 B11R1.182 CCSc1cc(ccc1Cl)C 62a_100000210202_100012356289 [0,1,0,0,0,0|2,0,0]=3 4934 B11R1.182 CCSc1cc(ccc1Cl)C 62a_100012356289_100000210202 [0,1,0,0,0,0|2,0,0]=3 4935 B11R1.182 CCSc1cc(ccc1Cl)Cl 62a_100000210202_100000707729 [0,1,0,0,0,0|2,0,0]=3 4936 B11R1.182 CCSc1cc(ccc1Cl)Cl 62a_100000707729_100000210202 [0,1,0,0,0,0|2,0,0]=3 4937 B11R1.182 CCSc1cc(ccc1Cl)F 62a_100000210202_100011217299 [0,1,0,0,0,0|2,0,0]=3 4938 B11R1.182 CCSc1cc(ccc1Cl)F 62a_100011217299_100000210202 [0,1,0,0,0,0|2,0,0]=3 4939 B11R1.182 CCSc1cc(ccc1Cl)N 62a_100000210202_100012360549 [0,1,0,0,0,0|2,0,0]=3 4940 B11R1.182 CCSc1cc(ccc1Cl)N 62a_100012360549_100000210202 [0,1,0,0,0,0|2,0,0]=3 4941 B11R1.182 CCSc1cc(ccc1Cl)O 62a_100000049588_100000210202 [0,1,0,0,0,0|2,0,0]=3 4942 B11R1.182 CCSc1cc(ccc1Cl)O 62a_100000210202_100000049588 [0,1,0,0,0,0|2,0,0]=3 4943 B11R1.182 CCSc1cc(ccc1F)Br 62a_100000210202_100011217312 [0,1,0,0,0,0|2,0,0]=3 4944 B11R1.182 CCSc1cc(ccc1F)Br 62a_100011217312_100000210202 [0,1,0,0,0,0|2,0,0]=3 4945 B11R1.182 CCSc1cc(ccc1F)C 62a_100000210202_100000736223 [0,1,0,0,0,0|2,0,0]=3 4946 B11R1.182 CCSc1cc(ccc1F)C 62a_100000736223_100000210202 [0,1,0,0,0,0|2,0,0]=3 4947 B11R1.182 CCSc1cc(ccc1F)Cl 62a_100000210202_100011218116 [0,1,0,0,0,0|2,0,0]=3 4948 B11R1.182 CCSc1cc(ccc1F)Cl 62a_100011218116_100000210202 [0,1,0,0,0,0|2,0,0]=3 4949 B11R1.182 CCSc1cc(ccc1F)F 62a_100000210202_100011219198 [0,1,0,0,0,0|2,0,0]=3 4950 B11R1.182 CCSc1cc(ccc1F)F 62a_100011219198_100000210202 [0,1,0,0,0,0|2,0,0]=3 4951 B11R1.182 CCSc1cc(ccc1F)N 62a_100000210202_100000760356 [0,1,0,0,0,0|2,0,0]=3 4952 B11R1.182 CCSc1cc(ccc1F)N 62a_100000760356_100000210202 [0,1,0,0,0,0|2,0,0]=3 4953 B11R1.182 CCSc1cc(ccc1F)O 62a_100000210202_100000693481 [0,1,0,0,0,0|2,0,0]=3 4954 B11R1.182 CCSc1cc(ccc1F)O 62a_100000693481_100000210202 [0,1,0,0,0,0|2,0,0]=3 4955 B11R1.182 CCSc1cc(ccc1N)Br 62a_100000187925_100000210202 [0,1,0,0,0,0|2,0,0]=3 4956 B11R1.182 CCSc1cc(ccc1N)Br 62a_100000210202_100000187925 [0,1,0,0,0,0|2,0,0]=3 4957 B11R1.182 CCSc1cc(ccc1N)C 62a_100000210202_100011356834 [0,1,0,0,0,0|2,0,0]=3 4958 B11R1.182 CCSc1cc(ccc1N)C 62a_100011356834_100000210202 [0,1,0,0,0,0|2,0,0]=3 4959 B11R1.182 CCSc1cc(ccc1N)Cl 62a_100000210202_100000761889 [0,1,0,0,0,0|2,0,0]=3 4960 B11R1.182 CCSc1cc(ccc1N)Cl 62a_100000761889_100000210202 [0,1,0,0,0,0|2,0,0]=3 4961 B11R1.182 CCSc1cc(ccc1N)F 62a_100000210202_100000760547 [0,1,0,0,0,0|2,0,0]=3 4962 B11R1.182 CCSc1cc(ccc1N)F 62a_100000760547_100000210202 [0,1,0,0,0,0|2,0,0]=3 4963 B11R1.182 CCSc1cc(ccc1N)N 62a_100000210202_100011534242 [0,1,0,0,0,0|2,0,0]=3 4964 B11R1.182 CCSc1cc(ccc1N)N 62a_100011534242_100000210202 [0,1,0,0,0,0|2,0,0]=3 4965 B11R1.182 CCSc1cc(ccc1N)O 62a_100000210202_100012001276 [0,1,0,0,0,0|2,0,0]=3 4966 B11R1.182 CCSc1cc(ccc1N)O 62a_100012001276_100000210202 [0,1,0,0,0,0|2,0,0]=3 4967 B11R1.182 CCSc1cc(ccc1O)Br 62a_100000210202_100012355227 [0,1,0,0,0,0|1,0,0]=2 4968 B11R1.182 CCSc1cc(ccc1O)Br 62a_100012355227_100000210202 [0,1,0,0,0,0|1,0,0]=2 4969 B11R1.182 CCSc1cc(ccc1O)C 62a_100000210202_100000765521 [0,1,0,0,0,0|1,0,0]=2 4970 B11R1.182 CCSc1cc(ccc1O)C 62a_100000765521_100000210202 [0,1,0,0,0,0|1,0,0]=2 4971 B11R1.182 CCSc1cc(ccc1O)Cl 62a_100000210202_100011356953 [0,1,0,0,0,0|1,0,0]=2 4972 B11R1.182 CCSc1cc(ccc1O)Cl 62a_100011356953_100000210202 [0,1,0,0,0,0|1,0,0]=2 4973 B11R1.182 CCSc1cc(ccc1O)F 62a_100000210202_100000211999 [0,1,0,0,0,0|1,0,0]=2 4974 B11R1.182 CCSc1cc(ccc1O)F 62a_100000211999_100000210202 [0,1,0,0,0,0|1,0,0]=2 4975 B11R1.182 CCSc1cc(ccc1O)N 62a_100000210202_100011534360 [0,1,0,0,0,0|1,0,0]=2 4976 B11R1.182 CCSc1cc(ccc1O)N 62a_100011534360_100000210202 [0,1,0,0,0,0|1,0,0]=2 4977 B11R1.182 CCSc1cc(ccc1O)O 62a_100000210202_100009813629 [0,1,0,0,0,0|1,0,0]=2 4978 B11R1.182 CCSc1cc(cnc1Br)N 62a_100000210202_100010201102 [0,1,0,0,0,0|3,0,0]=4 4979 B11R1.182 CCSc1cc(cnc1Br)N 62a_100010201102_100000210202 [0,1,0,0,0,0|3,0,0]=4 4980 B11R1.182 CCSc1cc(cnc1C)Br 62a_100000210202_200010090566 [0,1,0,0,0,0|3,0,0]=4 4981 B11R1.182 CCSc1cc(cnc1C)Br 62a_200010090566_100000210202 [0,1,0,0,0,0|3,0,0]=4 4982 B11R1.182 CCSc1cc(cnc1C)C 62a_100000210202_100009817436 [0,1,0,0,0,0|3,0,0]=4 4983 B11R1.182 CCSc1cc(cnc1C)C 62a_100009817436_100000210202 [0,1,0,0,0,0|3,0,0]=4 4984 B11R1.182 CCSc1cc(cnc1C)F 62a_100000210202_100009860710 [0,1,0,0,0,0|3,0,0]=4 4985 B11R1.182 CCSc1cc(cnc1C)F 62a_100009860710_100000210202 [0,1,0,0,0,0|3,0,0]=4 4986 B11R1.182 CCSc1cc(cnc1C)N 62a_100000210202_100011998591 [0,1,0,0,0,0|3,0,0]=4 4987 B11R1.182 CCSc1cc(cnc1C)N 62a_100011998591_100000210202 [0,1,0,0,0,0|3,0,0]=4 4988 B11R1.182 CCSc1cc(cnc1C)O 62a_100000210202_100009819603 [0,1,0,0,0,0|3,0,0]=4 4989 B11R1.182 CCSc1cc(cnc1C)O 62a_100009819603_100000210202 [0,1,0,0,0,0|3,0,0]=4 4990 B11R1.182 CCSc1cc(cnc1Cl)Br 62a_100000210202_100009814771 [0,1,0,0,0,0|3,0,0]=4 4991 B11R1.182 CCSc1cc(cnc1Cl)Br 62a_100009814771_100000210202 [0,1,0,0,0,0|3,0,0]=4 4992 B11R1.182 CCSc1cc(cnc1Cl)C 62a_100000210202_100010210167 [0,1,0,0,0,0|3,0,0]=4 4993 B11R1.182 CCSc1cc(cnc1Cl)C 62a_100010210167_100000210202 [0,1,0,0,0,0|3,0,0]=4 4994 B11R1.182 CCSc1cc(cnc1Cl)Cl 62a_100000210202_200000062399 [0,1,0,0,0,0|3,0,0]=4 4995 B11R1.182 CCSc1cc(cnc1Cl)Cl 62a_200000062399_100000210202 [0,1,0,0,0,0|3,0,0]=4 4996 B11R1.182 CCSc1cc(cnc1Cl)N 62a_100000210202_100010253917 [0,1,0,0,0,0|3,0,0]=4 4997 B11R1.182 CCSc1cc(cnc1Cl)N 62a_100010253917_100000210202 [0,1,0,0,0,0|3,0,0]=4 4998 B11R1.182 CCSc1cc(cnc1F)Br 62a_100000210202_100010172738 [0,1,0,0,0,0|3,0,0]=4 4999 B11R1.182 CCSc1cc(cnc1F)Br 62a_100010172738_100000210202 [0,1,0,0,0,0|3,0,0]=4 5000 B11R1.182 CCSc1cc(cnc1F)C 62a_100000049784_100000210202 [0,1,0,0,0,0|3,0,0]=4 5001 B11R1.182 CCSc1cc(cnc1F)C 62a_100000210202_100000049784 [0,1,0,0,0,0|3,0,0]=4 5002 B11R1.182 CCSc1cc(cnc1F)Cl 62a_100000210202_100010188783 [0,1,0,0,0,0|3,0,0]=4 5003 B11R1.182 CCSc1cc(cnc1F)Cl 62a_100010188783_100000210202 [0,1,0,0,0,0|3,0,0]=4 5004 B11R1.182 CCSc1cc(cnc1F)F 62a_100000210202_100009820768 [0,1,0,0,0,0|3,0,0]=4 5005 B11R1.182 CCSc1cc(cnc1F)F 62a_100009820768_100000210202 [0,1,0,0,0,0|3,0,0]=4 5006 B11R1.182 CCSc1cc(cnc1F)N 62a_100000210202_100009840397 [0,1,0,0,0,0|3,0,0]=4 5007 B11R1.182 CCSc1cc(cnc1F)N 62a_100009840397_100000210202 [0,1,0,0,0,0|3,0,0]=4 5008 B11R1.182 CCSc1cc(cnc1F)O 62a_100000210202_100009817267 [0,1,0,0,0,0|3,0,0]=4 5009 B11R1.182 CCSc1cc(cnc1F)O 62a_100009817267_100000210202 [0,1,0,0,0,0|3,0,0]=4 5010 B11R1.182 CCSc1cc(cnc1N)Br 62a_100000210202_100000760472 [0,1,0,0,0,0|3,0,0]=4 5011 B11R1.182 CCSc1cc(cnc1N)Br 62a_100000760472_100000210202 [0,1,0,0,0,0|3,0,0]=4 5012 B11R1.182 CCSc1cc(cnc1N)C 62a_100000049664_100000210202 [0,1,0,0,0,0|3,0,0]=4 5013 B11R1.182 CCSc1cc(cnc1N)C 62a_100000210202_100000049664 [0,1,0,0,0,0|3,0,0]=4 5014 B11R1.182 CCSc1cc(cnc1N)Cl 62a_100000050159_100000210202 [0,1,0,0,0,0|3,0,0]=4 5015 B11R1.182 CCSc1cc(cnc1N)Cl 62a_100000210202_100000050159 [0,1,0,0,0,0|3,0,0]=4 5016 B11R1.182 CCSc1cc(cnc1N)F 62a_100000210202_100009814671 [0,1,0,0,0,0|3,0,0]=4 5017 B11R1.182 CCSc1cc(cnc1N)F 62a_100009814671_100000210202 [0,1,0,0,0,0|3,0,0]=4 5018 B11R1.182 CCSc1cc(cnc1N)N 62a_100000210202_200011934315 [0,1,0,0,0,0|3,0,0]=4 5019 B11R1.182 CCSc1cc(cnc1N)N 62a_200011934315_100000210202 [0,1,0,0,0,0|3,0,0]=4 5020 B11R1.182 CCSc1cc(cnc1O)Br 62a_100000210202_100010197142 [0,1,0,0,0,0|2,0,0]=3 5021 B11R1.182 CCSc1cc(cnc1O)Br 62a_100010197142_100000210202 [0,1,0,0,0,0|2,0,0]=3 5022 B11R1.182 CCSc1cc(cnc1O)C 62a_100000210202_100000719714 [0,1,0,0,0,0|2,0,0]=3 5023 B11R1.182 CCSc1cc(cnc1O)C 62a_100000719714_100000210202 [0,1,0,0,0,0|2,0,0]=3 5024 B11R1.182 CCSc1cc(cnc1O)Cl 62a_100000210202_100010188700 [0,1,0,0,0,0|2,0,0]=3 5025 B11R1.182 CCSc1cc(cnc1O)Cl 62a_100010188700_100000210202 [0,1,0,0,0,0|2,0,0]=3 5026 B11R1.182 CCSc1cc(ncc1Br)Br 62a_100000210202_100010171693 [0,1,0,0,0,0|3,0,0]=4 5027 B11R1.182 CCSc1cc(ncc1Br)Br 62a_100010171693_100000210202 [0,1,0,0,0,0|3,0,0]=4 5028 B11R1.182 CCSc1cc(ncc1Br)Cl 62a_100000210202_100009815598 [0,1,0,0,0,0|3,0,0]=4 5029 B11R1.182 CCSc1cc(ncc1Br)Cl 62a_100009815598_100000210202 [0,1,0,0,0,0|3,0,0]=4 5030 B11R1.182 CCSc1cc(ncc1C)Br 62a_100000210202_100010067628 [0,1,0,0,0,0|3,0,0]=4 5031 B11R1.182 CCSc1cc(ncc1C)Br 62a_100010067628_100000210202 [0,1,0,0,0,0|3,0,0]=4 5032 B11R1.182 CCSc1cc(ncc1C)C 62a_100000210202_100009862788 [0,1,0,0,0,0|3,0,0]=4 5033 B11R1.182 CCSc1cc(ncc1C)C 62a_100009862788_100000210202 [0,1,0,0,0,0|3,0,0]=4 5034 B11R1.182 CCSc1cc(ncc1C)Cl 62a_100000210202_100010068021 [0,1,0,0,0,0|3,0,0]=4 5035 B11R1.182 CCSc1cc(ncc1C)Cl 62a_100010068021_100000210202 [0,1,0,0,0,0|3,0,0]=4 5036 B11R1.182 CCSc1cc(ncc1C)F 62a_100000049870_100000210202 [0,1,0,0,0,0|3,0,0]=4 5037 B11R1.182 CCSc1cc(ncc1C)F 62a_100000210202_100000049870 [0,1,0,0,0,0|3,0,0]=4 5038 B11R1.182 CCSc1cc(ncc1C)N 62a_100000210202_100009819938 [0,1,0,0,0,0|3,0,0]=4 5039 B11R1.182 CCSc1cc(ncc1C)N 62a_100009819938_100000210202 [0,1,0,0,0,0|3,0,0]=4 5040 B11R1.182 CCSc1cc(ncc1C)O 62a_100000210202_100009831917 [0,1,0,0,0,0|3,0,0]=4 5041 B11R1.182 CCSc1cc(ncc1C)O 62a_100009831917_100000210202 [0,1,0,0,0,0|3,0,0]=4 5042 B11R1.182 CCSc1cc(ncc1Cl)Br 62a_100000210202_100010223331 [0,1,0,0,0,0|3,0,0]=4 5043 B11R1.182 CCSc1cc(ncc1Cl)Br 62a_100010223331_100000210202 [0,1,0,0,0,0|3,0,0]=4 5044 B11R1.182 CCSc1cc(ncc1Cl)Cl 62a_100000210202_100010172835 [0,1,0,0,0,0|3,0,0]=4 5045 B11R1.182 CCSc1cc(ncc1Cl)Cl 62a_100010172835_100000210202 [0,1,0,0,0,0|3,0,0]=4 5046 B11R1.182 CCSc1cc(ncc1Cl)F 62a_100000210202_100009892587 [0,1,0,0,0,0|3,0,0]=4 5047 B11R1.182 CCSc1cc(ncc1Cl)F 62a_100009892587_100000210202 [0,1,0,0,0,0|3,0,0]=4 5048 B11R1.182 CCSc1cc(ncc1Cl)N 62a_100000210202_100010134119 [0,1,0,0,0,0|3,0,0]=4 5049 B11R1.182 CCSc1cc(ncc1Cl)N 62a_100010134119_100000210202 [0,1,0,0,0,0|3,0,0]=4 5050 B11R1.182 CCSc1cc(ncc1F)Br 62a_100000210202_100010193852 [0,1,0,0,0,0|3,0,0]=4 5051 B11R1.182 CCSc1cc(ncc1F)Br 62a_100010193852_100000210202 [0,1,0,0,0,0|3,0,0]=4 5052 B11R1.182 CCSc1cc(ncc1F)C 62a_100000210202_100009867690 [0,1,0,0,0,0|3,0,0]=4 5053 B11R1.182 CCSc1cc(ncc1F)C 62a_100009867690_100000210202 [0,1,0,0,0,0|3,0,0]=4 5054 B11R1.182 CCSc1cc(ncc1F)Cl 62a_100000210202_100000708277 [0,1,0,0,0,0|3,0,0]=4 5055 B11R1.182 CCSc1cc(ncc1F)Cl 62a_100000708277_100000210202 [0,1,0,0,0,0|3,0,0]=4 5056 B11R1.182 CCSc1cc(ncc1F)F 62a_100000210202_100010233071 [0,1,0,0,0,0|3,0,0]=4 5057 B11R1.182 CCSc1cc(ncc1F)F 62a_100010233071_100000210202 [0,1,0,0,0,0|3,0,0]=4 5058 B11R1.182 CCSc1cc(ncc1F)N 62a_100000210202_100015713587 [0,1,0,0,0,0|3,0,0]=4 5059 B11R1.182 CCSc1cc(ncc1F)N 62a_100015713587_100000210202 [0,1,0,0,0,0|3,0,0]=4 5060 B11R1.182 CCSc1cc(ncc1N)Cl 62a_100000050123_100000210202 [0,1,0,0,0,0|3,0,0]=4 5061 B11R1.182 CCSc1cc(ncc1N)Cl 62a_100000210202_100000050123 [0,1,0,0,0,0|3,0,0]=4 5062 B11R1.182 CCSc1cc(ncc1O)C 62a_100000210202_100009843476 [0,1,0,0,0,0|2,0,0]=3 5063 B11R1.182 CCSc1cc(ncc1O)C 62a_100009843476_100000210202 [0,1,0,0,0,0|2,0,0]=3 5064 B11R1.182 CCSc1cc(ncc1O)Cl 62a_100000210202_100000698892 [0,1,0,0,0,0|2,0,0]=3 5065 B11R1.182 CCSc1cc(ncc1O)Cl 62a_100000698892_100000210202 [0,1,0,0,0,0|2,0,0]=3 5066 B11R1.182 CCSc1cc(nnc1O)O 62a_100000210202_100000759565 [0,1,0,0,0,0|3,0,0]=4 5067 B11R1.182 CCSc1cn(ccc1=O)C 62a_100000210202_100010750718 [0,1,0,0,0,0|2,0,1]=4 5068 B11R1.182 CCSc1cn(ccc1=O)C 62a_100010750718_100000210202 [0,1,0,0,0,0|2,0,1]=4 5069 B11R1.182 CCSc1nc(ccc1Br)N 62a_100000210202_100010192275 [0,1,0,0,0,0|3,0,0]=4 5070 B11R1.182 CCSc1nc(ccc1Br)N 62a_100010192275_100000210202 [0,1,0,0,0,0|3,0,0]=4 5071 B11R1.182 CCSc1nc(ccc1C)C 62a_100000210202_100009854376 [0,1,0,0,0,0|3,0,0]=4 5072 B11R1.182 CCSc1nc(ccc1C)C 62a_100009854376_100000210202 [0,1,0,0,0,0|3,0,0]=4 5073 B11R1.182 CCSc1nc(ccc1C)N 62a_100000126722_100000210202 [0,1,0,0,0,0|3,0,0]=4 5074 B11R1.182 CCSc1nc(ccc1C)N 62a_100000210202_100000126722 [0,1,0,0,0,0|3,0,0]=4 5075 B11R1.182 CCSc1nc(ccc1F)C 62a_100000210202_100009817602 [0,1,0,0,0,0|3,0,0]=4 5076 B11R1.182 CCSc1nc(ccc1F)C 62a_100009817602_100000210202 [0,1,0,0,0,0|3,0,0]=4 5077 B11R1.182 CCSc1nc(ccc1F)Cl 62a_100000210202_100010136221 [0,1,0,0,0,0|3,0,0]=4 5078 B11R1.182 CCSc1nc(ccc1F)Cl 62a_100010136221_100000210202 [0,1,0,0,0,0|3,0,0]=4 5079 B11R1.182 CCSc1nc(ccc1F)F 62a_100000210202_100010997973 [0,1,0,0,0,0|3,0,0]=4 5080 B11R1.182 CCSc1nc(ccc1F)F 62a_100010997973_100000210202 [0,1,0,0,0,0|3,0,0]=4 5081 B11R1.182 CCSc1nc(ccc1F)N 62a_100000210202_100010892222 [0,1,0,0,0,0|3,0,0]=4 5082 B11R1.182 CCSc1nc(ccc1F)N 62a_100010892222_100000210202 [0,1,0,0,0,0|3,0,0]=4 5083 B11R1.182 CCSc1nc(ccc1N)Br 62a_100000210202_100010168765 [0,1,0,0,0,0|3,0,0]=4 5084 B11R1.182 CCSc1nc(ccc1N)Br 62a_100010168765_100000210202 [0,1,0,0,0,0|3,0,0]=4 5085 B11R1.182 CCSc1nc(ccc1N)C 62a_100000210202_100000685570 [0,1,0,0,0,0|3,0,0]=4 5086 B11R1.182 CCSc1nc(ccc1N)C 62a_100000685570_100000210202 [0,1,0,0,0,0|3,0,0]=4 5087 B11R1.182 CCSc1nc(ccc1N)Cl 62a_100000210202_100010233647 [0,1,0,0,0,0|3,0,0]=4 5088 B11R1.182 CCSc1nc(ccc1N)Cl 62a_100010233647_100000210202 [0,1,0,0,0,0|3,0,0]=4 5089 B11R1.182 CCSc1nc(ccc1N)F 62a_100000210202_100009879877 [0,1,0,0,0,0|3,0,0]=4 5090 B11R1.182 CCSc1nc(ccc1N)F 62a_100009879877_100000210202 [0,1,0,0,0,0|3,0,0]=4 5091 B11R1.182 CCSc1nc(ccc1N)N 62a_100000210202_200009884323 [0,1,0,0,0,0|3,0,0]=4 5092 B11R1.182 CCSc1nc(ccc1N)N 62a_200009884323_100000210202 [0,1,0,0,0,0|3,0,0]=4 5093 B11R1.182 CCSc1nc(ccc1O)Br 62a_100000210202_100010253912 [0,1,0,0,0,0|2,0,0]=3 5094 B11R1.182 CCSc1nc(ccc1O)Br 62a_100010253912_100000210202 [0,1,0,0,0,0|2,0,0]=3 5095 B11R1.182 CCSc1nc(ccc1O)C 62a_100000210202_100000702858 [0,1,0,0,0,0|2,0,0]=3 5096 B11R1.182 CCSc1nc(ccc1O)C 62a_100000702858_100000210202 [0,1,0,0,0,0|2,0,0]=3 5097 B11R1.182 CCSc1nc(ccc1O)Cl 62a_100000210202_100000696390 [0,1,0,0,0,0|2,0,0]=3 5098 B11R1.182 CCSc1nc(ccc1O)F 62a_100000210202_100010382442 [0,1,0,0,0,0|2,0,0]=3 5099 B11R1.182 CCSc1nc(ccc1O)F 62a_100010382442_100000210202 [0,1,0,0,0,0|2,0,0]=3 5100 B11R1.182 CNCc1cc(c[nH]c1=O)F 207a_100102657272_100000137007 [0,1,0,0,0,0|2,0,1]=4 5101 B11R1.182 CNCc1cc(c[nH]c1=O)F 270004a_106832991635_100000137007 [0,1,0,0,0,0|2,0,1]=4 5102 B11R1.182 CNCc1cc(ccc1Br)Br 207a_100102657272_100011266429 [0,1,0,0,0,0|2,0,0]=3 5103 B11R1.182 CNCc1cc(ccc1Br)Br 2230a_106832991635_100011982794 [0,1,0,0,0,0|2,0,0]=3 5104 B11R1.182 CNCc1cc(ccc1Br)Br 26a_100102657272_100011220040 [0,1,0,0,0,0|2,0,0]=3 5105 B11R1.182 CNCc1cc(ccc1Br)Br 270004a_106832991635_100011266429 [0,1,0,0,0,0|2,0,0]=3 5106 B11R1.182 CNCc1cc(ccc1Br)Br 34a_100000707832_200000210301 [0,1,0,0,0,0|2,0,0]=3 5107 B11R1.182 CNCc1cc(ccc1Br)Br 34a_100102657272_100011982794 [0,1,0,0,0,0|2,0,0]=3 5108 B11R1.182 CNCc1cc(ccc1Br)Br 7a_106832991635_100011982794 [0,1,0,0,0,0|2,0,0]=3 5109 B11R1.182 CNCc1cc(ccc1Br)C 207a_100102657272_100011551863 [0,1,0,0,0,0|2,0,0]=3 5110 B11R1.182 CNCc1cc(ccc1Br)C 26a_100102657272_100012002257 [0,1,0,0,0,0|2,0,0]=3 5111 B11R1.182 CNCc1cc(ccc1Br)C 270004a_106832991635_100011551863 [0,1,0,0,0,0|2,0,0]=3 5112 B11R1.182 CNCc1cc(ccc1Br)Cl 207a_100102657272_100000746314 [0,1,0,0,0,0|2,0,0]=3 5113 B11R1.182 CNCc1cc(ccc1Br)Cl 2230a_106832991635_100000733903 [0,1,0,0,0,0|2,0,0]=3 5114 B11R1.182 CNCc1cc(ccc1Br)Cl 26a_100102657272_100012339455 [0,1,0,0,0,0|2,0,0]=3 5115 B11R1.182 CNCc1cc(ccc1Br)Cl 270004a_106832991635_100000746314 [0,1,0,0,0,0|2,0,0]=3 5116 B11R1.182 CNCc1cc(ccc1Br)Cl 34a_100102657272_100000733903 [0,1,0,0,0,0|2,0,0]=3 5117 B11R1.182 CNCc1cc(ccc1Br)Cl 7a_106832991635_100000733903 [0,1,0,0,0,0|2,0,0]=3 5118 B11R1.182 CNCc1cc(ccc1Br)F 207a_100102657272_100000766564 [0,1,0,0,0,0|2,0,0]=3 5119 B11R1.182 CNCc1cc(ccc1Br)F 2230a_100000742738_200000210301 [0,1,0,0,0,0|2,0,0]=3 5120 B11R1.182 CNCc1cc(ccc1Br)F 2230a_106832991635_100000736370 [0,1,0,0,0,0|2,0,0]=3 5121 B11R1.182 CNCc1cc(ccc1Br)F 26a_100102657272_100000690578 [0,1,0,0,0,0|2,0,0]=3 5122 B11R1.182 CNCc1cc(ccc1Br)F 270004a_106832991635_100000766564 [0,1,0,0,0,0|2,0,0]=3 5123 B11R1.182 CNCc1cc(ccc1Br)F 34a_100000742738_200000210301 [0,1,0,0,0,0|2,0,0]=3 5124 B11R1.182 CNCc1cc(ccc1Br)F 34a_100102657272_100000736370 [0,1,0,0,0,0|2,0,0]=3 5125 B11R1.182 CNCc1cc(ccc1Br)F 7a_106832991635_100000736370 [0,1,0,0,0,0|2,0,0]=3 5126 B11R1.182 CNCc1cc(ccc1Br)I 207a_100102657272_100010185652 [0,1,0,0,0,0|2,0,0]=3 5127 B11R1.182 CNCc1cc(ccc1Br)I 2230a_106832991635_100012355412 [0,1,0,0,0,0|2,0,0]=3 5128 B11R1.182 CNCc1cc(ccc1Br)I 26a_100102657272_100012356990 [0,1,0,0,0,0|2,0,0]=3 5129 B11R1.182 CNCc1cc(ccc1Br)I 34a_100102657272_100012355412 [0,1,0,0,0,0|2,0,0]=3 5130 B11R1.182 CNCc1cc(ccc1Br)I 7a_106832991635_100012355412 [0,1,0,0,0,0|2,0,0]=3 5131 B11R1.182 CNCc1cc(ccc1C)Br 207a_100102657272_100011361606 [0,1,0,0,0,0|2,0,0]=3 5132 B11R1.182 CNCc1cc(ccc1C)Br 26a_100102657272_100000685420 [0,1,0,0,0,0|2,0,0]=3 5133 B11R1.182 CNCc1cc(ccc1C)Br 270004a_106832991635_100011361606 [0,1,0,0,0,0|2,0,0]=3 5134 B11R1.182 CNCc1cc(ccc1C)C 207a_100102657272_100000211343 [0,1,0,0,0,0|2,0,0]=3 5135 B11R1.182 CNCc1cc(ccc1C)C 2230a_106832991635_100000184699 [0,1,0,0,0,0|2,0,0]=3 5136 B11R1.182 CNCc1cc(ccc1C)C 270004a_106832991635_100000211343 [0,1,0,0,0,0|2,0,0]=3 5137 B11R1.182 CNCc1cc(ccc1C)C 34a_100000174964_200000210301 [0,1,0,0,0,0|2,0,0]=3 5138 B11R1.182 CNCc1cc(ccc1C)C 34a_100102657272_100000184699 [0,1,0,0,0,0|2,0,0]=3 5139 B11R1.182 CNCc1cc(ccc1C)C 7a_106832991635_100000184699 [0,1,0,0,0,0|2,0,0]=3 5140 B11R1.182 CNCc1cc(ccc1C)Cl 207a_100102657272_100011551331 [0,1,0,0,0,0|2,0,0]=3 5141 B11R1.182 CNCc1cc(ccc1C)Cl 2230a_106832991635_100012186985 [0,1,0,0,0,0|2,0,0]=3 5142 B11R1.182 CNCc1cc(ccc1C)Cl 270004a_106832991635_100011551331 [0,1,0,0,0,0|2,0,0]=3 5143 B11R1.182 CNCc1cc(ccc1C)Cl 34a_100000717755_200000210301 [0,1,0,0,0,0|2,0,0]=3 5144 B11R1.182 CNCc1cc(ccc1C)Cl 34a_100102657272_100012186985 [0,1,0,0,0,0|2,0,0]=3 5145 B11R1.182 CNCc1cc(ccc1C)Cl 7a_106832991635_100012186985 [0,1,0,0,0,0|2,0,0]=3 5146 B11R1.182 CNCc1cc(ccc1C)F 207a_100102657272_100000697687 [0,1,0,0,0,0|2,0,0]=3 5147 B11R1.182 CNCc1cc(ccc1C)F 2230a_106832991635_100000709795 [0,1,0,0,0,0|2,0,0]=3 5148 B11R1.182 CNCc1cc(ccc1C)F 270004a_106832991635_100000697687 [0,1,0,0,0,0|2,0,0]=3 5149 B11R1.182 CNCc1cc(ccc1C)F 34a_100011217291_200000210301 [0,1,0,0,0,0|2,0,0]=3 5150 B11R1.182 CNCc1cc(ccc1C)F 34a_100102657272_100000709795 [0,1,0,0,0,0|2,0,0]=3 5151 B11R1.182 CNCc1cc(ccc1C)F 7a_106832991635_100000709795 [0,1,0,0,0,0|2,0,0]=3 5152 B11R1.182 CNCc1cc(ccc1C)O 271570a_203496583355_106744473289 [0,1,0,0,0,0|2,0,0]=3 5153 B11R1.182 CNCc1cc(ccc1C)O 34a_200009844824_200000210301 [0,1,0,0,0,0|2,0,0]=3 5154 B11R1.182 CNCc1cc(ccc1Cl)Br 207a_100102657272_100000746309 [0,1,0,0,0,0|2,0,0]=3 5155 B11R1.182 CNCc1cc(ccc1Cl)Br 2230a_106832991635_100000763347 [0,1,0,0,0,0|2,0,0]=3 5156 B11R1.182 CNCc1cc(ccc1Cl)Br 26a_100102657272_100000738945 [0,1,0,0,0,0|2,0,0]=3 5157 B11R1.182 CNCc1cc(ccc1Cl)Br 270004a_106832991635_100000746309 [0,1,0,0,0,0|2,0,0]=3 5158 B11R1.182 CNCc1cc(ccc1Cl)Br 34a_100025772652_200000210301 [0,1,0,0,0,0|2,0,0]=3 5159 B11R1.182 CNCc1cc(ccc1Cl)Br 34a_100102657272_100000763347 [0,1,0,0,0,0|2,0,0]=3 5160 B11R1.182 CNCc1cc(ccc1Cl)Br 7a_106832991635_100000763347 [0,1,0,0,0,0|2,0,0]=3 5161 B11R1.182 CNCc1cc(ccc1Cl)C 207a_100102657272_100011551332 [0,1,0,0,0,0|2,0,0]=3 5162 B11R1.182 CNCc1cc(ccc1Cl)C 2230a_100025705715_200000210301 [0,1,0,0,0,0|2,0,0]=3 5163 B11R1.182 CNCc1cc(ccc1Cl)C 2230a_106832991635_100009871730 [0,1,0,0,0,0|2,0,0]=3 5164 B11R1.182 CNCc1cc(ccc1Cl)C 26a_100102657272_100000211493 [0,1,0,0,0,0|2,0,0]=3 5165 B11R1.182 CNCc1cc(ccc1Cl)C 270004a_106832991635_100011551332 [0,1,0,0,0,0|2,0,0]=3 5166 B11R1.182 CNCc1cc(ccc1Cl)C 34a_100025705715_200000210301 [0,1,0,0,0,0|2,0,0]=3 5167 B11R1.182 CNCc1cc(ccc1Cl)C 34a_100102657272_100009871730 [0,1,0,0,0,0|2,0,0]=3 5168 B11R1.182 CNCc1cc(ccc1Cl)C 7a_106832991635_100009871730 [0,1,0,0,0,0|2,0,0]=3 5169 B11R1.182 CNCc1cc(ccc1Cl)Cl 207a_100102657272_100000746308 [0,1,0,0,0,0|2,0,0]=3 5170 B11R1.182 CNCc1cc(ccc1Cl)Cl 2230a_106832991635_100000756322 [0,1,0,0,0,0|2,0,0]=3 5171 B11R1.182 CNCc1cc(ccc1Cl)Cl 26a_100102657272_100000211422 [0,1,0,0,0,0|2,0,0]=3 5172 B11R1.182 CNCc1cc(ccc1Cl)Cl 270004a_106832991635_100000746308 [0,1,0,0,0,0|2,0,0]=3 5173 B11R1.182 CNCc1cc(ccc1Cl)Cl 34a_100102657272_100000756322 [0,1,0,0,0,0|2,0,0]=3 5174 B11R1.182 CNCc1cc(ccc1Cl)Cl 34a_100102946428_200000210301 [0,1,0,0,0,0|2,0,0]=3 5175 B11R1.182 CNCc1cc(ccc1Cl)Cl 7a_106832991635_100000756322 [0,1,0,0,0,0|2,0,0]=3 5176 B11R1.182 CNCc1cc(ccc1Cl)F 207a_100102657272_100011218309 [0,1,0,0,0,0|2,0,0]=3 5177 B11R1.182 CNCc1cc(ccc1Cl)F 2230a_100011830483_200000210301 [0,1,0,0,0,0|2,0,0]=3 5178 B11R1.182 CNCc1cc(ccc1Cl)F 2230a_106832991635_100000709952 [0,1,0,0,0,0|2,0,0]=3 5179 B11R1.182 CNCc1cc(ccc1Cl)F 26a_100102657272_100000692107 [0,1,0,0,0,0|2,0,0]=3 5180 B11R1.182 CNCc1cc(ccc1Cl)F 270004a_106832991635_100011218309 [0,1,0,0,0,0|2,0,0]=3 5181 B11R1.182 CNCc1cc(ccc1Cl)F 34a_100011830483_200000210301 [0,1,0,0,0,0|2,0,0]=3 5182 B11R1.182 CNCc1cc(ccc1Cl)F 34a_100102657272_100000709952 [0,1,0,0,0,0|2,0,0]=3 5183 B11R1.182 CNCc1cc(ccc1Cl)F 7a_106832991635_100000709952 [0,1,0,0,0,0|2,0,0]=3 5184 B11R1.182 CNCc1cc(ccc1Cl)I 207a_100102657272_100010254384 [0,1,0,0,0,0|2,0,0]=3 5185 B11R1.182 CNCc1cc(ccc1Cl)I 2230a_106832991635_100010188191 [0,1,0,0,0,0|2,0,0]=3 5186 B11R1.182 CNCc1cc(ccc1Cl)I 34a_100102657272_100010188191 [0,1,0,0,0,0|2,0,0]=3 5187 B11R1.182 CNCc1cc(ccc1Cl)I 7a_106832991635_100010188191 [0,1,0,0,0,0|2,0,0]=3 5188 B11R1.182 CNCc1cc(ccc1F)Br 207a_100102657272_100000211465 [0,1,0,0,0,0|2,0,0]=3 5189 B11R1.182 CNCc1cc(ccc1F)Br 2230a_106832991635_100000736399 [0,1,0,0,0,0|2,0,0]=3 5190 B11R1.182 CNCc1cc(ccc1F)Br 26a_100102657272_100000686035 [0,1,0,0,0,0|2,0,0]=3 5191 B11R1.182 CNCc1cc(ccc1F)Br 270004a_106832991635_100000211465 [0,1,0,0,0,0|2,0,0]=3 5192 B11R1.182 CNCc1cc(ccc1F)Br 34a_100009815772_200000210301 [0,1,0,0,0,0|2,0,0]=3 5193 B11R1.182 CNCc1cc(ccc1F)Br 34a_100102657272_100000736399 [0,1,0,0,0,0|2,0,0]=3 5194 B11R1.182 CNCc1cc(ccc1F)Br 7a_106832991635_100000736399 [0,1,0,0,0,0|2,0,0]=3 5195 B11R1.182 CNCc1cc(ccc1F)C 207a_100102657272_100000756917 [0,1,0,0,0,0|2,0,0]=3 5196 B11R1.182 CNCc1cc(ccc1F)C 2230a_106832991635_100011260760 [0,1,0,0,0,0|2,0,0]=3 5197 B11R1.182 CNCc1cc(ccc1F)C 270004a_106832991635_100000756917 [0,1,0,0,0,0|2,0,0]=3 5198 B11R1.182 CNCc1cc(ccc1F)C 34a_100102657272_100011260760 [0,1,0,0,0,0|2,0,0]=3 5199 B11R1.182 CNCc1cc(ccc1F)C 34a_100102693586_200000210301 [0,1,0,0,0,0|2,0,0]=3 5200 B11R1.182 CNCc1cc(ccc1F)C 7a_106832991635_100011260760 [0,1,0,0,0,0|2,0,0]=3 5201 B11R1.182 CNCc1cc(ccc1F)Cl 207a_100102657272_100000745245 [0,1,0,0,0,0|2,0,0]=3 5202 B11R1.182 CNCc1cc(ccc1F)Cl 2230a_106832991635_100000716957 [0,1,0,0,0,0|2,0,0]=3 5203 B11R1.182 CNCc1cc(ccc1F)Cl 270004a_106832991635_100000745245 [0,1,0,0,0,0|2,0,0]=3 5204 B11R1.182 CNCc1cc(ccc1F)Cl 34a_100011211646_200000210301 [0,1,0,0,0,0|2,0,0]=3 5205 B11R1.182 CNCc1cc(ccc1F)Cl 34a_100102657272_100000716957 [0,1,0,0,0,0|2,0,0]=3 5206 B11R1.182 CNCc1cc(ccc1F)Cl 7a_106832991635_100000716957 [0,1,0,0,0,0|2,0,0]=3 5207 B11R1.182 CNCc1cc(ccc1F)F 207a_100102657272_100000740046 [0,1,0,0,0,0|2,0,0]=3 5208 B11R1.182 CNCc1cc(ccc1F)F 2230a_106832991635_100000741279 [0,1,0,0,0,0|2,0,0]=3 5209 B11R1.182 CNCc1cc(ccc1F)F 270004a_106832991635_100000740046 [0,1,0,0,0,0|2,0,0]=3 5210 B11R1.182 CNCc1cc(ccc1F)F 34a_100000752317_200000210301 [0,1,0,0,0,0|2,0,0]=3 5211 B11R1.182 CNCc1cc(ccc1F)F 34a_100102657272_100000741279 [0,1,0,0,0,0|2,0,0]=3 5212 B11R1.182 CNCc1cc(ccc1F)F 7a_106832991635_100000741279 [0,1,0,0,0,0|2,0,0]=3 5213 B11R1.182 CNCc1cc(ccc1F)I 207a_100102657272_100000050626 [0,1,0,0,0,0|2,0,0]=3 5214 B11R1.182 CNCc1cc(ccc1F)I 2230a_106832991635_200010149601 [0,1,0,0,0,0|2,0,0]=3 5215 B11R1.182 CNCc1cc(ccc1F)I 34a_100102657272_200010149601 [0,1,0,0,0,0|2,0,0]=3 5216 B11R1.182 CNCc1cc(ccc1F)I 7a_106832991635_200010149601 [0,1,0,0,0,0|2,0,0]=3 5217 B11R1.182 CNCc1cc(ccc1F)O 271570a_203496583355_100000748472 [0,1,0,0,0,0|2,0,0]=3 5218 B11R1.182 CNCc1cc(ccc1I)Br 207a_100102657272_100010185651 [0,1,0,0,0,0|2,0,0]=3 5219 B11R1.182 CNCc1cc(ccc1I)Br 2230a_106832991635_100012362523 [0,1,0,0,0,0|2,0,0]=3 5220 B11R1.182 CNCc1cc(ccc1I)Br 26a_100102657272_100012344904 [0,1,0,0,0,0|2,0,0]=3 5221 B11R1.182 CNCc1cc(ccc1I)Br 270004a_106832991635_100010185651 [0,1,0,0,0,0|2,0,0]=3 5222 B11R1.182 CNCc1cc(ccc1I)Br 34a_100102657272_100012362523 [0,1,0,0,0,0|2,0,0]=3 5223 B11R1.182 CNCc1cc(ccc1I)Br 7a_106832991635_100012362523 [0,1,0,0,0,0|2,0,0]=3 5224 B11R1.182 CNCc1cc(ccc1I)C 207a_100102657272_100010150105 [0,1,0,0,0,0|2,0,0]=3 5225 B11R1.182 CNCc1cc(ccc1I)C 270004a_106832991635_100010150105 [0,1,0,0,0,0|2,0,0]=3 5226 B11R1.182 CNCc1cc(ccc1I)Cl 207a_100102657272_100010254386 [0,1,0,0,0,0|2,0,0]=3 5227 B11R1.182 CNCc1cc(ccc1I)Cl 2230a_106832991635_100012348826 [0,1,0,0,0,0|2,0,0]=3 5228 B11R1.182 CNCc1cc(ccc1I)Cl 270004a_106832991635_100010254386 [0,1,0,0,0,0|2,0,0]=3 5229 B11R1.182 CNCc1cc(ccc1I)Cl 34a_100102657272_100012348826 [0,1,0,0,0,0|2,0,0]=3 5230 B11R1.182 CNCc1cc(ccc1I)Cl 7a_106832991635_100012348826 [0,1,0,0,0,0|2,0,0]=3 5231 B11R1.182 CNCc1cc(ccc1I)F 207a_100102657272_100010186294 [0,1,0,0,0,0|2,0,0]=3 5232 B11R1.182 CNCc1cc(ccc1I)F 2230a_106832991635_100010149606 [0,1,0,0,0,0|2,0,0]=3 5233 B11R1.182 CNCc1cc(ccc1I)F 270004a_106832991635_100010186294 [0,1,0,0,0,0|2,0,0]=3 5234 B11R1.182 CNCc1cc(ccc1I)F 34a_100102657272_100010149606 [0,1,0,0,0,0|2,0,0]=3 5235 B11R1.182 CNCc1cc(ccc1I)F 7a_106832991635_100010149606 [0,1,0,0,0,0|2,0,0]=3 5236 B11R1.182 CNCc1cc(ccc1O)Br 34a_100000730032_200000210301 [0,1,0,0,0,0|1,0,0]=2 5237 B11R1.182 CNCc1cc(ccc1O)Cl 34a_100000238540_200000210301 [0,1,0,0,0,0|1,0,0]=2 5238 B11R1.182 CNCc1cc(ccc1O)F 34a_100102657272_100010161318 [0,1,0,0,0,0|1,0,0]=2 5239 B11R1.182 CNCc1cc(ccc1O)F 7a_106832991635_100010161318 [0,1,0,0,0,0|1,0,0]=2 5240 B11R1.182 CNCc1cc(ccc1O)O 271570a_203496583355_100011602694 [0,1,0,0,0,0|1,0,0]=2 5241 B11R1.182 CNCc1cc(cnc1Br)Br 207a_100102657272_100010177830 [0,1,0,0,0,0|3,0,0]=4 5242 B11R1.182 CNCc1cc(cnc1Br)Br 2230a_106832991635_100010253922 [0,1,0,0,0,0|3,0,0]=4 5243 B11R1.182 CNCc1cc(cnc1Br)Br 34a_100102657272_100010253922 [0,1,0,0,0,0|3,0,0]=4 5244 B11R1.182 CNCc1cc(cnc1Br)Br 7a_106832991635_100010253922 [0,1,0,0,0,0|3,0,0]=4 5245 B11R1.182 CNCc1cc(cnc1Br)F 2230a_100010760786_200000210301 [0,1,0,0,0,0|3,0,0]=4 5246 B11R1.182 CNCc1cc(cnc1Br)F 34a_100010760786_200000210301 [0,1,0,0,0,0|3,0,0]=4 5247 B11R1.182 CNCc1cc(cnc1C)Cl 207a_100102657272_100000100030 [0,1,0,0,0,0|3,0,0]=4 5248 B11R1.182 CNCc1cc(cnc1C)Cl 270004a_106832991635_100000100030 [0,1,0,0,0,0|3,0,0]=4 5249 B11R1.182 CNCc1cc(cnc1Cl)Br 207a_100102657272_100009816941 [0,1,0,0,0,0|3,0,0]=4 5250 B11R1.182 CNCc1cc(cnc1Cl)Br 2230a_106832991635_100009816982 [0,1,0,0,0,0|3,0,0]=4 5251 B11R1.182 CNCc1cc(cnc1Cl)Br 34a_100102657272_100009816982 [0,1,0,0,0,0|3,0,0]=4 5252 B11R1.182 CNCc1cc(cnc1Cl)Br 7a_106832991635_100009816982 [0,1,0,0,0,0|3,0,0]=4 5253 B11R1.182 CNCc1cc(cnc1Cl)C 207a_100102657272_100000050350 [0,1,0,0,0,0|3,0,0]=4 5254 B11R1.182 CNCc1cc(cnc1Cl)Cl 207a_100102657272_100000086932 [0,1,0,0,0,0|3,0,0]=4 5255 B11R1.182 CNCc1cc(cnc1Cl)F 207a_100102657272_100000079965 [0,1,0,0,0,0|3,0,0]=4 5256 B11R1.182 CNCc1cc(cnc1F)C 207a_100102657272_100009854360 [0,1,0,0,0,0|3,0,0]=4 5257 B11R1.182 CNCc1cc(cnc1O)Br 207a_100102657272_100010064889 [0,1,0,0,0,0|2,0,0]=3 5258 B11R1.182 CNCc1cc(cnc1O)Br 270004a_106832991635_100010064889 [0,1,0,0,0,0|2,0,0]=3 5259 B11R1.182 CNCc1cc(ncc1Br)Br 270004a_106832991635_100010230906 [0,1,0,0,0,0|3,0,0]=4 5260 B11R1.182 CNCc1cc(ncc1Cl)Br 270004a_106832991635_100010214479 [0,1,0,0,0,0|3,0,0]=4 5261 B11R1.182 CNCc1cc(ncc1Cl)Cl 270004a_106832991635_100000050890 [0,1,0,0,0,0|3,0,0]=4 5262 B11R1.182 CNCc1cc(ncc1F)Br 270004a_106832991635_100000707870 [0,1,0,0,0,0|3,0,0]=4 5263 B11R1.182 CNCc1nc(ccc1Br)C 207a_100102657272_100010173661 [0,1,0,0,0,0|3,0,0]=4 5264 B11R1.182 CNCc1nc(ccc1Br)C 270004a_106832991635_100010173661 [0,1,0,0,0,0|3,0,0]=4 5265 B11R1.182 CNCc1nc(ccc1Br)Cl 270004a_106832991635_100000734296 [0,1,0,0,0,0|3,0,0]=4 5266 B11R1.182 CNCc1nc(ccc1Cl)C 2230a_106832991635_200009852033 [0,1,0,0,0,0|3,0,0]=4 5267 B11R1.182 CNCc1nc(ccc1Cl)C 34a_100102657272_200009852033 [0,1,0,0,0,0|3,0,0]=4 5268 B11R1.182 CNCc1nc(ccc1Cl)C 7a_106832991635_200009852033 [0,1,0,0,0,0|3,0,0]=4 5269 B11R1.182 CNCc1nc(ccc1Cl)Cl 2230a_106832991635_100000059412 [0,1,0,0,0,0|3,0,0]=4 5270 B11R1.182 CNCc1nc(ccc1Cl)Cl 270004a_106832991635_100011935248 [0,1,0,0,0,0|3,0,0]=4 5271 B11R1.182 CNCc1nc(ccc1Cl)Cl 34a_100102657272_100000059412 [0,1,0,0,0,0|3,0,0]=4 5272 B11R1.182 CNCc1nc(ccc1Cl)Cl 7a_106832991635_100000059412 [0,1,0,0,0,0|3,0,0]=4 5273 B11R1.182 CNCc1nc(ccc1F)Br 2230a_106832991635_100010065826 [0,1,0,0,0,0|3,0,0]=4 5274 B11R1.182 CNCc1nc(ccc1F)Br 270004a_106832991635_100009814804 [0,1,0,0,0,0|3,0,0]=4 5275 B11R1.182 CNCc1nc(ccc1F)Br 34a_100102657272_100010065826 [0,1,0,0,0,0|3,0,0]=4 5276 B11R1.182 CNCc1nc(ccc1F)Br 7a_106832991635_100010065826 [0,1,0,0,0,0|3,0,0]=4 5277 B11R1.182 CNCc1nc(ccc1F)Cl 2230a_100009887702_200000210301 [0,1,0,0,0,0|3,0,0]=4 5278 B11R1.182 CNCc1nc(ccc1F)Cl 2230a_106832991635_100009881012 [0,1,0,0,0,0|3,0,0]=4 5279 B11R1.182 CNCc1nc(ccc1F)Cl 270004a_106832991635_100000050918 [0,1,0,0,0,0|3,0,0]=4 5280 B11R1.182 CNCc1nc(ccc1F)Cl 34a_100009887702_200000210301 [0,1,0,0,0,0|3,0,0]=4 5281 B11R1.182 CNCc1nc(ccc1F)Cl 34a_100102657272_100009881012 [0,1,0,0,0,0|3,0,0]=4 5282 B11R1.182 CNCc1nc(ccc1F)Cl 7a_106832991635_100009881012 [0,1,0,0,0,0|3,0,0]=4 5283 B11R1.182 CNCc1nc(ccc1O)C 2230a_106832991635_100020630696 [0,1,0,0,0,0|2,0,0]=3 5284 B11R1.182 CNCc1nc(ccc1O)C 34a_100102657272_100020630696 [0,1,0,0,0,0|2,0,0]=3 5285 B11R1.182 CNCc1nc(ccc1O)C 7a_106832991635_100020630696 [0,1,0,0,0,0|2,0,0]=3 5286 B11R1.182 COCc1cc(ccc1Br)Br 34a_100011266457_200000210301 [0,1,0,0,0,0|2,0,0]=3 5287 B11R1.182 COCc1cc(ccc1Br)Br 34a_100138415774_100011982794 [0,1,0,0,0,0|2,0,0]=3 5288 B11R1.182 COCc1cc(ccc1Br)Br 7a_100011266457_200000210301 [0,1,0,0,0,0|2,0,0]=3 5289 B11R1.182 COCc1cc(ccc1Br)C 34a_100012361352_200000210301 [0,1,0,0,0,0|2,0,0]=3 5290 B11R1.182 COCc1cc(ccc1Br)C 7a_100012361352_200000210301 [0,1,0,0,0,0|2,0,0]=3 5291 B11R1.182 COCc1cc(ccc1Br)Cl 34a_100012355668_200000210301 [0,1,0,0,0,0|2,0,0]=3 5292 B11R1.182 COCc1cc(ccc1Br)Cl 34a_100138415774_100000733903 [0,1,0,0,0,0|2,0,0]=3 5293 B11R1.182 COCc1cc(ccc1Br)Cl 7a_100012355668_200000210301 [0,1,0,0,0,0|2,0,0]=3 5294 B11R1.182 COCc1cc(ccc1Br)F 34a_100011217561_200000210301 [0,1,0,0,0,0|2,0,0]=3 5295 B11R1.182 COCc1cc(ccc1Br)F 34a_100138415774_100000736370 [0,1,0,0,0,0|2,0,0]=3 5296 B11R1.182 COCc1cc(ccc1Br)F 7a_100011217561_200000210301 [0,1,0,0,0,0|2,0,0]=3 5297 B11R1.182 COCc1cc(ccc1Br)I 34a_100138415774_100012355412 [0,1,0,0,0,0|2,0,0]=3 5298 B11R1.182 COCc1cc(ccc1Br)I 7a_100012359683_200000210301 [0,1,0,0,0,0|2,0,0]=3 5299 B11R1.182 COCc1cc(ccc1Br)N 34a_100012347228_200000210301 [0,1,0,0,0,0|2,0,0]=3 5300 B11R1.182 COCc1cc(ccc1Br)O 271570a_203496583355_202125822959 [0,1,0,0,0,0|2,0,0]=3 5301 B11R1.182 COCc1cc(ccc1C)Br 34a_100000700630_200000210301 [0,1,0,0,0,0|2,0,0]=3 5302 B11R1.182 COCc1cc(ccc1C)Br 7a_100000700630_200000210301 [0,1,0,0,0,0|2,0,0]=3 5303 B11R1.182 COCc1cc(ccc1C)C 34a_100138415774_100000184699 [0,1,0,0,0,0|2,0,0]=3 5304 B11R1.182 COCc1cc(ccc1C)C 34a_200011215349_200000210301 [0,1,0,0,0,0|2,0,0]=3 5305 B11R1.182 COCc1cc(ccc1C)C 7a_200011215349_200000210301 [0,1,0,0,0,0|2,0,0]=3 5306 B11R1.182 COCc1cc(ccc1C)Cl 34a_100012002407_200000210301 [0,1,0,0,0,0|2,0,0]=3 5307 B11R1.182 COCc1cc(ccc1C)Cl 34a_100138415774_100012186985 [0,1,0,0,0,0|2,0,0]=3 5308 B11R1.182 COCc1cc(ccc1C)Cl 7a_100012002407_200000210301 [0,1,0,0,0,0|2,0,0]=3 5309 B11R1.182 COCc1cc(ccc1C)F 34a_100011219218_200000210301 [0,1,0,0,0,0|2,0,0]=3 5310 B11R1.182 COCc1cc(ccc1C)F 34a_100138415774_100000709795 [0,1,0,0,0,0|2,0,0]=3 5311 B11R1.182 COCc1cc(ccc1C)F 7a_100011219218_200000210301 [0,1,0,0,0,0|2,0,0]=3 5312 B11R1.182 COCc1cc(ccc1C)I 34a_100010150140_200000210301 [0,1,0,0,0,0|2,0,0]=3 5313 B11R1.182 COCc1cc(ccc1C)I 7a_100010150140_200000210301 [0,1,0,0,0,0|2,0,0]=3 5314 B11R1.182 COCc1cc(ccc1Cl)Br 34a_100011215897_200000210301 [0,1,0,0,0,0|2,0,0]=3 5315 B11R1.182 COCc1cc(ccc1Cl)Br 34a_100138415774_100000763347 [0,1,0,0,0,0|2,0,0]=3 5316 B11R1.182 COCc1cc(ccc1Cl)Br 7a_100011215897_200000210301 [0,1,0,0,0,0|2,0,0]=3 5317 B11R1.182 COCc1cc(ccc1Cl)C 34a_100009878994_200000210301 [0,1,0,0,0,0|2,0,0]=3 5318 B11R1.182 COCc1cc(ccc1Cl)C 34a_100138415774_100009871730 [0,1,0,0,0,0|2,0,0]=3 5319 B11R1.182 COCc1cc(ccc1Cl)C 7a_100009878994_200000210301 [0,1,0,0,0,0|2,0,0]=3 5320 B11R1.182 COCc1cc(ccc1Cl)Cl 34a_100000698905_200000210301 [0,1,0,0,0,0|2,0,0]=3 5321 B11R1.182 COCc1cc(ccc1Cl)Cl 34a_100138415774_100000756322 [0,1,0,0,0,0|2,0,0]=3 5322 B11R1.182 COCc1cc(ccc1Cl)Cl 7a_100000698905_200000210301 [0,1,0,0,0,0|2,0,0]=3 5323 B11R1.182 COCc1cc(ccc1Cl)F 34a_100011218361_200000210301 [0,1,0,0,0,0|2,0,0]=3 5324 B11R1.182 COCc1cc(ccc1Cl)F 34a_100138415774_100000709952 [0,1,0,0,0,0|2,0,0]=3 5325 B11R1.182 COCc1cc(ccc1Cl)F 7a_100011218361_200000210301 [0,1,0,0,0,0|2,0,0]=3 5326 B11R1.182 COCc1cc(ccc1Cl)I 34a_100010128486_200000210301 [0,1,0,0,0,0|2,0,0]=3 5327 B11R1.182 COCc1cc(ccc1Cl)I 34a_100138415774_100010188191 [0,1,0,0,0,0|2,0,0]=3 5328 B11R1.182 COCc1cc(ccc1Cl)I 7a_100010128486_200000210301 [0,1,0,0,0,0|2,0,0]=3 5329 B11R1.182 COCc1cc(ccc1Cl)N 34a_100011273577_200000210301 [0,1,0,0,0,0|2,0,0]=3 5330 B11R1.182 COCc1cc(ccc1F)Br 34a_100000246282_200000210301 [0,1,0,0,0,0|2,0,0]=3 5331 B11R1.182 COCc1cc(ccc1F)Br 34a_100138415774_100000736399 [0,1,0,0,0,0|2,0,0]=3 5332 B11R1.182 COCc1cc(ccc1F)Br 7a_100000246282_200000210301 [0,1,0,0,0,0|2,0,0]=3 5333 B11R1.182 COCc1cc(ccc1F)C 34a_100011692775_200000210301 [0,1,0,0,0,0|2,0,0]=3 5334 B11R1.182 COCc1cc(ccc1F)C 34a_100138415774_100011260760 [0,1,0,0,0,0|2,0,0]=3 5335 B11R1.182 COCc1cc(ccc1F)C 7a_100011692775_200000210301 [0,1,0,0,0,0|2,0,0]=3 5336 B11R1.182 COCc1cc(ccc1F)Cl 34a_100011217248_200000210301 [0,1,0,0,0,0|2,0,0]=3 5337 B11R1.182 COCc1cc(ccc1F)Cl 34a_100138415774_100000716957 [0,1,0,0,0,0|2,0,0]=3 5338 B11R1.182 COCc1cc(ccc1F)Cl 7a_100011217248_200000210301 [0,1,0,0,0,0|2,0,0]=3 5339 B11R1.182 COCc1cc(ccc1F)F 34a_100011217725_200000210301 [0,1,0,0,0,0|2,0,0]=3 5340 B11R1.182 COCc1cc(ccc1F)F 34a_100138415774_100000741279 [0,1,0,0,0,0|2,0,0]=3 5341 B11R1.182 COCc1cc(ccc1F)F 7a_100011217725_200000210301 [0,1,0,0,0,0|2,0,0]=3 5342 B11R1.182 COCc1cc(ccc1F)I 34a_100000049604_200000210301 [0,1,0,0,0,0|2,0,0]=3 5343 B11R1.182 COCc1cc(ccc1F)I 34a_100138415774_200010149601 [0,1,0,0,0,0|2,0,0]=3 5344 B11R1.182 COCc1cc(ccc1F)I 7a_100000049604_200000210301 [0,1,0,0,0,0|2,0,0]=3 5345 B11R1.182 COCc1cc(ccc1F)N 34a_100011218011_200000210301 [0,1,0,0,0,0|2,0,0]=3 5346 B11R1.182 COCc1cc(ccc1F)O 271570a_203496583355_100010140362 [0,1,0,0,0,0|2,0,0]=3 5347 B11R1.182 COCc1cc(ccc1I)Br 34a_100011356890_200000210301 [0,1,0,0,0,0|2,0,0]=3 5348 B11R1.182 COCc1cc(ccc1I)Br 34a_100138415774_100012362523 [0,1,0,0,0,0|2,0,0]=3 5349 B11R1.182 COCc1cc(ccc1I)Br 7a_100011356890_200000210301 [0,1,0,0,0,0|2,0,0]=3 5350 B11R1.182 COCc1cc(ccc1I)Cl 34a_100138415774_100012348826 [0,1,0,0,0,0|2,0,0]=3 5351 B11R1.182 COCc1cc(ccc1I)F 34a_100010255287_200000210301 [0,1,0,0,0,0|2,0,0]=3 5352 B11R1.182 COCc1cc(ccc1I)F 34a_100138415774_100010149606 [0,1,0,0,0,0|2,0,0]=3 5353 B11R1.182 COCc1cc(ccc1I)F 7a_100010255287_200000210301 [0,1,0,0,0,0|2,0,0]=3 5354 B11R1.182 COCc1cc(ccc1N)Br 34a_100012353972_200000210301 [0,1,0,0,0,0|2,0,0]=3 5355 B11R1.182 COCc1cc(ccc1N)Br 7a_100012353972_200000210301 [0,1,0,0,0,0|2,0,0]=3 5356 B11R1.182 COCc1cc(ccc1N)C 34a_100011215565_200000210301 [0,1,0,0,0,0|2,0,0]=3 5357 B11R1.182 COCc1cc(ccc1N)C 7a_100011215565_200000210301 [0,1,0,0,0,0|2,0,0]=3 5358 B11R1.182 COCc1cc(ccc1N)Cl 34a_100011214999_200000210301 [0,1,0,0,0,0|2,0,0]=3 5359 B11R1.182 COCc1cc(ccc1N)Cl 7a_100011214999_200000210301 [0,1,0,0,0,0|2,0,0]=3 5360 B11R1.182 COCc1cc(ccc1N)F 34a_100011296978_200000210301 [0,1,0,0,0,0|2,0,0]=3 5361 B11R1.182 COCc1cc(ccc1N)F 7a_100011296978_200000210301 [0,1,0,0,0,0|2,0,0]=3 5362 B11R1.182 COCc1cc(ccc1O)F 34a_100138415774_100010161318 [0,1,0,0,0,0|1,0,0]=2 5363 B11R1.182 COCc1cc(cnc1Br)Br 34a_100138415774_100010253922 [0,1,0,0,0,0|3,0,0]=4 5364 B11R1.182 COCc1cc(cnc1Br)Cl 34a_200010065233_200000210301 [0,1,0,0,0,0|3,0,0]=4 5365 B11R1.182 COCc1cc(cnc1Br)Cl 7a_200010065233_200000210301 [0,1,0,0,0,0|3,0,0]=4 5366 B11R1.182 COCc1cc(cnc1C)Br 34a_100010894652_200000210301 [0,1,0,0,0,0|3,0,0]=4 5367 B11R1.182 COCc1cc(cnc1C)Br 7a_100010894652_200000210301 [0,1,0,0,0,0|3,0,0]=4 5368 B11R1.182 COCc1cc(cnc1Cl)Br 34a_100000734252_200000210301 [0,1,0,0,0,0|3,0,0]=4 5369 B11R1.182 COCc1cc(cnc1Cl)Br 34a_100138415774_100009816982 [0,1,0,0,0,0|3,0,0]=4 5370 B11R1.182 COCc1cc(cnc1Cl)Br 7a_100000734252_200000210301 [0,1,0,0,0,0|3,0,0]=4 5371 B11R1.182 COCc1cc(cnc1Cl)C 34a_100000118064_200000210301 [0,1,0,0,0,0|3,0,0]=4 5372 B11R1.182 COCc1cc(cnc1Cl)C 7a_100000118064_200000210301 [0,1,0,0,0,0|3,0,0]=4 5373 B11R1.182 COCc1cc(cnc1Cl)Cl 34a_100000084153_200000210301 [0,1,0,0,0,0|3,0,0]=4 5374 B11R1.182 COCc1cc(cnc1Cl)Cl 7a_100000084153_200000210301 [0,1,0,0,0,0|3,0,0]=4 5375 B11R1.182 COCc1cc(cnc1Cl)F 34a_100000079972_200000210301 [0,1,0,0,0,0|3,0,0]=4 5376 B11R1.182 COCc1cc(cnc1Cl)F 7a_100000079972_200000210301 [0,1,0,0,0,0|3,0,0]=4 5377 B11R1.182 COCc1cc(cnc1F)Br 34a_100010202234_200000210301 [0,1,0,0,0,0|3,0,0]=4 5378 B11R1.182 COCc1cc(cnc1F)Br 7a_100010202234_200000210301 [0,1,0,0,0,0|3,0,0]=4 5379 B11R1.182 COCc1cc(cnc1F)Cl 34a_200000081815_200000210301 [0,1,0,0,0,0|3,0,0]=4 5380 B11R1.182 COCc1cc(cnc1F)Cl 7a_200000081815_200000210301 [0,1,0,0,0,0|3,0,0]=4 5381 B11R1.182 COCc1cc(cnc1N)Br 34a_100011934449_200000210301 [0,1,0,0,0,0|3,0,0]=4 5382 B11R1.182 COCc1cc(cnc1N)Br 7a_100011934449_200000210301 [0,1,0,0,0,0|3,0,0]=4 5383 B11R1.182 COCc1cc(ncc1Br)Br 34a_100010245045_200000210301 [0,1,0,0,0,0|3,0,0]=4 5384 B11R1.182 COCc1cc(ncc1Br)Br 7a_100010245045_200000210301 [0,1,0,0,0,0|3,0,0]=4 5385 B11R1.182 COCc1cc(ncc1Br)C 34a_100015579599_200000210301 [0,1,0,0,0,0|3,0,0]=4 5386 B11R1.182 COCc1cc(ncc1Br)Cl 34a_100010245067_200000210301 [0,1,0,0,0,0|3,0,0]=4 5387 B11R1.182 COCc1cc(ncc1Br)Cl 7a_100010245067_200000210301 [0,1,0,0,0,0|3,0,0]=4 5388 B11R1.182 COCc1cc(ncc1Cl)Cl 34a_100000081519_200000210301 [0,1,0,0,0,0|3,0,0]=4 5389 B11R1.182 COCc1cc(ncc1Cl)Cl 7a_100000081519_200000210301 [0,1,0,0,0,0|3,0,0]=4 5390 B11R1.182 COCc1cc(ncc1F)Cl 34a_100000081974_200000210301 [0,1,0,0,0,0|3,0,0]=4 5391 B11R1.182 COCc1cc(ncc1F)Cl 7a_100000081974_200000210301 [0,1,0,0,0,0|3,0,0]=4 5392 B11R1.182 COCc1cc(ncc1F)F 34a_100000730792_200000210301 [0,1,0,0,0,0|3,0,0]=4 5393 B11R1.182 COCc1cc(ncc1F)F 7a_100000730792_200000210301 [0,1,0,0,0,0|3,0,0]=4 5394 B11R1.182 COCc1nc(ccc1Br)Br 34a_200010065229_200000210301 [0,1,0,0,0,0|3,0,0]=4 5395 B11R1.182 COCc1nc(ccc1Br)Br 7a_200010065229_200000210301 [0,1,0,0,0,0|3,0,0]=4 5396 B11R1.182 COCc1nc(ccc1Br)C 34a_100010074375_200000210301 [0,1,0,0,0,0|3,0,0]=4 5397 B11R1.182 COCc1nc(ccc1Br)Cl 34a_100010244999_200000210301 [0,1,0,0,0,0|3,0,0]=4 5398 B11R1.182 COCc1nc(ccc1Br)F 34a_100000701195_200000210301 [0,1,0,0,0,0|3,0,0]=4 5399 B11R1.182 COCc1nc(ccc1Cl)C 34a_100138415774_200009852033 [0,1,0,0,0,0|3,0,0]=4 5400 B11R1.182 COCc1nc(ccc1Cl)Cl 34a_100000749784_200000210301 [0,1,0,0,0,0|3,0,0]=4 5401 B11R1.182 COCc1nc(ccc1Cl)Cl 34a_100138415774_100000059412 [0,1,0,0,0,0|3,0,0]=4 5402 B11R1.182 COCc1nc(ccc1F)Br 34a_100138415774_100010065826 [0,1,0,0,0,0|3,0,0]=4 5403 B11R1.182 COCc1nc(ccc1F)Cl 34a_100138415774_100009881012 [0,1,0,0,0,0|3,0,0]=4 5404 B11R1.182 COCc1nc(ccc1O)C 34a_100138415774_100020630696 [0,1,0,0,0,0|2,0,0]=3 5405 B11R1.182 CSCc1cc(ccc1Br)Br 62a_100011982794_200000210301 [0,1,0,0,0,0|2,0,0]=3 5406 B11R1.182 CSCc1cc(ccc1Br)Br 62a_200000210301_100011982794 [0,1,0,0,0,0|2,0,0]=3 5407 B11R1.182 CSCc1cc(ccc1Br)Cl 62a_100000733903_200000210301 [0,1,0,0,0,0|2,0,0]=3 5408 B11R1.182 CSCc1cc(ccc1Br)Cl 62a_200000210301_100000733903 [0,1,0,0,0,0|2,0,0]=3 5409 B11R1.182 CSCc1cc(ccc1Br)F 62a_100000736370_200000210301 [0,1,0,0,0,0|2,0,0]=3 5410 B11R1.182 CSCc1cc(ccc1Br)F 62a_200000210301_100000736370 [0,1,0,0,0,0|2,0,0]=3 5411 B11R1.182 CSCc1cc(ccc1Br)I 62a_100012355412_200000210301 [0,1,0,0,0,0|2,0,0]=3 5412 B11R1.182 CSCc1cc(ccc1Br)I 62a_200000210301_100012355412 [0,1,0,0,0,0|2,0,0]=3 5413 B11R1.182 CSCc1cc(ccc1C)C 62a_100000184699_200000210301 [0,1,0,0,0,0|2,0,0]=3 5414 B11R1.182 CSCc1cc(ccc1C)C 62a_200000210301_100000184699 [0,1,0,0,0,0|2,0,0]=3 5415 B11R1.182 CSCc1cc(ccc1C)Cl 62a_100012186985_200000210301 [0,1,0,0,0,0|2,0,0]=3 5416 B11R1.182 CSCc1cc(ccc1C)Cl 62a_200000210301_100012186985 [0,1,0,0,0,0|2,0,0]=3 5417 B11R1.182 CSCc1cc(ccc1C)F 62a_100000709795_200000210301 [0,1,0,0,0,0|2,0,0]=3 5418 B11R1.182 CSCc1cc(ccc1C)F 62a_200000210301_100000709795 [0,1,0,0,0,0|2,0,0]=3 5419 B11R1.182 CSCc1cc(ccc1Cl)Br 62a_100000763347_200000210301 [0,1,0,0,0,0|2,0,0]=3 5420 B11R1.182 CSCc1cc(ccc1Cl)Br 62a_200000210301_100000763347 [0,1,0,0,0,0|2,0,0]=3 5421 B11R1.182 CSCc1cc(ccc1Cl)C 62a_100009871730_200000210301 [0,1,0,0,0,0|2,0,0]=3 5422 B11R1.182 CSCc1cc(ccc1Cl)C 62a_200000210301_100009871730 [0,1,0,0,0,0|2,0,0]=3 5423 B11R1.182 CSCc1cc(ccc1Cl)Cl 62a_100000756322_200000210301 [0,1,0,0,0,0|2,0,0]=3 5424 B11R1.182 CSCc1cc(ccc1Cl)Cl 62a_200000210301_100000756322 [0,1,0,0,0,0|2,0,0]=3 5425 B11R1.182 CSCc1cc(ccc1Cl)F 62a_100000709952_200000210301 [0,1,0,0,0,0|2,0,0]=3 5426 B11R1.182 CSCc1cc(ccc1Cl)F 62a_200000210301_100000709952 [0,1,0,0,0,0|2,0,0]=3 5427 B11R1.182 CSCc1cc(ccc1Cl)I 62a_100010188191_200000210301 [0,1,0,0,0,0|2,0,0]=3 5428 B11R1.182 CSCc1cc(ccc1Cl)I 62a_200000210301_100010188191 [0,1,0,0,0,0|2,0,0]=3 5429 B11R1.182 CSCc1cc(ccc1F)Br 62a_100000736399_200000210301 [0,1,0,0,0,0|2,0,0]=3 5430 B11R1.182 CSCc1cc(ccc1F)Br 62a_200000210301_100000736399 [0,1,0,0,0,0|2,0,0]=3 5431 B11R1.182 CSCc1cc(ccc1F)C 62a_100011260760_200000210301 [0,1,0,0,0,0|2,0,0]=3 5432 B11R1.182 CSCc1cc(ccc1F)C 62a_200000210301_100011260760 [0,1,0,0,0,0|2,0,0]=3 5433 B11R1.182 CSCc1cc(ccc1F)Cl 62a_100000716957_200000210301 [0,1,0,0,0,0|2,0,0]=3 5434 B11R1.182 CSCc1cc(ccc1F)Cl 62a_200000210301_100000716957 [0,1,0,0,0,0|2,0,0]=3 5435 B11R1.182 CSCc1cc(ccc1F)F 62a_100000685659_200000210301 [0,1,0,0,0,0|2,0,0]=3 5436 B11R1.182 CSCc1cc(ccc1F)F 62a_200000210301_100000685659 [0,1,0,0,0,0|2,0,0]=3 5437 B11R1.182 CSCc1cc(ccc1F)I 62a_200000210301_200010149601 [0,1,0,0,0,0|2,0,0]=3 5438 B11R1.182 CSCc1cc(ccc1F)I 62a_200010149601_200000210301 [0,1,0,0,0,0|2,0,0]=3 5439 B11R1.182 CSCc1cc(ccc1I)Br 62a_100012362523_200000210301 [0,1,0,0,0,0|2,0,0]=3 5440 B11R1.182 CSCc1cc(ccc1I)Br 62a_200000210301_100012362523 [0,1,0,0,0,0|2,0,0]=3 5441 B11R1.182 CSCc1cc(ccc1I)Cl 62a_100012348826_200000210301 [0,1,0,0,0,0|2,0,0]=3 5442 B11R1.182 CSCc1cc(ccc1I)Cl 62a_200000210301_100012348826 [0,1,0,0,0,0|2,0,0]=3 5443 B11R1.182 CSCc1cc(ccc1I)F 62a_100010149606_200000210301 [0,1,0,0,0,0|2,0,0]=3 5444 B11R1.182 CSCc1cc(ccc1I)F 62a_200000210301_100010149606 [0,1,0,0,0,0|2,0,0]=3 5445 B11R1.182 CSCc1cc(ccc1O)F 62a_100010161318_200000210301 [0,1,0,0,0,0|1,0,0]=2 5446 B11R1.182 CSCc1cc(ccc1O)F 62a_200000210301_100010161318 [0,1,0,0,0,0|1,0,0]=2 5447 B11R1.182 CSCc1cc(cnc1Br)Br 62a_100010253922_200000210301 [0,1,0,0,0,0|3,0,0]=4 5448 B11R1.182 CSCc1cc(cnc1Br)Br 62a_200000210301_100010253922 [0,1,0,0,0,0|3,0,0]=4 5449 B11R1.182 CSCc1cc(cnc1Cl)Br 62a_100009816982_200000210301 [0,1,0,0,0,0|3,0,0]=4 5450 B11R1.182 CSCc1cc(cnc1Cl)Br 62a_200000210301_100009816982 [0,1,0,0,0,0|3,0,0]=4 5451 B11R1.182 CSCc1nc(ccc1Cl)C 62a_200000210301_200009852033 [0,1,0,0,0,0|3,0,0]=4 5452 B11R1.182 CSCc1nc(ccc1Cl)C 62a_200009852033_200000210301 [0,1,0,0,0,0|3,0,0]=4 5453 B11R1.182 CSCc1nc(ccc1Cl)Cl 62a_100000059412_200000210301 [0,1,0,0,0,0|3,0,0]=4 5454 B11R1.182 CSCc1nc(ccc1Cl)Cl 62a_200000210301_100000059412 [0,1,0,0,0,0|3,0,0]=4 5455 B11R1.182 CSCc1nc(ccc1F)Br 62a_100010065826_200000210301 [0,1,0,0,0,0|3,0,0]=4 5456 B11R1.182 CSCc1nc(ccc1F)Br 62a_200000210301_100010065826 [0,1,0,0,0,0|3,0,0]=4 5457 B11R1.182 CSCc1nc(ccc1F)Cl 62a_100009881012_200000210301 [0,1,0,0,0,0|3,0,0]=4 5458 B11R1.182 CSCc1nc(ccc1F)Cl 62a_200000210301_100009881012 [0,1,0,0,0,0|3,0,0]=4 5459 B11R1.182 CSCc1nc(ccc1O)C 62a_100020630696_200000210301 [0,1,0,0,0,0|2,0,0]=3 5460 B11R1.182 CSCc1nc(ccc1O)C 62a_200000210301_100020630696 [0,1,0,0,0,0|2,0,0]=3 5461 B11R1.182 Cc1cc(c(cn1)Br)CO[13CH3] 34a_100015579599_200025704644 [0,1,0,0,0,0|3,0,0]=4 5462 B11R1.182 Cc1cc(c(cn1)O)SCF 62a_100009843476_100015361967 [0,1,0,0,0,0|3,0,0]=4 5463 B11R1.182 Cc1cc(c(cn1)O)SCF 62a_100015361967_100009843476 [0,1,0,0,0,0|3,0,0]=4 5464 B11R1.182 Cc1ccc(c(c1)CC#N)O 271570a_203496583355_100010147026 [0,1,0,0,0,0|1,0,1]=3 5465 B11R1.182 Cc1ccc(c(c1)CN[13CH3])C 34a_100000174964_200025704644 [0,1,0,0,0,0|2,0,0]=3 5466 B11R1.182 Cc1ccc(c(c1)CN[13CH3])Cl 2230a_100025705715_200025704644 [0,1,0,0,0,0|2,0,0]=3 5467 B11R1.182 Cc1ccc(c(c1)CN[13CH3])Cl 34a_100025705715_200025704644 [0,1,0,0,0,0|2,0,0]=3 5468 B11R1.182 Cc1ccc(c(c1)CN[13CH3])F 34a_100102693586_200025704644 [0,1,0,0,0,0|2,0,0]=3 5469 B11R1.182 Cc1ccc(c(c1)CO[13CH3])Br 34a_100012361352_200025704644 [0,1,0,0,0,0|2,0,0]=3 5470 B11R1.182 Cc1ccc(c(c1)CO[13CH3])Br 7a_100012361352_200025704644 [0,1,0,0,0,0|2,0,0]=3 5471 B11R1.182 Cc1ccc(c(c1)CO[13CH3])C 34a_200011215349_200025704644 [0,1,0,0,0,0|2,0,0]=3 5472 B11R1.182 Cc1ccc(c(c1)CO[13CH3])C 7a_200011215349_200025704644 [0,1,0,0,0,0|2,0,0]=3 5473 B11R1.182 Cc1ccc(c(c1)CO[13CH3])Cl 34a_100009878994_200025704644 [0,1,0,0,0,0|2,0,0]=3 5474 B11R1.182 Cc1ccc(c(c1)CO[13CH3])Cl 7a_100009878994_200025704644 [0,1,0,0,0,0|2,0,0]=3 5475 B11R1.182 Cc1ccc(c(c1)CO[13CH3])F 34a_100011692775_200025704644 [0,1,0,0,0,0|2,0,0]=3 5476 B11R1.182 Cc1ccc(c(c1)CO[13CH3])F 7a_100011692775_200025704644 [0,1,0,0,0,0|2,0,0]=3 5477 B11R1.182 Cc1ccc(c(c1)CO[13CH3])N 34a_100011215565_200025704644 [0,1,0,0,0,0|2,0,0]=3 5478 B11R1.182 Cc1ccc(c(c1)CO[13CH3])N 7a_100011215565_200025704644 [0,1,0,0,0,0|2,0,0]=3 5479 B11R1.182 Cc1ccc(c(c1)CS[13CH3])C 62a_100000184699_200025704644 [0,1,0,0,0,0|2,0,0]=3 5480 B11R1.182 Cc1ccc(c(c1)CS[13CH3])C 62a_200025704644_100000184699 [0,1,0,0,0,0|2,0,0]=3 5481 B11R1.182 Cc1ccc(c(c1)CS[13CH3])Cl 62a_100009871730_200025704644 [0,1,0,0,0,0|2,0,0]=3 5482 B11R1.182 Cc1ccc(c(c1)CS[13CH3])Cl 62a_200025704644_100009871730 [0,1,0,0,0,0|2,0,0]=3 5483 B11R1.182 Cc1ccc(c(c1)CS[13CH3])F 62a_100011260760_200025704644 [0,1,0,0,0,0|2,0,0]=3 5484 B11R1.182 Cc1ccc(c(c1)CS[13CH3])F 62a_200025704644_100011260760 [0,1,0,0,0,0|2,0,0]=3 5485 B11R1.182 Cc1ccc(c(c1)NCF)Br 34a_100000745044_100015361967 [0,1,0,0,0,0|3,0,0]=4 5486 B11R1.182 Cc1ccc(c(c1)NCF)C 34a_100000185781_100015361967 [0,1,0,0,0,0|3,0,0]=4 5487 B11R1.182 Cc1ccc(c(c1)NCF)C 7a_100000185781_100015361967 [0,1,0,0,0,0|3,0,0]=4 5488 B11R1.182 Cc1ccc(c(c1)NCF)Cl 34a_100011215360_100015361967 [0,1,0,0,0,0|3,0,0]=4 5489 B11R1.182 Cc1ccc(c(c1)NCF)F 34a_100000211285_100015361967 [0,1,0,0,0,0|3,0,0]=4 5490 B11R1.182 Cc1ccc(c(c1)NCF)I 34a_100011216686_100015361967 [0,1,0,0,0,0|3,0,0]=4 5491 B11R1.182 Cc1ccc(c(c1)NCF)O 34a_100011215204_100015361967 [0,1,0,0,0,0|2,0,0]=3 5492 B11R1.182 Cc1ccc(c(c1)OCF)Br 34a_100012002257_100015361967 [0,1,0,0,0,0|3,0,0]=4 5493 B11R1.182 Cc1ccc(c(c1)OCF)Br 7a_100012002257_100015361967 [0,1,0,0,0,0|3,0,0]=4 5494 B11R1.182 Cc1ccc(c(c1)OCF)C 34a_100000210931_100015361967 [0,1,0,0,0,0|3,0,0]=4 5495 B11R1.182 Cc1ccc(c(c1)OCF)C 7a_100000210931_100015361967 [0,1,0,0,0,0|3,0,0]=4 5496 B11R1.182 Cc1ccc(c(c1)OCF)Cl 34a_100000211493_100015361967 [0,1,0,0,0,0|3,0,0]=4 5497 B11R1.182 Cc1ccc(c(c1)OCF)Cl 7a_100000211493_100015361967 [0,1,0,0,0,0|3,0,0]=4 5498 B11R1.182 Cc1ccc(c(c1)OCF)F 34a_100000759540_100015361967 [0,1,0,0,0,0|3,0,0]=4 5499 B11R1.182 Cc1ccc(c(c1)OCF)F 7a_100000759540_100015361967 [0,1,0,0,0,0|3,0,0]=4 5500 B11R1.182 Cc1ccc(c(c1)OCF)N 34a_100000211527_100015361967 [0,1,0,0,0,0|3,0,0]=4 5501 B11R1.182 Cc1ccc(c(c1)OCF)N 7a_100000211527_100015361967 [0,1,0,0,0,0|3,0,0]=4 5502 B11R1.182 Cc1ccc(c(c1)SCF)Br 62a_100012353751_100015361967 [0,1,0,0,0,0|3,0,0]=4 5503 B11R1.182 Cc1ccc(c(c1)SCF)Br 62a_100015361967_100012353751 [0,1,0,0,0,0|3,0,0]=4 5504 B11R1.182 Cc1ccc(c(c1)SCF)C 62a_100000210833_100015361967 [0,1,0,0,0,0|3,0,0]=4 5505 B11R1.182 Cc1ccc(c(c1)SCF)C 62a_100015361967_100000210833 [0,1,0,0,0,0|3,0,0]=4 5506 B11R1.182 Cc1ccc(c(c1)SCF)Cl 62a_100012356289_100015361967 [0,1,0,0,0,0|3,0,0]=4 5507 B11R1.182 Cc1ccc(c(c1)SCF)Cl 62a_100015361967_100012356289 [0,1,0,0,0,0|3,0,0]=4 5508 B11R1.182 Cc1ccc(c(c1)SCF)F 62a_100000736223_100015361967 [0,1,0,0,0,0|3,0,0]=4 5509 B11R1.182 Cc1ccc(c(c1)SCF)F 62a_100015361967_100000736223 [0,1,0,0,0,0|3,0,0]=4 5510 B11R1.182 Cc1ccc(c(c1)SCF)N 62a_100011356834_100015361967 [0,1,0,0,0,0|3,0,0]=4 5511 B11R1.182 Cc1ccc(c(c1)SCF)N 62a_100015361967_100011356834 [0,1,0,0,0,0|3,0,0]=4 5512 B11R1.182 Cc1ccc(c(c1)SCF)O 62a_100000765521_100015361967 [0,1,0,0,0,0|2,0,0]=3 5513 B11R1.182 Cc1ccc(c(c1)SCF)O 62a_100015361967_100000765521 [0,1,0,0,0,0|2,0,0]=3 5514 B11R1.182 Cc1ccc(c(n1)CO[13CH3])Br 34a_100010074375_200025704644 [0,1,0,0,0,0|3,0,0]=4 5515 B11R1.182 Cc1ccc(c(n1)CS[13CH3])Cl 62a_200009852033_200025704644 [0,1,0,0,0,0|3,0,0]=4 5516 B11R1.182 Cc1ccc(c(n1)CS[13CH3])Cl 62a_200025704644_200009852033 [0,1,0,0,0,0|3,0,0]=4 5517 B11R1.182 Cc1ccc(c(n1)CS[13CH3])O 62a_100020630696_200025704644 [0,1,0,0,0,0|2,0,0]=3 5518 B11R1.182 Cc1ccc(c(n1)CS[13CH3])O 62a_200025704644_100020630696 [0,1,0,0,0,0|2,0,0]=3 5519 B11R1.182 Cc1ccc(c(n1)SCF)O 62a_100000702858_100015361967 [0,1,0,0,0,0|3,0,0]=4 5520 B11R1.182 Cc1ccc(c(n1)SCF)O 62a_100015361967_100000702858 [0,1,0,0,0,0|3,0,0]=4 5521 B11R1.182 Cc1ccc(cc1CC#N)O 271570a_203496583355_100010147029 [0,1,0,0,0,0|2,0,1]=4 5522 B11R1.182 Cc1ccc(cc1CN[13CH3])Cl 34a_100000717755_200025704644 [0,1,0,0,0,0|2,0,0]=3 5523 B11R1.182 Cc1ccc(cc1CN[13CH3])F 34a_100011217291_200025704644 [0,1,0,0,0,0|2,0,0]=3 5524 B11R1.182 Cc1ccc(cc1CN[13CH3])O 34a_200009844824_200025704644 [0,1,0,0,0,0|2,0,0]=3 5525 B11R1.182 Cc1ccc(cc1CO[13CH3])Br 34a_100000700630_200025704644 [0,1,0,0,0,0|2,0,0]=3 5526 B11R1.182 Cc1ccc(cc1CO[13CH3])Br 7a_100000700630_200025704644 [0,1,0,0,0,0|2,0,0]=3 5527 B11R1.182 Cc1ccc(cc1CO[13CH3])Cl 34a_100012002407_200025704644 [0,1,0,0,0,0|2,0,0]=3 5528 B11R1.182 Cc1ccc(cc1CO[13CH3])Cl 7a_100012002407_200025704644 [0,1,0,0,0,0|2,0,0]=3 5529 B11R1.182 Cc1ccc(cc1CO[13CH3])F 34a_100011219218_200025704644 [0,1,0,0,0,0|2,0,0]=3 5530 B11R1.182 Cc1ccc(cc1CO[13CH3])F 7a_100011219218_200025704644 [0,1,0,0,0,0|2,0,0]=3 5531 B11R1.182 Cc1ccc(cc1CO[13CH3])I 34a_100010150140_200025704644 [0,1,0,0,0,0|2,0,0]=3 5532 B11R1.182 Cc1ccc(cc1CO[13CH3])I 7a_100010150140_200025704644 [0,1,0,0,0,0|2,0,0]=3 5533 B11R1.182 Cc1ccc(cc1CS[13CH3])Cl 62a_100012186985_200025704644 [0,1,0,0,0,0|2,0,0]=3 5534 B11R1.182 Cc1ccc(cc1CS[13CH3])Cl 62a_200025704644_100012186985 [0,1,0,0,0,0|2,0,0]=3 5535 B11R1.182 Cc1ccc(cc1CS[13CH3])F 62a_100000709795_200025704644 [0,1,0,0,0,0|2,0,0]=3 5536 B11R1.182 Cc1ccc(cc1CS[13CH3])F 62a_200025704644_100000709795 [0,1,0,0,0,0|2,0,0]=3 5537 B11R1.182 Cc1ccc(cc1NCF)Br 34a_100000741167_100015361967 [0,1,0,0,0,0|3,0,0]=4 5538 B11R1.182 Cc1ccc(cc1NCF)Br 7a_100000741167_100015361967 [0,1,0,0,0,0|3,0,0]=4 5539 B11R1.182 Cc1ccc(cc1NCF)Cl 34a_100000211374_100015361967 [0,1,0,0,0,0|3,0,0]=4 5540 B11R1.182 Cc1ccc(cc1NCF)Cl 7a_100000211374_100015361967 [0,1,0,0,0,0|3,0,0]=4 5541 B11R1.182 Cc1ccc(cc1NCF)F 34a_100000211107_100015361967 [0,1,0,0,0,0|3,0,0]=4 5542 B11R1.182 Cc1ccc(cc1NCF)F 7a_100000211107_100015361967 [0,1,0,0,0,0|3,0,0]=4 5543 B11R1.182 Cc1ccc(cc1NCF)I 7a_100000761890_100015361967 [0,1,0,0,0,0|3,0,0]=4 5544 B11R1.182 Cc1ccc(cc1NCF)O 34a_100011216113_100015361967 [0,1,0,0,0,0|3,0,0]=4 5545 B11R1.182 Cc1ccc(cc1OCF)Br 34a_100000685420_100015361967 [0,1,0,0,0,0|3,0,0]=4 5546 B11R1.182 Cc1ccc(cc1OCF)Br 7a_100000685420_100015361967 [0,1,0,0,0,0|3,0,0]=4 5547 B11R1.182 Cc1ccc(cc1OCF)Cl 34a_100000756515_100015361967 [0,1,0,0,0,0|3,0,0]=4 5548 B11R1.182 Cc1ccc(cc1OCF)Cl 7a_100000756515_100015361967 [0,1,0,0,0,0|3,0,0]=4 5549 B11R1.182 Cc1ccc(cc1OCF)F 34a_100000690566_100015361967 [0,1,0,0,0,0|3,0,0]=4 5550 B11R1.182 Cc1ccc(cc1OCF)F 7a_100000690566_100015361967 [0,1,0,0,0,0|3,0,0]=4 5551 B11R1.182 Cc1ccc(cc1OCF)I 7a_100000766334_100015361967 [0,1,0,0,0,0|3,0,0]=4 5552 B11R1.182 Cc1ccc(cc1OCF)N 34a_100000759471_100015361967 [0,1,0,0,0,0|3,0,0]=4 5553 B11R1.182 Cc1ccc(cc1OCF)N 7a_100000759471_100015361967 [0,1,0,0,0,0|3,0,0]=4 5554 B11R1.182 Cc1ccc(cc1SCF)Br 62a_100011344865_100015361967 [0,1,0,0,0,0|3,0,0]=4 5555 B11R1.182 Cc1ccc(cc1SCF)Br 62a_100015361967_100011344865 [0,1,0,0,0,0|3,0,0]=4 5556 B11R1.182 Cc1ccc(cc1SCF)Cl 62a_100011263213_100015361967 [0,1,0,0,0,0|3,0,0]=4 5557 B11R1.182 Cc1ccc(cc1SCF)Cl 62a_100015361967_100011263213 [0,1,0,0,0,0|3,0,0]=4 5558 B11R1.182 Cc1ccc(cc1SCF)F 62a_100011218078_100015361967 [0,1,0,0,0,0|3,0,0]=4 5559 B11R1.182 Cc1ccc(cc1SCF)F 62a_100015361967_100011218078 [0,1,0,0,0,0|3,0,0]=4 5560 B11R1.182 Cc1ccc(cc1SCF)N 62a_100000736455_100015361967 [0,1,0,0,0,0|3,0,0]=4 5561 B11R1.182 Cc1ccc(cc1SCF)N 62a_100015361967_100000736455 [0,1,0,0,0,0|3,0,0]=4 5562 B11R1.182 Cc1ccc(cc1SCF)O 62a_100011380479_100015361967 [0,1,0,0,0,0|3,0,0]=4 5563 B11R1.182 Cc1ccc(cc1SCF)O 62a_100015361967_100011380479 [0,1,0,0,0,0|3,0,0]=4 5564 B11R1.182 Cc1cnc(c(c1)CO[13CH3])Cl 34a_100000118064_200025704644 [0,1,0,0,0,0|3,0,0]=4 5565 B11R1.182 Cc1cnc(c(c1)CO[13CH3])Cl 7a_100000118064_200025704644 [0,1,0,0,0,0|3,0,0]=4 5566 B11R1.182 Cc1cnc(c(c1)SCF)O 62a_100000719714_100015361967 [0,1,0,0,0,0|3,0,0]=4 5567 B11R1.182 Cc1cnc(c(c1)SCF)O 62a_100015361967_100000719714 [0,1,0,0,0,0|3,0,0]=4 5568 B11R1.182 Cc1ncc(cc1CO[13CH3])Br 34a_100010894652_200025704644 [0,1,0,0,0,0|3,0,0]=4 5569 B11R1.182 Cc1ncc(cc1CO[13CH3])Br 7a_100010894652_200025704644 [0,1,0,0,0,0|3,0,0]=4 5570 B11R1.182 FCNc1cc(ccc1Br)Br 34a_100000737762_100015361967 [0,1,0,0,0,0|3,0,0]=4 5571 B11R1.182 FCNc1cc(ccc1Br)Cl 34a_100000687073_100015361967 [0,1,0,0,0,0|3,0,0]=4 5572 B11R1.182 FCNc1cc(ccc1Br)F 34a_100000687223_100015361967 [0,1,0,0,0,0|3,0,0]=4 5573 B11R1.182 FCNc1cc(ccc1Cl)Br 34a_100000750497_100015361967 [0,1,0,0,0,0|3,0,0]=4 5574 B11R1.182 FCNc1cc(ccc1Cl)Cl 34a_100000184485_100015361967 [0,1,0,0,0,0|3,0,0]=4 5575 B11R1.182 FCNc1cc(ccc1Cl)F 34a_100000751338_100015361967 [0,1,0,0,0,0|3,0,0]=4 5576 B11R1.182 FCNc1cc(ccc1Cl)I 34a_200000761891_100015361967 [0,1,0,0,0,0|3,0,0]=4 5577 B11R1.182 FCNc1cc(ccc1F)Br 34a_100000740924_100015361967 [0,1,0,0,0,0|3,0,0]=4 5578 B11R1.182 FCNc1cc(ccc1F)Cl 34a_100000212115_100015361967 [0,1,0,0,0,0|3,0,0]=4 5579 B11R1.182 FCNc1cc(ccc1F)F 34a_100000210742_100015361967 [0,1,0,0,0,0|3,0,0]=4 5580 B11R1.182 FCNc1cc(ccc1F)I 34a_100011464823_100015361967 [0,1,0,0,0,0|3,0,0]=4 5581 B11R1.182 FCNc1cc(ccc1I)Br 34a_100000743836_100015361967 [0,1,0,0,0,0|3,0,0]=4 5582 B11R1.182 FCNc1cc(ccc1I)Cl 34a_100000761886_100015361967 [0,1,0,0,0,0|3,0,0]=4 5583 B11R1.182 FCNc1cc(ccc1I)F 34a_100011218093_100015361967 [0,1,0,0,0,0|3,0,0]=4 5584 B11R1.182 FCOc1cc(ccc1Br)Br 34a_100011220040_100015361967 [0,1,0,0,0,0|3,0,0]=4 5585 B11R1.182 FCOc1cc(ccc1Br)Br 7a_100011220040_100015361967 [0,1,0,0,0,0|3,0,0]=4 5586 B11R1.182 FCOc1cc(ccc1Br)Cl 34a_100012339455_100015361967 [0,1,0,0,0,0|3,0,0]=4 5587 B11R1.182 FCOc1cc(ccc1Br)Cl 7a_100012339455_100015361967 [0,1,0,0,0,0|3,0,0]=4 5588 B11R1.182 FCOc1cc(ccc1Br)F 34a_100000690578_100015361967 [0,1,0,0,0,0|3,0,0]=4 5589 B11R1.182 FCOc1cc(ccc1Br)F 7a_100000690578_100015361967 [0,1,0,0,0,0|3,0,0]=4 5590 B11R1.182 FCOc1cc(ccc1Br)I 34a_100012356990_100015361967 [0,1,0,0,0,0|3,0,0]=4 5591 B11R1.182 FCOc1cc(ccc1Br)I 7a_100012356990_100015361967 [0,1,0,0,0,0|3,0,0]=4 5592 B11R1.182 FCOc1cc(ccc1Cl)Br 34a_100000738945_100015361967 [0,1,0,0,0,0|3,0,0]=4 5593 B11R1.182 FCOc1cc(ccc1Cl)Br 7a_100000738945_100015361967 [0,1,0,0,0,0|3,0,0]=4 5594 B11R1.182 FCOc1cc(ccc1Cl)Cl 34a_100000211422_100015361967 [0,1,0,0,0,0|3,0,0]=4 5595 B11R1.182 FCOc1cc(ccc1Cl)Cl 7a_100000211422_100015361967 [0,1,0,0,0,0|3,0,0]=4 5596 B11R1.182 FCOc1cc(ccc1Cl)F 34a_100000692107_100015361967 [0,1,0,0,0,0|3,0,0]=4 5597 B11R1.182 FCOc1cc(ccc1Cl)F 7a_100000692107_100015361967 [0,1,0,0,0,0|3,0,0]=4 5598 B11R1.182 FCOc1cc(ccc1Cl)I 34a_100011356854_100015361967 [0,1,0,0,0,0|3,0,0]=4 5599 B11R1.182 FCOc1cc(ccc1Cl)I 7a_100011356854_100015361967 [0,1,0,0,0,0|3,0,0]=4 5600 B11R1.182 FCOc1cc(ccc1F)Br 34a_100000686035_100015361967 [0,1,0,0,0,0|3,0,0]=4 5601 B11R1.182 FCOc1cc(ccc1F)Br 7a_100000686035_100015361967 [0,1,0,0,0,0|3,0,0]=4 5602 B11R1.182 FCOc1cc(ccc1F)Cl 34a_100000757397_100015361967 [0,1,0,0,0,0|3,0,0]=4 5603 B11R1.182 FCOc1cc(ccc1F)Cl 7a_100000757397_100015361967 [0,1,0,0,0,0|3,0,0]=4 5604 B11R1.182 FCOc1cc(ccc1F)F 34a_100000752141_100015361967 [0,1,0,0,0,0|3,0,0]=4 5605 B11R1.182 FCOc1cc(ccc1F)F 7a_100000752141_100015361967 [0,1,0,0,0,0|3,0,0]=4 5606 B11R1.182 FCOc1cc(ccc1F)I 34a_100009958187_100015361967 [0,1,0,0,0,0|3,0,0]=4 5607 B11R1.182 FCOc1cc(ccc1F)I 7a_100009958187_100015361967 [0,1,0,0,0,0|3,0,0]=4 5608 B11R1.182 FCOc1cc(ccc1I)Br 34a_100012344904_100015361967 [0,1,0,0,0,0|3,0,0]=4 5609 B11R1.182 FCOc1cc(ccc1I)Br 7a_100012344904_100015361967 [0,1,0,0,0,0|3,0,0]=4 5610 B11R1.182 FCOc1cc(ccc1I)Cl 34a_100000050036_100015361967 [0,1,0,0,0,0|3,0,0]=4 5611 B11R1.182 FCOc1cc(ccc1I)Cl 7a_100000050036_100015361967 [0,1,0,0,0,0|3,0,0]=4 5612 B11R1.182 FCOc1cc(ccc1I)F 34a_100010084537_100015361967 [0,1,0,0,0,0|3,0,0]=4 5613 B11R1.182 FCOc1cc(ccc1I)F 7a_100010084537_100015361967 [0,1,0,0,0,0|3,0,0]=4 5614 B11R1.182 FCSc1cc(ccc1Br)Br 62a_100011483371_100015361967 [0,1,0,0,0,0|3,0,0]=4 5615 B11R1.182 FCSc1cc(ccc1Br)Br 62a_100015361967_100011483371 [0,1,0,0,0,0|3,0,0]=4 5616 B11R1.182 FCSc1cc(ccc1Br)Cl 62a_100012339723_100015361967 [0,1,0,0,0,0|3,0,0]=4 5617 B11R1.182 FCSc1cc(ccc1Br)Cl 62a_100015361967_100012339723 [0,1,0,0,0,0|3,0,0]=4 5618 B11R1.182 FCSc1cc(ccc1Br)F 62a_100011217576_100015361967 [0,1,0,0,0,0|3,0,0]=4 5619 B11R1.182 FCSc1cc(ccc1Br)F 62a_100015361967_100011217576 [0,1,0,0,0,0|3,0,0]=4 5620 B11R1.182 FCSc1cc(ccc1Cl)Br 62a_100011772130_100015361967 [0,1,0,0,0,0|3,0,0]=4 5621 B11R1.182 FCSc1cc(ccc1Cl)Br 62a_100015361967_100011772130 [0,1,0,0,0,0|3,0,0]=4 5622 B11R1.182 FCSc1cc(ccc1Cl)Cl 62a_100000707729_100015361967 [0,1,0,0,0,0|3,0,0]=4 5623 B11R1.182 FCSc1cc(ccc1Cl)Cl 62a_100015361967_100000707729 [0,1,0,0,0,0|3,0,0]=4 5624 B11R1.182 FCSc1cc(ccc1Cl)F 62a_100011217299_100015361967 [0,1,0,0,0,0|3,0,0]=4 5625 B11R1.182 FCSc1cc(ccc1Cl)F 62a_100015361967_100011217299 [0,1,0,0,0,0|3,0,0]=4 5626 B11R1.182 FCSc1cc(ccc1F)Br 62a_100011217312_100015361967 [0,1,0,0,0,0|3,0,0]=4 5627 B11R1.182 FCSc1cc(ccc1F)Br 62a_100015361967_100011217312 [0,1,0,0,0,0|3,0,0]=4 5628 B11R1.182 FCSc1cc(ccc1F)Cl 62a_100011218116_100015361967 [0,1,0,0,0,0|3,0,0]=4 5629 B11R1.182 FCSc1cc(ccc1F)Cl 62a_100015361967_100011218116 [0,1,0,0,0,0|3,0,0]=4 5630 B11R1.182 FCSc1cc(ccc1F)F 62a_100011219198_100015361967 [0,1,0,0,0,0|3,0,0]=4 5631 B11R1.182 FCSc1cc(ccc1F)F 62a_100015361967_100011219198 [0,1,0,0,0,0|3,0,0]=4 5632 B11R1.182 N#CCc1cc(ccc1Br)O 271570a_203496583355_100010146707 [0,1,0,0,0,0|2,0,1]=4 5633 B11R1.182 N#CCc1cc(ccc1F)O 271570a_203496583355_100000739769 [0,1,0,0,0,0|2,0,1]=4 5634 B11R1.182 N#CCc1cc(ccc1N)O 271570a_203496583355_100010188562 [0,1,0,0,0,0|2,0,1]=4 5635 B11R1.182 N#CCc1cc(ccc1O)F 271570a_203496583355_100011206898 [0,1,0,0,0,0|1,0,1]=3 5636 B11R1.182 Nc1ccc(c(c1)OCF)Cl 34a_100011934209_100015361967 [0,1,0,0,0,0|3,0,0]=4 5637 B11R1.182 Nc1ccc(c(c1)OCF)F 34a_100012017398_100015361967 [0,1,0,0,0,0|3,0,0]=4 5638 B11R1.182 Nc1ccc(c(c1)OCF)F 7a_100012017398_100015361967 [0,1,0,0,0,0|3,0,0]=4 5639 B11R1.182 Nc1ccc(c(c1)OCF)N 34a_100025717382_100015361967 [0,1,0,0,0,0|3,0,0]=4 5640 B11R1.182 Nc1ccc(c(c1)SCF)Br 62a_100000750459_100015361967 [0,1,0,0,0,0|3,0,0]=4 5641 B11R1.182 Nc1ccc(c(c1)SCF)Br 62a_100015361967_100000750459 [0,1,0,0,0,0|3,0,0]=4 5642 B11R1.182 Nc1ccc(c(c1)SCF)Cl 62a_100012360549_100015361967 [0,1,0,0,0,0|3,0,0]=4 5643 B11R1.182 Nc1ccc(c(c1)SCF)Cl 62a_100015361967_100012360549 [0,1,0,0,0,0|3,0,0]=4 5644 B11R1.182 Nc1ccc(c(c1)SCF)F 62a_100000760356_100015361967 [0,1,0,0,0,0|3,0,0]=4 5645 B11R1.182 Nc1ccc(c(c1)SCF)F 62a_100015361967_100000760356 [0,1,0,0,0,0|3,0,0]=4 5646 B11R1.182 Nc1ccc(c(c1)SCF)N 62a_100011534242_100015361967 [0,1,0,0,0,0|3,0,0]=4 5647 B11R1.182 Nc1ccc(c(c1)SCF)N 62a_100015361967_100011534242 [0,1,0,0,0,0|3,0,0]=4 5648 B11R1.182 Nc1ccc(c(c1)SCF)O 62a_100011534360_100015361967 [0,1,0,0,0,0|2,0,0]=3 5649 B11R1.182 Nc1ccc(c(c1)SCF)O 62a_100015361967_100011534360 [0,1,0,0,0,0|2,0,0]=3 5650 B11R1.182 Nc1ccc(cc1OCF)Br 34a_100000739049_100015361967 [0,1,0,0,0,0|3,0,0]=4 5651 B11R1.182 Nc1ccc(cc1OCF)Br 7a_100000739049_100015361967 [0,1,0,0,0,0|3,0,0]=4 5652 B11R1.182 Nc1ccc(cc1OCF)Cl 34a_100000185728_100015361967 [0,1,0,0,0,0|3,0,0]=4 5653 B11R1.182 Nc1ccc(cc1OCF)Cl 7a_100000185728_100015361967 [0,1,0,0,0,0|3,0,0]=4 5654 B11R1.182 Nc1ccc(cc1OCF)F 34a_100000753323_100015361967 [0,1,0,0,0,0|3,0,0]=4 5655 B11R1.182 Nc1ccc(cc1OCF)F 7a_100000753323_100015361967 [0,1,0,0,0,0|3,0,0]=4 5656 B11R1.182 Nc1ccc(cc1OCF)I 34a_100000057187_100015361967 [0,1,0,0,0,0|3,0,0]=4 5657 B11R1.182 Nc1ccc(cc1OCF)I 7a_100000057187_100015361967 [0,1,0,0,0,0|3,0,0]=4 5658 B11R1.182 Nc1ccc(cc1SCF)Br 62a_100000187925_100015361967 [0,1,0,0,0,0|3,0,0]=4 5659 B11R1.182 Nc1ccc(cc1SCF)Br 62a_100015361967_100000187925 [0,1,0,0,0,0|3,0,0]=4 5660 B11R1.182 Nc1ccc(cc1SCF)Cl 62a_100000761889_100015361967 [0,1,0,0,0,0|3,0,0]=4 5661 B11R1.182 Nc1ccc(cc1SCF)Cl 62a_100015361967_100000761889 [0,1,0,0,0,0|3,0,0]=4 5662 B11R1.182 Nc1ccc(cc1SCF)F 62a_100000760547_100015361967 [0,1,0,0,0,0|3,0,0]=4 5663 B11R1.182 Nc1ccc(cc1SCF)F 62a_100015361967_100000760547 [0,1,0,0,0,0|3,0,0]=4 5664 B11R1.182 Nc1ccc(cc1SCF)O 62a_100012001276_100015361967 [0,1,0,0,0,0|3,0,0]=4 5665 B11R1.182 Nc1ccc(cc1SCF)O 62a_100015361967_100012001276 [0,1,0,0,0,0|3,0,0]=4 5666 B11R1.182 Oc1ccc(c(c1)NCF)Br 34a_100011999798_100015361967 [0,1,0,0,0,0|3,0,0]=4 5667 B11R1.182 Oc1ccc(c(c1)NCF)Cl 34a_100011934297_100015361967 [0,1,0,0,0,0|3,0,0]=4 5668 B11R1.182 Oc1ccc(c(c1)NCF)F 34a_100012017239_100015361967 [0,1,0,0,0,0|3,0,0]=4 5669 B11R1.182 Oc1ccc(c(c1)SCF)Br 62a_100012339312_100015361967 [0,1,0,0,0,0|3,0,0]=4 5670 B11R1.182 Oc1ccc(c(c1)SCF)Br 62a_100015361967_100012339312 [0,1,0,0,0,0|3,0,0]=4 5671 B11R1.182 Oc1ccc(c(c1)SCF)Cl 62a_100000049588_100015361967 [0,1,0,0,0,0|3,0,0]=4 5672 B11R1.182 Oc1ccc(c(c1)SCF)Cl 62a_100015361967_100000049588 [0,1,0,0,0,0|3,0,0]=4 5673 B11R1.182 Oc1ccc(c(c1)SCF)F 62a_100000693481_100015361967 [0,1,0,0,0,0|3,0,0]=4 5674 B11R1.182 Oc1ccc(c(c1)SCF)F 62a_100015361967_100000693481 [0,1,0,0,0,0|3,0,0]=4 5675 B11R1.182 Oc1ccc(c(c1)SCF)O 62a_100015361967_100009813629 [0,1,0,0,0,0|2,0,0]=3 5676 B11R1.182 Oc1ccc(cc1NCF)Br 34a_100000752626_100015361967 [0,1,0,0,0,0|2,0,0]=3 5677 B11R1.182 Oc1ccc(cc1NCF)Cl 34a_100000210500_100015361967 [0,1,0,0,0,0|2,0,0]=3 5678 B11R1.182 Oc1ccc(cc1NCF)F 34a_100000759472_100015361967 [0,1,0,0,0,0|2,0,0]=3 5679 B11R1.182 Oc1ccc(cc1SCF)Br 62a_100012355227_100015361967 [0,1,0,0,0,0|2,0,0]=3 5680 B11R1.182 Oc1ccc(cc1SCF)Br 62a_100015361967_100012355227 [0,1,0,0,0,0|2,0,0]=3 5681 B11R1.182 Oc1ccc(cc1SCF)Cl 62a_100011356953_100015361967 [0,1,0,0,0,0|2,0,0]=3 5682 B11R1.182 Oc1ccc(cc1SCF)Cl 62a_100015361967_100011356953 [0,1,0,0,0,0|2,0,0]=3 5683 B11R1.182 Oc1ccc(cc1SCF)F 62a_100000211999_100015361967 [0,1,0,0,0,0|2,0,0]=3 5684 B11R1.182 Oc1ccc(cc1SCF)F 62a_100015361967_100000211999 [0,1,0,0,0,0|2,0,0]=3 5685 B11R1.182 Oc1ccc(nc1SCF)Br 62a_100010253912_100015361967 [0,1,0,0,0,0|3,0,0]=4 5686 B11R1.182 Oc1ccc(nc1SCF)Br 62a_100015361967_100010253912 [0,1,0,0,0,0|3,0,0]=4 5687 B11R1.182 Oc1ccc(nc1SCF)Cl 62a_100015361967_100000696390 [0,1,0,0,0,0|3,0,0]=4 5688 B11R1.182 Oc1ccc(nc1SCF)F 62a_100010382442_100015361967 [0,1,0,0,0,0|3,0,0]=4 5689 B11R1.182 Oc1ccc(nc1SCF)F 62a_100015361967_100010382442 [0,1,0,0,0,0|3,0,0]=4 5690 B11R1.182 Oc1cnc(cc1SCF)Cl 62a_100000698892_100015361967 [0,1,0,0,0,0|3,0,0]=4 5691 B11R1.182 Oc1cnc(cc1SCF)Cl 62a_100015361967_100000698892 [0,1,0,0,0,0|3,0,0]=4 5692 B11R1.182 Oc1ncc(cc1SCF)Br 62a_100010197142_100015361967 [0,1,0,0,0,0|3,0,0]=4 5693 B11R1.182 Oc1ncc(cc1SCF)Br 62a_100015361967_100010197142 [0,1,0,0,0,0|3,0,0]=4 5694 B11R1.182 Oc1ncc(cc1SCF)Cl 62a_100010188700_100015361967 [0,1,0,0,0,0|3,0,0]=4 5695 B11R1.182 Oc1ncc(cc1SCF)Cl 62a_100015361967_100010188700 [0,1,0,0,0,0|3,0,0]=4 5696 B11R1.182 [13CH3]NCc1cc(ccc1Br)Br 34a_100000707832_200025704644 [0,1,0,0,0,0|2,0,0]=3 5697 B11R1.182 [13CH3]NCc1cc(ccc1Br)F 2230a_100000742738_200025704644 [0,1,0,0,0,0|2,0,0]=3 5698 B11R1.182 [13CH3]NCc1cc(ccc1Br)F 34a_100000742738_200025704644 [0,1,0,0,0,0|2,0,0]=3 5699 B11R1.182 [13CH3]NCc1cc(ccc1Cl)Br 34a_100025772652_200025704644 [0,1,0,0,0,0|2,0,0]=3 5700 B11R1.182 [13CH3]NCc1cc(ccc1Cl)Cl 34a_100102946428_200025704644 [0,1,0,0,0,0|2,0,0]=3 5701 B11R1.182 [13CH3]NCc1cc(ccc1Cl)F 2230a_100011830483_200025704644 [0,1,0,0,0,0|2,0,0]=3 5702 B11R1.182 [13CH3]NCc1cc(ccc1Cl)F 34a_100011830483_200025704644 [0,1,0,0,0,0|2,0,0]=3 5703 B11R1.182 [13CH3]NCc1cc(ccc1F)Br 34a_100009815772_200025704644 [0,1,0,0,0,0|2,0,0]=3 5704 B11R1.182 [13CH3]NCc1cc(ccc1F)Cl 34a_100011211646_200025704644 [0,1,0,0,0,0|2,0,0]=3 5705 B11R1.182 [13CH3]NCc1cc(ccc1F)F 34a_100000752317_200025704644 [0,1,0,0,0,0|2,0,0]=3 5706 B11R1.182 [13CH3]NCc1cc(ccc1O)Br 34a_100000730032_200025704644 [0,1,0,0,0,0|1,0,0]=2 5707 B11R1.182 [13CH3]NCc1cc(ccc1O)Cl 34a_100000238540_200025704644 [0,1,0,0,0,0|1,0,0]=2 5708 B11R1.182 [13CH3]NCc1cc(cnc1Br)F 2230a_100010760786_200025704644 [0,1,0,0,0,0|3,0,0]=4 5709 B11R1.182 [13CH3]NCc1cc(cnc1Br)F 34a_100010760786_200025704644 [0,1,0,0,0,0|3,0,0]=4 5710 B11R1.182 [13CH3]NCc1nc(ccc1F)Cl 2230a_100009887702_200025704644 [0,1,0,0,0,0|3,0,0]=4 5711 B11R1.182 [13CH3]NCc1nc(ccc1F)Cl 34a_100009887702_200025704644 [0,1,0,0,0,0|3,0,0]=4 5712 B11R1.182 [13CH3]OCc1cc(ccc1Br)Br 34a_100011266457_200025704644 [0,1,0,0,0,0|2,0,0]=3 5713 B11R1.182 [13CH3]OCc1cc(ccc1Br)Br 7a_100011266457_200025704644 [0,1,0,0,0,0|2,0,0]=3 5714 B11R1.182 [13CH3]OCc1cc(ccc1Br)Cl 34a_100012355668_200025704644 [0,1,0,0,0,0|2,0,0]=3 5715 B11R1.182 [13CH3]OCc1cc(ccc1Br)Cl 7a_100012355668_200025704644 [0,1,0,0,0,0|2,0,0]=3 5716 B11R1.182 [13CH3]OCc1cc(ccc1Br)F 34a_100011217561_200025704644 [0,1,0,0,0,0|2,0,0]=3 5717 B11R1.182 [13CH3]OCc1cc(ccc1Br)F 7a_100011217561_200025704644 [0,1,0,0,0,0|2,0,0]=3 5718 B11R1.182 [13CH3]OCc1cc(ccc1Br)I 7a_100012359683_200025704644 [0,1,0,0,0,0|2,0,0]=3 5719 B11R1.182 [13CH3]OCc1cc(ccc1Br)N 34a_100012347228_200025704644 [0,1,0,0,0,0|2,0,0]=3 5720 B11R1.182 [13CH3]OCc1cc(ccc1Cl)Br 34a_100011215897_200025704644 [0,1,0,0,0,0|2,0,0]=3 5721 B11R1.182 [13CH3]OCc1cc(ccc1Cl)Br 7a_100011215897_200025704644 [0,1,0,0,0,0|2,0,0]=3 5722 B11R1.182 [13CH3]OCc1cc(ccc1Cl)Cl 34a_100000698905_200025704644 [0,1,0,0,0,0|2,0,0]=3 5723 B11R1.182 [13CH3]OCc1cc(ccc1Cl)Cl 7a_100000698905_200025704644 [0,1,0,0,0,0|2,0,0]=3 5724 B11R1.182 [13CH3]OCc1cc(ccc1Cl)F 34a_100011218361_200025704644 [0,1,0,0,0,0|2,0,0]=3 5725 B11R1.182 [13CH3]OCc1cc(ccc1Cl)F 7a_100011218361_200025704644 [0,1,0,0,0,0|2,0,0]=3 5726 B11R1.182 [13CH3]OCc1cc(ccc1Cl)I 34a_100010128486_200025704644 [0,1,0,0,0,0|2,0,0]=3 5727 B11R1.182 [13CH3]OCc1cc(ccc1Cl)I 7a_100010128486_200025704644 [0,1,0,0,0,0|2,0,0]=3 5728 B11R1.182 [13CH3]OCc1cc(ccc1Cl)N 34a_100011273577_200025704644 [0,1,0,0,0,0|2,0,0]=3 5729 B11R1.182 [13CH3]OCc1cc(ccc1F)Br 34a_100000246282_200025704644 [0,1,0,0,0,0|2,0,0]=3 5730 B11R1.182 [13CH3]OCc1cc(ccc1F)Br 7a_100000246282_200025704644 [0,1,0,0,0,0|2,0,0]=3 5731 B11R1.182 [13CH3]OCc1cc(ccc1F)Cl 34a_100011217248_200025704644 [0,1,0,0,0,0|2,0,0]=3 5732 B11R1.182 [13CH3]OCc1cc(ccc1F)Cl 7a_100011217248_200025704644 [0,1,0,0,0,0|2,0,0]=3 5733 B11R1.182 [13CH3]OCc1cc(ccc1F)F 34a_100011217725_200025704644 [0,1,0,0,0,0|2,0,0]=3 5734 B11R1.182 [13CH3]OCc1cc(ccc1F)F 7a_100011217725_200025704644 [0,1,0,0,0,0|2,0,0]=3 5735 B11R1.182 [13CH3]OCc1cc(ccc1F)I 34a_100000049604_200025704644 [0,1,0,0,0,0|2,0,0]=3 5736 B11R1.182 [13CH3]OCc1cc(ccc1F)I 7a_100000049604_200025704644 [0,1,0,0,0,0|2,0,0]=3 5737 B11R1.182 [13CH3]OCc1cc(ccc1F)N 34a_100011218011_200025704644 [0,1,0,0,0,0|2,0,0]=3 5738 B11R1.182 [13CH3]OCc1cc(ccc1I)Br 34a_100011356890_200025704644 [0,1,0,0,0,0|2,0,0]=3 5739 B11R1.182 [13CH3]OCc1cc(ccc1I)Br 7a_100011356890_200025704644 [0,1,0,0,0,0|2,0,0]=3 5740 B11R1.182 [13CH3]OCc1cc(ccc1I)F 34a_100010255287_200025704644 [0,1,0,0,0,0|2,0,0]=3 5741 B11R1.182 [13CH3]OCc1cc(ccc1I)F 7a_100010255287_200025704644 [0,1,0,0,0,0|2,0,0]=3 5742 B11R1.182 [13CH3]OCc1cc(ccc1N)Br 34a_100012353972_200025704644 [0,1,0,0,0,0|2,0,0]=3 5743 B11R1.182 [13CH3]OCc1cc(ccc1N)Br 7a_100012353972_200025704644 [0,1,0,0,0,0|2,0,0]=3 5744 B11R1.182 [13CH3]OCc1cc(ccc1N)Cl 34a_100011214999_200025704644 [0,1,0,0,0,0|2,0,0]=3 5745 B11R1.182 [13CH3]OCc1cc(ccc1N)Cl 7a_100011214999_200025704644 [0,1,0,0,0,0|2,0,0]=3 5746 B11R1.182 [13CH3]OCc1cc(ccc1N)F 34a_100011296978_200025704644 [0,1,0,0,0,0|2,0,0]=3 5747 B11R1.182 [13CH3]OCc1cc(ccc1N)F 7a_100011296978_200025704644 [0,1,0,0,0,0|2,0,0]=3 5748 B11R1.182 [13CH3]OCc1cc(cnc1Br)Cl 34a_200010065233_200025704644 [0,1,0,0,0,0|3,0,0]=4 5749 B11R1.182 [13CH3]OCc1cc(cnc1Br)Cl 7a_200010065233_200025704644 [0,1,0,0,0,0|3,0,0]=4 5750 B11R1.182 [13CH3]OCc1cc(cnc1Cl)Br 34a_100000734252_200025704644 [0,1,0,0,0,0|3,0,0]=4 5751 B11R1.182 [13CH3]OCc1cc(cnc1Cl)Br 7a_100000734252_200025704644 [0,1,0,0,0,0|3,0,0]=4 5752 B11R1.182 [13CH3]OCc1cc(cnc1Cl)Cl 34a_100000084153_200025704644 [0,1,0,0,0,0|3,0,0]=4 5753 B11R1.182 [13CH3]OCc1cc(cnc1Cl)Cl 7a_100000084153_200025704644 [0,1,0,0,0,0|3,0,0]=4 5754 B11R1.182 [13CH3]OCc1cc(cnc1Cl)F 34a_100000079972_200025704644 [0,1,0,0,0,0|3,0,0]=4 5755 B11R1.182 [13CH3]OCc1cc(cnc1Cl)F 7a_100000079972_200025704644 [0,1,0,0,0,0|3,0,0]=4 5756 B11R1.182 [13CH3]OCc1cc(cnc1F)Br 34a_100010202234_200025704644 [0,1,0,0,0,0|3,0,0]=4 5757 B11R1.182 [13CH3]OCc1cc(cnc1F)Br 7a_100010202234_200025704644 [0,1,0,0,0,0|3,0,0]=4 5758 B11R1.182 [13CH3]OCc1cc(cnc1F)Cl 34a_200000081815_200025704644 [0,1,0,0,0,0|3,0,0]=4 5759 B11R1.182 [13CH3]OCc1cc(cnc1F)Cl 7a_200000081815_200025704644 [0,1,0,0,0,0|3,0,0]=4 5760 B11R1.182 [13CH3]OCc1cc(cnc1N)Br 34a_100011934449_200025704644 [0,1,0,0,0,0|3,0,0]=4 5761 B11R1.182 [13CH3]OCc1cc(cnc1N)Br 7a_100011934449_200025704644 [0,1,0,0,0,0|3,0,0]=4 5762 B11R1.182 [13CH3]OCc1cc(ncc1Br)Br 34a_100010245045_200025704644 [0,1,0,0,0,0|3,0,0]=4 5763 B11R1.182 [13CH3]OCc1cc(ncc1Br)Br 7a_100010245045_200025704644 [0,1,0,0,0,0|3,0,0]=4 5764 B11R1.182 [13CH3]OCc1cc(ncc1Br)Cl 34a_100010245067_200025704644 [0,1,0,0,0,0|3,0,0]=4 5765 B11R1.182 [13CH3]OCc1cc(ncc1Br)Cl 7a_100010245067_200025704644 [0,1,0,0,0,0|3,0,0]=4 5766 B11R1.182 [13CH3]OCc1cc(ncc1Cl)Cl 34a_100000081519_200025704644 [0,1,0,0,0,0|3,0,0]=4 5767 B11R1.182 [13CH3]OCc1cc(ncc1Cl)Cl 7a_100000081519_200025704644 [0,1,0,0,0,0|3,0,0]=4 5768 B11R1.182 [13CH3]OCc1cc(ncc1F)Cl 34a_100000081974_200025704644 [0,1,0,0,0,0|3,0,0]=4 5769 B11R1.182 [13CH3]OCc1cc(ncc1F)Cl 7a_100000081974_200025704644 [0,1,0,0,0,0|3,0,0]=4 5770 B11R1.182 [13CH3]OCc1cc(ncc1F)F 34a_100000730792_200025704644 [0,1,0,0,0,0|3,0,0]=4 5771 B11R1.182 [13CH3]OCc1cc(ncc1F)F 7a_100000730792_200025704644 [0,1,0,0,0,0|3,0,0]=4 5772 B11R1.182 [13CH3]OCc1nc(ccc1Br)Br 34a_200010065229_200025704644 [0,1,0,0,0,0|3,0,0]=4 5773 B11R1.182 [13CH3]OCc1nc(ccc1Br)Br 7a_200010065229_200025704644 [0,1,0,0,0,0|3,0,0]=4 5774 B11R1.182 [13CH3]OCc1nc(ccc1Br)Cl 34a_100010244999_200025704644 [0,1,0,0,0,0|3,0,0]=4 5775 B11R1.182 [13CH3]OCc1nc(ccc1Br)F 34a_100000701195_200025704644 [0,1,0,0,0,0|3,0,0]=4 5776 B11R1.182 [13CH3]OCc1nc(ccc1Cl)Cl 34a_100000749784_200025704644 [0,1,0,0,0,0|3,0,0]=4 5777 B11R1.182 [13CH3]SCc1cc(ccc1Br)Br 62a_100011982794_200025704644 [0,1,0,0,0,0|2,0,0]=3 5778 B11R1.182 [13CH3]SCc1cc(ccc1Br)Br 62a_200025704644_100011982794 [0,1,0,0,0,0|2,0,0]=3 5779 B11R1.182 [13CH3]SCc1cc(ccc1Br)Cl 62a_100000733903_200025704644 [0,1,0,0,0,0|2,0,0]=3 5780 B11R1.182 [13CH3]SCc1cc(ccc1Br)Cl 62a_200025704644_100000733903 [0,1,0,0,0,0|2,0,0]=3 5781 B11R1.182 [13CH3]SCc1cc(ccc1Br)F 62a_100000736370_200025704644 [0,1,0,0,0,0|2,0,0]=3 5782 B11R1.182 [13CH3]SCc1cc(ccc1Br)F 62a_200025704644_100000736370 [0,1,0,0,0,0|2,0,0]=3 5783 B11R1.182 [13CH3]SCc1cc(ccc1Br)I 62a_100012355412_200025704644 [0,1,0,0,0,0|2,0,0]=3 5784 B11R1.182 [13CH3]SCc1cc(ccc1Br)I 62a_200025704644_100012355412 [0,1,0,0,0,0|2,0,0]=3 5785 B11R1.182 [13CH3]SCc1cc(ccc1Cl)Br 62a_100000763347_200025704644 [0,1,0,0,0,0|2,0,0]=3 5786 B11R1.182 [13CH3]SCc1cc(ccc1Cl)Br 62a_200025704644_100000763347 [0,1,0,0,0,0|2,0,0]=3 5787 B11R1.182 [13CH3]SCc1cc(ccc1Cl)Cl 62a_100000756322_200025704644 [0,1,0,0,0,0|2,0,0]=3 5788 B11R1.182 [13CH3]SCc1cc(ccc1Cl)Cl 62a_200025704644_100000756322 [0,1,0,0,0,0|2,0,0]=3 5789 B11R1.182 [13CH3]SCc1cc(ccc1Cl)F 62a_100000709952_200025704644 [0,1,0,0,0,0|2,0,0]=3 5790 B11R1.182 [13CH3]SCc1cc(ccc1Cl)F 62a_200025704644_100000709952 [0,1,0,0,0,0|2,0,0]=3 5791 B11R1.182 [13CH3]SCc1cc(ccc1Cl)I 62a_100010188191_200025704644 [0,1,0,0,0,0|2,0,0]=3 5792 B11R1.182 [13CH3]SCc1cc(ccc1Cl)I 62a_200025704644_100010188191 [0,1,0,0,0,0|2,0,0]=3 5793 B11R1.182 [13CH3]SCc1cc(ccc1F)Br 62a_100000736399_200025704644 [0,1,0,0,0,0|2,0,0]=3 5794 B11R1.182 [13CH3]SCc1cc(ccc1F)Br 62a_200025704644_100000736399 [0,1,0,0,0,0|2,0,0]=3 5795 B11R1.182 [13CH3]SCc1cc(ccc1F)Cl 62a_100000716957_200025704644 [0,1,0,0,0,0|2,0,0]=3 5796 B11R1.182 [13CH3]SCc1cc(ccc1F)Cl 62a_200025704644_100000716957 [0,1,0,0,0,0|2,0,0]=3 5797 B11R1.182 [13CH3]SCc1cc(ccc1F)F 62a_100000685659_200025704644 [0,1,0,0,0,0|2,0,0]=3 5798 B11R1.182 [13CH3]SCc1cc(ccc1F)F 62a_200025704644_100000685659 [0,1,0,0,0,0|2,0,0]=3 5799 B11R1.182 [13CH3]SCc1cc(ccc1F)I 62a_200010149601_200025704644 [0,1,0,0,0,0|2,0,0]=3 5800 B11R1.182 [13CH3]SCc1cc(ccc1F)I 62a_200025704644_200010149601 [0,1,0,0,0,0|2,0,0]=3 5801 B11R1.182 [13CH3]SCc1cc(ccc1I)Br 62a_100012362523_200025704644 [0,1,0,0,0,0|2,0,0]=3 5802 B11R1.182 [13CH3]SCc1cc(ccc1I)Br 62a_200025704644_100012362523 [0,1,0,0,0,0|2,0,0]=3 5803 B11R1.182 [13CH3]SCc1cc(ccc1I)Cl 62a_100012348826_200025704644 [0,1,0,0,0,0|2,0,0]=3 5804 B11R1.182 [13CH3]SCc1cc(ccc1I)Cl 62a_200025704644_100012348826 [0,1,0,0,0,0|2,0,0]=3 5805 B11R1.182 [13CH3]SCc1cc(ccc1I)F 62a_100010149606_200025704644 [0,1,0,0,0,0|2,0,0]=3 5806 B11R1.182 [13CH3]SCc1cc(ccc1I)F 62a_200025704644_100010149606 [0,1,0,0,0,0|2,0,0]=3 5807 B11R1.182 [13CH3]SCc1cc(ccc1O)F 62a_100010161318_200025704644 [0,1,0,0,0,0|1,0,0]=2 5808 B11R1.182 [13CH3]SCc1cc(ccc1O)F 62a_200025704644_100010161318 [0,1,0,0,0,0|1,0,0]=2 5809 B11R1.182 [13CH3]SCc1cc(cnc1Br)Br 62a_100010253922_200025704644 [0,1,0,0,0,0|3,0,0]=4 5810 B11R1.182 [13CH3]SCc1cc(cnc1Br)Br 62a_200025704644_100010253922 [0,1,0,0,0,0|3,0,0]=4 5811 B11R1.182 [13CH3]SCc1cc(cnc1Cl)Br 62a_100009816982_200025704644 [0,1,0,0,0,0|3,0,0]=4 5812 B11R1.182 [13CH3]SCc1cc(cnc1Cl)Br 62a_200025704644_100009816982 [0,1,0,0,0,0|3,0,0]=4 5813 B11R1.182 [13CH3]SCc1nc(ccc1Cl)Cl 62a_100000059412_200025704644 [0,1,0,0,0,0|3,0,0]=4 5814 B11R1.182 [13CH3]SCc1nc(ccc1Cl)Cl 62a_200025704644_100000059412 [0,1,0,0,0,0|3,0,0]=4 5815 B11R1.182 [13CH3]SCc1nc(ccc1F)Br 62a_100010065826_200025704644 [0,1,0,0,0,0|3,0,0]=4 5816 B11R1.182 [13CH3]SCc1nc(ccc1F)Br 62a_200025704644_100010065826 [0,1,0,0,0,0|3,0,0]=4 5817 B11R1.182 [13CH3]SCc1nc(ccc1F)Cl 62a_100009881012_200025704644 [0,1,0,0,0,0|3,0,0]=4 5818 B11R1.182 [13CH3]SCc1nc(ccc1F)Cl 62a_200025704644_100009881012 [0,1,0,0,0,0|3,0,0]=4 5819 B11R1.222 CC(C#N)c1ccccc1O 271570a_203496583355_200010232107 [0,1,0,0,0,0|1,0,1]=3 5820 B11R1.222 CC(N[13CH3])c1ccccc1Br 2230a_100000181357_200025704644 [0,1,0,0,0,0|2,0,0]=3 5821 B11R1.222 CC(N[13CH3])c1ccccc1Cl 2230a_100000174978_200025704644 [0,1,0,0,0,0|2,0,0]=3 5822 B11R1.222 CC(N[13CH3])c1ccccc1Cl 34a_100000174978_200025704644 [0,1,0,0,0,0|2,0,0]=3 5823 B11R1.222 CC(N[13CH3])c1ccccc1F 2230a_100000181408_200025704644 [0,1,0,0,0,0|2,0,0]=3 5824 B11R1.222 CC(N[13CH3])c1ccccc1F 34a_100000181408_200025704644 [0,1,0,0,0,0|2,0,0]=3 5825 B11R1.222 CC(N[13CH3])c1cccnc1O 2230a_100159269580_200025704644 [0,1,0,0,0,0|2,0,0]=3 5826 B11R1.222 CC(N[13CH3])c1ncccc1Br 2230a_100159271932_200025704644 [0,1,0,0,0,0|3,0,0]=4 5827 B11R1.222 CC(O[13CH3])c1ccccc1Br 34a_100000702211_200025704644 [0,1,0,0,0,0|2,0,0]=3 5828 B11R1.222 CC(O[13CH3])c1ccccc1Br 7a_100000702211_200025704644 [0,1,0,0,0,0|2,0,0]=3 5829 B11R1.222 CC(O[13CH3])c1ccccc1Cl 34a_100000740796_200025704644 [0,1,0,0,0,0|2,0,0]=3 5830 B11R1.222 CC(O[13CH3])c1ccccc1Cl 7a_100000740796_200025704644 [0,1,0,0,0,0|2,0,0]=3 5831 B11R1.222 CC(O[13CH3])c1ccccc1F 34a_100000697922_200025704644 [0,1,0,0,0,0|2,0,0]=3 5832 B11R1.222 CC(O[13CH3])c1ccccc1F 7a_100000697922_200025704644 [0,1,0,0,0,0|2,0,0]=3 5833 B11R1.222 CC(O[13CH3])c1ccccc1N 7a_100011405641_200025704644 [0,1,0,0,0,0|2,0,0]=3 5834 B11R1.222 CC(O[13CH3])c1cccnc1Cl 34a_100009865335_200025704644 [0,1,0,0,0,0|3,0,0]=4 5835 B11R1.222 CC(O[13CH3])c1cccnc1Cl 7a_100009865335_200025704644 [0,1,0,0,0,0|3,0,0]=4 5836 B11R1.222 CC(O[13CH3])c1ccncc1F 34a_100012180158_200025704644 [0,1,0,0,0,0|3,0,0]=4 5837 B11R1.222 CC(S[13CH3])c1ccccc1Cl 62a_100000181259_200025704644 [0,1,0,0,0,0|2,0,0]=3 5838 B11R1.222 CC(S[13CH3])c1ccccc1Cl 62a_200025704644_100000181259 [0,1,0,0,0,0|2,0,0]=3 5839 B11R1.222 CC(S[13CH3])c1ccccc1F 62a_200000741388_200025704644 [0,1,0,0,0,0|2,0,0]=3 5840 B11R1.222 CC(S[13CH3])c1ccccc1F 62a_200025704644_200000741388 [0,1,0,0,0,0|2,0,0]=3 5841 B11R1.222 CCC(=O)c1ccccc1Br 1458a_100000188424_100000210202 [0,1,0,0,0,0|1,0,1]=3 5842 B11R1.222 CCC(=O)c1ccccc1C 1458a_100000212026_100000210202 [0,1,0,0,0,0|1,0,1]=3 5843 B11R1.222 CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210202 [0,1,0,0,0,0|1,0,1]=3 5844 B11R1.222 CCC(=O)c1ccccc1F 1458a_100000188656_100000210202 [0,1,0,0,0,0|1,0,1]=3 5845 B11R1.222 CCC(=O)c1ccccc1I 1458a_100000187884_100000210202 [0,1,0,0,0,0|1,0,1]=3 5846 B11R1.222 CCC(=O)c1ccccc1O 1458a_100015234032_100000210202 [0,1,0,0,0,0|0,0,1]=2 5847 B11R1.222 CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210202 [0,1,0,0,0,0|0,0,2]=3 5848 B11R1.222 CCN(C)c1ccccc1Br 2230a_100020606079_100000210202 [0,1,0,0,0,0|2,0,0]=3 5849 B11R1.222 CCN(C)c1ccccc1Br 2230a_114873767003_200000210301 [0,1,0,0,0,0|2,0,0]=3 5850 B11R1.222 CCN(C)c1ccccc1Br 269982a_100020606079_100000204670 [0,1,0,0,0,0|2,0,0]=3 5851 B11R1.222 CCN(C)c1ccccc1Br 269982a_114873767003_200000210301 [0,1,0,0,0,0|2,0,0]=3 5852 B11R1.222 CCN(C)c1ccccc1Br 34a_100020606079_100000210202 [0,1,0,0,0,0|2,0,0]=3 5853 B11R1.222 CCN(C)c1ccccc1Br 34a_114873767003_200000210301 [0,1,0,0,0,0|2,0,0]=3 5854 B11R1.222 CCN(C)c1ccccc1C 2230a_100000211084_200000210301 [0,1,0,0,0,0|2,0,0]=3 5855 B11R1.222 CCN(C)c1ccccc1C 2230a_100000219699_100000210202 [0,1,0,0,0,0|2,0,0]=3 5856 B11R1.222 CCN(C)c1ccccc1C 269982a_100000211084_200000210301 [0,1,0,0,0,0|2,0,0]=3 5857 B11R1.222 CCN(C)c1ccccc1C 269982a_100000219699_100000204670 [0,1,0,0,0,0|2,0,0]=3 5858 B11R1.222 CCN(C)c1ccccc1C 34a_100000211084_200000210301 [0,1,0,0,0,0|2,0,0]=3 5859 B11R1.222 CCN(C)c1ccccc1C 34a_100000219699_100000210202 [0,1,0,0,0,0|2,0,0]=3 5860 B11R1.222 CCN(C)c1ccccc1Cl 2230a_100000219374_100000210202 [0,1,0,0,0,0|2,0,0]=3 5861 B11R1.222 CCN(C)c1ccccc1Cl 269982a_100000219374_100000204670 [0,1,0,0,0,0|2,0,0]=3 5862 B11R1.222 CCN(C)c1ccccc1Cl 34a_100000219374_100000210202 [0,1,0,0,0,0|2,0,0]=3 5863 B11R1.222 CCN(C)c1ccccc1F 2230a_100000220357_100000210202 [0,1,0,0,0,0|2,0,0]=3 5864 B11R1.222 CCN(C)c1ccccc1F 2230a_100000220365_200000210301 [0,1,0,0,0,0|2,0,0]=3 5865 B11R1.222 CCN(C)c1ccccc1F 269982a_100000220357_100000204670 [0,1,0,0,0,0|2,0,0]=3 5866 B11R1.222 CCN(C)c1ccccc1F 269982a_100000220365_200000210301 [0,1,0,0,0,0|2,0,0]=3 5867 B11R1.222 CCN(C)c1ccccc1F 34a_100000220357_100000210202 [0,1,0,0,0,0|2,0,0]=3 5868 B11R1.222 CCN(C)c1ccccc1F 34a_100000220365_200000210301 [0,1,0,0,0,0|2,0,0]=3 5869 B11R1.222 CCN(C)c1ccccc1F 38a_100000220357_100000204670 [0,1,0,0,0,0|2,0,0]=3 5870 B11R1.222 CCN(C)c1ccccc1O 269982a_100000033821_100000204670 [0,1,0,0,0,0|1,0,0]=2 5871 B11R1.222 CCN(C)c1ccccc1O 269982a_103624766699_200000210301 [0,1,0,0,0,0|1,0,0]=2 5872 B11R1.222 CCN([13CH3])c1ccccc1Br 2230a_114873767003_200025704644 [0,1,0,0,0,0|2,0,0]=3 5873 B11R1.222 CCN([13CH3])c1ccccc1Br 269982a_114873767003_200025704644 [0,1,0,0,0,0|2,0,0]=3 5874 B11R1.222 CCN([13CH3])c1ccccc1Br 34a_114873767003_200025704644 [0,1,0,0,0,0|2,0,0]=3 5875 B11R1.222 CCN([13CH3])c1ccccc1C 2230a_100000211084_200025704644 [0,1,0,0,0,0|2,0,0]=3 5876 B11R1.222 CCN([13CH3])c1ccccc1C 269982a_100000211084_200025704644 [0,1,0,0,0,0|2,0,0]=3 5877 B11R1.222 CCN([13CH3])c1ccccc1C 34a_100000211084_200025704644 [0,1,0,0,0,0|2,0,0]=3 5878 B11R1.222 CCN([13CH3])c1ccccc1F 2230a_100000220365_200025704644 [0,1,0,0,0,0|2,0,0]=3 5879 B11R1.222 CCN([13CH3])c1ccccc1F 269982a_100000220365_200025704644 [0,1,0,0,0,0|2,0,0]=3 5880 B11R1.222 CCN([13CH3])c1ccccc1F 34a_100000220365_200025704644 [0,1,0,0,0,0|2,0,0]=3 5881 B11R1.222 CCN([13CH3])c1ccccc1O 269982a_103624766699_200025704644 [0,1,0,0,0,0|1,0,0]=2 5882 B11R1.222 CN(CF)c1ccccc1Br 269982a_100020606079_100015361967 [0,1,0,0,0,0|3,0,0]=4 5883 B11R1.222 CN(CF)c1ccccc1Br 34a_100020606079_100015361967 [0,1,0,0,0,0|3,0,0]=4 5884 B11R1.222 CN(CF)c1ccccc1Cl 269982a_100000219374_100015361967 [0,1,0,0,0,0|3,0,0]=4 5885 B11R1.222 CN(CF)c1ccccc1Cl 34a_100000219374_100015361967 [0,1,0,0,0,0|3,0,0]=4 5886 B11R1.222 CN(CF)c1ccccc1F 269982a_100000220357_100015361967 [0,1,0,0,0,0|3,0,0]=4 5887 B11R1.222 CN(CF)c1ccccc1F 34a_100000220357_100015361967 [0,1,0,0,0,0|3,0,0]=4 5888 B11R1.222 CN(CF)c1ccccc1F 38a_100000220357_100015361967 [0,1,0,0,0,0|3,0,0]=4 5889 B11R1.222 CN(CF)c1ccccc1O 269982a_100000033821_100015361967 [0,1,0,0,0,0|2,0,0]=3 5890 B11R1.222 CNC(=O)c1ccccc1Br 11a_106832991635_100000188424 [0,1,0,0,0,0|2,0,1]=4 5891 B11R1.222 CNC(=O)c1ccccc1Br 1626a_100102657272_100000188424 [0,1,0,0,0,0|2,0,1]=4 5892 B11R1.222 CNC(=O)c1ccccc1Br 240690a_100102657272_100000188424 [0,1,0,0,0,0|2,0,1]=4 5893 B11R1.222 CNC(=O)c1ccccc1Br 527a_100102657272_100000188424 [0,1,0,0,0,0|2,0,1]=4 5894 B11R1.222 CNC(=O)c1ccccc1C 11a_106832991635_100000212026 [0,1,0,0,0,0|2,0,1]=4 5895 B11R1.222 CNC(=O)c1ccccc1C 1626a_100102657272_100000212026 [0,1,0,0,0,0|2,0,1]=4 5896 B11R1.222 CNC(=O)c1ccccc1C 240690a_100102657272_100000212026 [0,1,0,0,0,0|2,0,1]=4 5897 B11R1.222 CNC(=O)c1ccccc1C 527a_100102657272_100000212026 [0,1,0,0,0,0|2,0,1]=4 5898 B11R1.222 CNC(=O)c1ccccc1Cl 11a_106832991635_100000185844 [0,1,0,0,0,0|2,0,1]=4 5899 B11R1.222 CNC(=O)c1ccccc1Cl 1626a_100102657272_100000185844 [0,1,0,0,0,0|2,0,1]=4 5900 B11R1.222 CNC(=O)c1ccccc1Cl 240690a_100102657272_100000185844 [0,1,0,0,0,0|2,0,1]=4 5901 B11R1.222 CNC(=O)c1ccccc1Cl 527a_100102657272_100000185844 [0,1,0,0,0,0|2,0,1]=4 5902 B11R1.222 CNC(=O)c1ccccc1F 11a_106832991635_100000188656 [0,1,0,0,0,0|2,0,1]=4 5903 B11R1.222 CNC(=O)c1ccccc1F 1626a_100102657272_100000188656 [0,1,0,0,0,0|2,0,1]=4 5904 B11R1.222 CNC(=O)c1ccccc1F 240690a_100102657272_100000188656 [0,1,0,0,0,0|2,0,1]=4 5905 B11R1.222 CNC(=O)c1ccccc1F 527a_100102657272_100000188656 [0,1,0,0,0,0|2,0,1]=4 5906 B11R1.222 CNC(=O)c1ccccc1I 11a_106832991635_100000187884 [0,1,0,0,0,0|2,0,1]=4 5907 B11R1.222 CNC(=O)c1ccccc1I 1626a_100102657272_100000187884 [0,1,0,0,0,0|2,0,1]=4 5908 B11R1.222 CNC(=O)c1ccccc1I 240690a_100102657272_100000187884 [0,1,0,0,0,0|2,0,1]=4 5909 B11R1.222 CNC(=O)c1ccccc1I 527a_100102657272_100000187884 [0,1,0,0,0,0|2,0,1]=4 5910 B11R1.222 CNC(=O)c1ccccc1O 240690a_100102657272_100015234032 [0,1,0,0,0,0|1,0,1]=3 5911 B11R1.222 CNC(=O)c1ccccc1O 271570a_203496583355_100000155073 [0,1,0,0,0,0|1,0,1]=3 5912 B11R1.222 CNC(=O)c1ccccc1[O-] 1626a_100102657272_100009911694 [0,1,0,0,0,0|1,0,2]=4 5913 B11R1.222 CNC(=O)c1ccccc1[O-] 240690a_100102657272_100009911694 [0,1,0,0,0,0|1,0,2]=4 5914 B11R1.222 CNC(=O)c1ccccc1[O-] 527a_100102657272_100009911694 [0,1,0,0,0,0|1,0,2]=4 5915 B11R1.222 CNC(=O)c1cccnc1O 271570a_203496583355_100000159833 [0,1,0,0,0,0|2,0,1]=4 5916 B11R1.222 CNC(C)c1ccccc1Br 2230a_100000181357_200000210301 [0,1,0,0,0,0|2,0,0]=3 5917 B11R1.222 CNC(C)c1ccccc1Br 269862a_106832991636_100000187085 [0,1,0,0,0,0|2,0,0]=3 5918 B11R1.222 CNC(C)c1ccccc1C 2230a_100000181355_200000210301 [0,1,0,0,0,0|2,0,0]=3 5919 B11R1.222 CNC(C)c1ccccc1C 269862a_106832991636_100000211656 [0,1,0,0,0,0|2,0,0]=3 5920 B11R1.222 CNC(C)c1ccccc1C 34a_100000181355_200000210301 [0,1,0,0,0,0|2,0,0]=3 5921 B11R1.222 CNC(C)c1ccccc1Cl 2230a_100000174978_200000210301 [0,1,0,0,0,0|2,0,0]=3 5922 B11R1.222 CNC(C)c1ccccc1Cl 2230a_106832991635_100000181259 [0,1,0,0,0,0|2,0,0]=3 5923 B11R1.222 CNC(C)c1ccccc1Cl 269862a_106832991636_100000210134 [0,1,0,0,0,0|2,0,0]=3 5924 B11R1.222 CNC(C)c1ccccc1Cl 34a_100000174978_200000210301 [0,1,0,0,0,0|2,0,0]=3 5925 B11R1.222 CNC(C)c1ccccc1Cl 7a_106832991635_100000181259 [0,1,0,0,0,0|2,0,0]=3 5926 B11R1.222 CNC(C)c1ccccc1F 2230a_100000181408_200000210301 [0,1,0,0,0,0|2,0,0]=3 5927 B11R1.222 CNC(C)c1ccccc1F 2230a_106832991635_200000741388 [0,1,0,0,0,0|2,0,0]=3 5928 B11R1.222 CNC(C)c1ccccc1F 269862a_106832991636_100000210632 [0,1,0,0,0,0|2,0,0]=3 5929 B11R1.222 CNC(C)c1ccccc1F 34a_100000181408_200000210301 [0,1,0,0,0,0|2,0,0]=3 5930 B11R1.222 CNC(C)c1ccccc1F 34a_100102657272_200000741388 [0,1,0,0,0,0|2,0,0]=3 5931 B11R1.222 CNC(C)c1ccccc1F 7a_106832991635_200000741388 [0,1,0,0,0,0|2,0,0]=3 5932 B11R1.222 CNC(C)c1ccccc1I 269862a_106832991636_100000751169 [0,1,0,0,0,0|2,0,0]=3 5933 B11R1.222 CNC(C)c1ccccc1O 271570a_203496583355_100000692418 [0,1,0,0,0,0|1,0,0]=2 5934 B11R1.222 CNC(C)c1cccnc1C 269862a_106832991636_100011995960 [0,1,0,0,0,0|3,0,0]=4 5935 B11R1.222 CNC(C)c1cccnc1O 2230a_100159269580_200000210301 [0,1,0,0,0,0|2,0,0]=3 5936 B11R1.222 CNC(C)c1ccncc1Br 269862a_106832991636_100009993184 [0,1,0,0,0,0|3,0,0]=4 5937 B11R1.222 CNC(C)c1ccncc1Cl 269862a_106832991636_100012001414 [0,1,0,0,0,0|3,0,0]=4 5938 B11R1.222 CNC(C)c1ccncc1F 269862a_106832991636_100000727669 [0,1,0,0,0,0|3,0,0]=4 5939 B11R1.222 CNC(C)c1cnccc1C 269862a_106832991636_100000693228 [0,1,0,0,0,0|3,0,0]=4 5940 B11R1.222 CNC(C)c1cnccc1Cl 269862a_106832991636_100160469449 [0,1,0,0,0,0|3,0,0]=4 5941 B11R1.222 CNC(C)c1ncccc1Br 2230a_100159271932_200000210301 [0,1,0,0,0,0|3,0,0]=4 5942 B11R1.222 CNC(C)c1ncccc1Br 269862a_106832991636_100012348690 [0,1,0,0,0,0|3,0,0]=4 5943 B11R1.222 CNC(C)c1ncccc1C 2230a_100011536111_200000210301 [0,1,0,0,0,0|3,0,0]=4 5944 B11R1.222 CNC(C)c1ncccc1C 269862a_106832991636_100011536074 [0,1,0,0,0,0|3,0,0]=4 5945 B11R1.222 CNC(C)c1ncccc1Cl 269862a_106832991636_100015267551 [0,1,0,0,0,0|3,0,0]=4 5946 B11R1.222 CNC(C)c1ncccc1F 269862a_106832991636_100011997767 [0,1,0,0,0,0|3,0,0]=4 5947 B11R1.222 CNC(C)c1ncccc1I 269862a_106832991636_200015599370 [0,1,0,0,0,0|3,0,0]=4 5948 B11R1.222 CN[C@H](C)c1ccccc1O 2230a_100025703389_200000210301 [0,1,0,0,0,0|1,0,0]=2 5949 B11R1.222 COC(=O)c1ccccc1O 271570a_203496583355_100000148710 [0,1,0,0,0,0|1,0,1]=3 5950 B11R1.222 COC(=O)c1cccnc1O 271570a_203496583355_100000150852 [0,1,0,0,0,0|2,0,1]=4 5951 B11R1.222 COC(=O)c1ccncc1O 271570a_203496583355_100010008606 [0,1,0,0,0,0|2,0,1]=4 5952 B11R1.222 COC(=O)c1cnccc1O 271570a_203496583355_100020629055 [0,1,0,0,0,0|2,0,1]=4 5953 B11R1.222 COC(=O)c1ncccc1O 271570a_203496583355_100011935214 [0,1,0,0,0,0|2,0,1]=4 5954 B11R1.222 COC(C)c1ccccc1Br 34a_100000702211_200000210301 [0,1,0,0,0,0|2,0,0]=3 5955 B11R1.222 COC(C)c1ccccc1Br 7a_100000702211_200000210301 [0,1,0,0,0,0|2,0,0]=3 5956 B11R1.222 COC(C)c1ccccc1C 34a_100000742021_200000210301 [0,1,0,0,0,0|2,0,0]=3 5957 B11R1.222 COC(C)c1ccccc1C 7a_100000742021_200000210301 [0,1,0,0,0,0|2,0,0]=3 5958 B11R1.222 COC(C)c1ccccc1Cl 34a_100000740796_200000210301 [0,1,0,0,0,0|2,0,0]=3 5959 B11R1.222 COC(C)c1ccccc1Cl 7a_100000740796_200000210301 [0,1,0,0,0,0|2,0,0]=3 5960 B11R1.222 COC(C)c1ccccc1F 34a_100000697922_200000210301 [0,1,0,0,0,0|2,0,0]=3 5961 B11R1.222 COC(C)c1ccccc1F 34a_100138415774_200000741388 [0,1,0,0,0,0|2,0,0]=3 5962 B11R1.222 COC(C)c1ccccc1F 7a_100000697922_200000210301 [0,1,0,0,0,0|2,0,0]=3 5963 B11R1.222 COC(C)c1ccccc1N 7a_100011405641_200000210301 [0,1,0,0,0,0|2,0,0]=3 5964 B11R1.222 COC(C)c1cccnc1Cl 34a_100009865335_200000210301 [0,1,0,0,0,0|3,0,0]=4 5965 B11R1.222 COC(C)c1cccnc1Cl 7a_100009865335_200000210301 [0,1,0,0,0,0|3,0,0]=4 5966 B11R1.222 COC(C)c1ccncc1F 34a_100012180158_200000210301 [0,1,0,0,0,0|3,0,0]=4 5967 B11R1.222 CO[C@@H](C)c1ncccc1Br 7a_100013325542_200000210301 [0,1,0,0,0,0|3,0,0]=4 5968 B11R1.222 CO[C@@H](C)c1ncccc1O 271570a_203496583355_106256553109 [0,1,0,0,0,0|2,0,0]=3 5969 B11R1.222 CSC(C)c1ccccc1Cl 62a_100000181259_200000210301 [0,1,0,0,0,0|2,0,0]=3 5970 B11R1.222 CSC(C)c1ccccc1Cl 62a_200000210301_100000181259 [0,1,0,0,0,0|2,0,0]=3 5971 B11R1.222 CSC(C)c1ccccc1F 62a_200000210301_200000741388 [0,1,0,0,0,0|2,0,0]=3 5972 B11R1.222 CSC(C)c1ccccc1F 62a_200000741388_200000210301 [0,1,0,0,0,0|2,0,0]=3 5973 B11R1.222 C[C@@H](N[13CH3])c1ccccc1O 2230a_100025703389_200025704644 [0,1,0,0,0,0|1,0,0]=2 5974 B11R1.222 C[C@H](O[13CH3])c1ncccc1Br 7a_100013325542_200025704644 [0,1,0,0,0,0|3,0,0]=4 5975 B11R1.222 Cc1ccccc1C(=O)CF 1458a_100000212026_100015361967 [0,1,0,0,0,0|2,0,1]=4 5976 B11R1.222 Cc1ccccc1C(C)N[13CH3] 2230a_100000181355_200025704644 [0,1,0,0,0,0|2,0,0]=3 5977 B11R1.222 Cc1ccccc1C(C)N[13CH3] 34a_100000181355_200025704644 [0,1,0,0,0,0|2,0,0]=3 5978 B11R1.222 Cc1ccccc1C(C)O[13CH3] 34a_100000742021_200025704644 [0,1,0,0,0,0|2,0,0]=3 5979 B11R1.222 Cc1ccccc1C(C)O[13CH3] 7a_100000742021_200025704644 [0,1,0,0,0,0|2,0,0]=3 5980 B11R1.222 Cc1ccccc1N(C)CF 269982a_100000219699_100015361967 [0,1,0,0,0,0|3,0,0]=4 5981 B11R1.222 Cc1ccccc1N(C)CF 34a_100000219699_100015361967 [0,1,0,0,0,0|3,0,0]=4 5982 B11R1.222 Cc1cccnc1C(C)N[13CH3] 2230a_100011536111_200025704644 [0,1,0,0,0,0|3,0,0]=4 5983 B11R1.222 NCC(O)c1ccccc1O 271570a_203496583355_100011236429 [0,1,0,0,0,0|1,0,0]=2 5984 B11R1.222 NNC(=O)c1ccccc1O 271570a_203496583355_100000190081 [0,1,0,0,0,0|2,0,1]=4 5985 B11R1.222 N[C@H](CO)c1ccccc1O 271570a_203496583355_100161155918 [0,1,0,0,0,0|1,0,0]=2 5986 B11R1.222 O=C(CF)c1ccccc1Br 1458a_100000188424_100015361967 [0,1,0,0,0,0|2,0,1]=4 5987 B11R1.222 O=C(CF)c1ccccc1Cl 1458a_100000185844_100015361967 [0,1,0,0,0,0|2,0,1]=4 5988 B11R1.222 O=C(CF)c1ccccc1F 1458a_100000188656_100015361967 [0,1,0,0,0,0|2,0,1]=4 5989 B11R1.222 O=C(CF)c1ccccc1I 1458a_100000187884_100015361967 [0,1,0,0,0,0|2,0,1]=4 5990 B11R1.222 O=C(CF)c1ccccc1O 1458a_100015234032_100015361967 [0,1,0,0,0,0|1,0,1]=3 5991 B11R1.222 O=C(CF)c1ccccc1[O-] 1458a_100009911694_100015361967 [0,1,0,0,0,0|1,0,2]=4 5992 B11R1.605 C=C=Cc1c(cccc1Br)O 271570a_100015277604_100010187912 [0,1,0,0,0,0|0,0,3]=4 5993 B11R1.605 C=C=Cc1c(cccc1Cl)O 271570a_100015277604_100000050174 [0,1,0,0,0,0|0,0,3]=4 5994 B11R1.605 C=C=Cc1c(cccc1F)O 271570a_100015277604_100009820682 [0,1,0,0,0,0|0,0,3]=4 5995 B11R1.605 C=C=Cc1c(cccc1O)C 271570a_100015277604_100000686692 [0,1,0,0,0,0|0,0,3]=4 5996 B11R1.605 C=C=Cc1c(cccc1O)N 271570a_100015277604_100012183704 [0,1,0,0,0,0|0,0,3]=4 5997 B11R1.605 C=C=Cc1c(cccc1O)O 271570a_100015277604_100010205330 [0,1,0,0,0,0|0,0,3]=4 5998 B11R1.605 C=CCc1c(ccnc1F)O 271570a_203496583355_200010238768 [0,1,0,0,0,0|1,0,2]=4 5999 B11R1.605 CC=Cc1c(cccc1Br)Br 271570a_100016259895_100009994525 [0,1,0,0,0,0|1,0,2]=4 6000 B11R1.605 CC=Cc1c(cccc1Br)Cl 271570a_100016259895_100010214488 [0,1,0,0,0,0|1,0,2]=4 6001 B11R1.605 CC=Cc1c(cccc1Br)F 271570a_100016259895_100011219512 [0,1,0,0,0,0|1,0,2]=4 6002 B11R1.605 CC=Cc1c(cccc1Br)N 271570a_100016259895_100020590159 [0,1,0,0,0,0|1,0,2]=4 6003 B11R1.605 CC=Cc1c(cccc1Br)O 271570a_100016259895_100010187912 [0,1,0,0,0,0|0,0,2]=3 6004 B11R1.605 CC=Cc1c(cccc1C)C 271570a_100016259895_100000033847 [0,1,0,0,0,0|1,0,2]=4 6005 B11R1.605 CC=Cc1c(cccc1Cl)C 271570a_100016259895_100000043165 [0,1,0,0,0,0|1,0,2]=4 6006 B11R1.605 CC=Cc1c(cccc1Cl)Cl 271570a_100016259895_100000034237 [0,1,0,0,0,0|1,0,2]=4 6007 B11R1.605 CC=Cc1c(cccc1Cl)F 271570a_100016259895_100000050007 [0,1,0,0,0,0|1,0,2]=4 6008 B11R1.605 CC=Cc1c(cccc1Cl)N 271570a_100016259895_100000049713 [0,1,0,0,0,0|1,0,2]=4 6009 B11R1.605 CC=Cc1c(cccc1Cl)O 271570a_100016259895_100000050174 [0,1,0,0,0,0|0,0,2]=3 6010 B11R1.605 CC=Cc1c(cccc1F)C 271570a_100016259895_100012349962 [0,1,0,0,0,0|1,0,2]=4 6011 B11R1.605 CC=Cc1c(cccc1F)F 271570a_100016259895_100000693133 [0,1,0,0,0,0|1,0,2]=4 6012 B11R1.605 CC=Cc1c(cccc1F)N 271570a_100016259895_100011934729 [0,1,0,0,0,0|1,0,2]=4 6013 B11R1.605 CC=Cc1c(cccc1F)O 271570a_100016259895_100009820682 [0,1,0,0,0,0|0,0,2]=3 6014 B11R1.605 CC=Cc1c(cccc1N)C 271570a_100016259895_100000684715 [0,1,0,0,0,0|1,0,2]=4 6015 B11R1.605 CC=Cc1c(cccc1O)C 271570a_100016259895_100000686692 [0,1,0,0,0,0|0,0,2]=3 6016 B11R1.605 CC=Cc1c(cccc1O)N 271570a_100016259895_100012183704 [0,1,0,0,0,0|0,0,2]=3 6017 B11R1.605 CC=Cc1c(cccc1O)O 271570a_100016259895_100010205330 [0,1,0,0,0,0|0,0,2]=3 6018 B11R1.605 CC=Cc1c(ccnc1O)C 271570a_100016259895_100012000493 [0,1,0,0,0,0|1,0,2]=4 6019 B11R1.605 CC=Cc1c(ccnc1O)O 271570a_100016259895_200009817435 [0,1,0,0,0,0|1,0,2]=4 6020 B11R1.605 CCNc1c(cccc1Br)Br 34a_100000690995_100000210202 [0,1,0,0,0,0|2,0,0]=3 6021 B11R1.605 CCNc1c(cccc1Br)C 34a_100011834072_100000210202 [0,1,0,0,0,0|2,0,0]=3 6022 B11R1.605 CCNc1c(cccc1Br)Cl 34a_100102946385_100000210202 [0,1,0,0,0,0|2,0,0]=3 6023 B11R1.605 CCNc1c(cccc1Br)F 34a_100000684712_100000210202 [0,1,0,0,0,0|2,0,0]=3 6024 B11R1.605 CCNc1c(cccc1Br)O 34a_100011934926_100000210202 [0,1,0,0,0,0|1,0,0]=2 6025 B11R1.605 CCNc1c(cccc1C)C 34a_100000185769_100000210202 [0,1,0,0,0,0|2,0,0]=3 6026 B11R1.605 CCNc1c(cccc1Cl)C 34a_100000756524_100000210202 [0,1,0,0,0,0|2,0,0]=3 6027 B11R1.605 CCNc1c(cccc1Cl)Cl 34a_100000210028_100000210202 [0,1,0,0,0,0|2,0,0]=3 6028 B11R1.605 CCNc1c(cccc1Cl)F 34a_100000760031_100000210202 [0,1,0,0,0,0|2,0,0]=3 6029 B11R1.605 CCNc1c(cccc1Cl)O 34a_100012022510_100000210202 [0,1,0,0,0,0|1,0,0]=2 6030 B11R1.605 CCNc1c(cccc1F)C 34a_100000766463_100000210202 [0,1,0,0,0,0|2,0,0]=3 6031 B11R1.605 CCNc1c(cccc1F)F 2230a_100000210704_100000210202 [0,1,0,0,0,0|2,0,0]=3 6032 B11R1.605 CCNc1c(cccc1F)F 34a_100000210704_100000210202 [0,1,0,0,0,0|2,0,0]=3 6033 B11R1.605 CCNc1c(cccc1F)O 34a_100020591140_100000210202 [0,1,0,0,0,0|1,0,0]=2 6034 B11R1.605 CCNc1c(cccc1I)F 34a_100000042321_100000210202 [0,1,0,0,0,0|2,0,0]=3 6035 B11R1.605 CCNc1c(cccc1O)C 34a_100000743429_100000210202 [0,1,0,0,0,0|1,0,0]=2 6036 B11R1.605 CCNc1c(ccnc1F)C 27a_100015525214_100009818256 [0,1,0,0,0,0|3,0,0]=4 6037 B11R1.605 CCNc1c(ccnc1F)F 27a_100015525214_100009874084 [0,1,0,0,0,0|3,0,0]=4 6038 B11R1.605 CCOc1c(cccc1Br)Br 34a_100000736428_100000210202 [0,1,0,0,0,0|2,0,0]=3 6039 B11R1.605 CCOc1c(cccc1Br)Br 7a_100000736428_100000210202 [0,1,0,0,0,0|2,0,0]=3 6040 B11R1.605 CCOc1c(cccc1Br)C 34a_100009817157_100000210202 [0,1,0,0,0,0|2,0,0]=3 6041 B11R1.605 CCOc1c(cccc1Br)C 7a_100009817157_100000210202 [0,1,0,0,0,0|2,0,0]=3 6042 B11R1.605 CCOc1c(cccc1Br)Cl 34a_100010214474_100000210202 [0,1,0,0,0,0|2,0,0]=3 6043 B11R1.605 CCOc1c(cccc1Br)Cl 7a_100010214474_100000210202 [0,1,0,0,0,0|2,0,0]=3 6044 B11R1.605 CCOc1c(cccc1Br)F 34a_100009813666_100000210202 [0,1,0,0,0,0|2,0,0]=3 6045 B11R1.605 CCOc1c(cccc1Br)F 7a_100009813666_100000210202 [0,1,0,0,0,0|2,0,0]=3 6046 B11R1.605 CCOc1c(cccc1Br)N 34a_100011934915_100000210202 [0,1,0,0,0,0|2,0,0]=3 6047 B11R1.605 CCOc1c(cccc1C)C 34a_100000210341_100000210202 [0,1,0,0,0,0|2,0,0]=3 6048 B11R1.605 CCOc1c(cccc1C)C 7a_100000210341_100000210202 [0,1,0,0,0,0|2,0,0]=3 6049 B11R1.605 CCOc1c(cccc1Cl)C 34a_100000033731_100000210202 [0,1,0,0,0,0|2,0,0]=3 6050 B11R1.605 CCOc1c(cccc1Cl)C 7a_100000033731_100000210202 [0,1,0,0,0,0|2,0,0]=3 6051 B11R1.605 CCOc1c(cccc1Cl)Cl 34a_100000211709_100000210202 [0,1,0,0,0,0|2,0,0]=3 6052 B11R1.605 CCOc1c(cccc1Cl)Cl 7a_100000211709_100000210202 [0,1,0,0,0,0|2,0,0]=3 6053 B11R1.605 CCOc1c(cccc1Cl)F 34a_100000694953_100000210202 [0,1,0,0,0,0|2,0,0]=3 6054 B11R1.605 CCOc1c(cccc1Cl)F 7a_100000694953_100000210202 [0,1,0,0,0,0|2,0,0]=3 6055 B11R1.605 CCOc1c(cccc1Cl)N 34a_100000754742_100000210202 [0,1,0,0,0,0|2,0,0]=3 6056 B11R1.605 CCOc1c(cccc1F)C 34a_100011659162_100000210202 [0,1,0,0,0,0|2,0,0]=3 6057 B11R1.605 CCOc1c(cccc1F)C 7a_100011659162_100000210202 [0,1,0,0,0,0|2,0,0]=3 6058 B11R1.605 CCOc1c(cccc1F)F 34a_100000230165_100000210202 [0,1,0,0,0,0|2,0,0]=3 6059 B11R1.605 CCOc1c(cccc1F)F 7a_100000230165_100000210202 [0,1,0,0,0,0|2,0,0]=3 6060 B11R1.605 CCOc1c(cccc1F)N 34a_100011934987_100000210202 [0,1,0,0,0,0|2,0,0]=3 6061 B11R1.605 CCOc1c(cccc1F)O 271570a_203496583355_100010232518 [0,1,0,0,0,0|1,0,0]=2 6062 B11R1.605 CCOc1c(cccc1I)Br 34a_100010084509_100000210202 [0,1,0,0,0,0|2,0,0]=3 6063 B11R1.605 CCOc1c(cccc1I)Br 7a_100010084509_100000210202 [0,1,0,0,0,0|2,0,0]=3 6064 B11R1.605 CCOc1c(cccc1I)Cl 34a_100010202889_100000210202 [0,1,0,0,0,0|2,0,0]=3 6065 B11R1.605 CCOc1c(cccc1I)Cl 7a_100010202889_100000210202 [0,1,0,0,0,0|2,0,0]=3 6066 B11R1.605 CCOc1c(cccc1I)F 34a_100010186298_100000210202 [0,1,0,0,0,0|2,0,0]=3 6067 B11R1.605 CCOc1c(cccc1I)F 7a_100010186298_100000210202 [0,1,0,0,0,0|2,0,0]=3 6068 B11R1.605 CCOc1c(cccc1I)N 34a_100010084371_100000210202 [0,1,0,0,0,0|2,0,0]=3 6069 B11R1.605 CCOc1c(cccc1N)C 34a_100000756359_100000210202 [0,1,0,0,0,0|2,0,0]=3 6070 B11R1.605 CCOc1c(cccc1N)C 7a_100000756359_100000210202 [0,1,0,0,0,0|2,0,0]=3 6071 B11R1.605 CCOc1c(cccc1N)N 34a_200016994477_100000210202 [0,1,0,0,0,0|2,0,0]=3 6072 B11R1.605 CCOc1c(ccnc1C)C 34a_100011934651_100000210202 [0,1,0,0,0,0|3,0,0]=4 6073 B11R1.605 CCOc1c(ccnc1C)C 7a_100011934651_100000210202 [0,1,0,0,0,0|3,0,0]=4 6074 B11R1.605 CCOc1c(ccnc1Cl)C 34a_100000696282_100000210202 [0,1,0,0,0,0|3,0,0]=4 6075 B11R1.605 CCOc1c(ccnc1Cl)C 7a_100000696282_100000210202 [0,1,0,0,0,0|3,0,0]=4 6076 B11R1.605 CCOc1c(ccnc1Cl)Cl 34a_100000118450_100000210202 [0,1,0,0,0,0|3,0,0]=4 6077 B11R1.605 CCOc1c(ccnc1Cl)Cl 7a_100000118450_100000210202 [0,1,0,0,0,0|3,0,0]=4 6078 B11R1.605 CCOc1c(ccnc1Cl)F 34a_100009867227_100000210202 [0,1,0,0,0,0|3,0,0]=4 6079 B11R1.605 CCOc1c(ccnc1Cl)F 7a_100009867227_100000210202 [0,1,0,0,0,0|3,0,0]=4 6080 B11R1.605 CCOc1c(ccnc1Cl)I 34a_100010067911_100000210202 [0,1,0,0,0,0|3,0,0]=4 6081 B11R1.605 CCOc1c(ccnc1Cl)I 7a_100010067911_100000210202 [0,1,0,0,0,0|3,0,0]=4 6082 B11R1.605 CCOc1c(ccnc1Cl)N 34a_100009844647_100000210202 [0,1,0,0,0,0|3,0,0]=4 6083 B11R1.605 CCOc1c(ccnc1Cl)N 7a_100009844647_100000210202 [0,1,0,0,0,0|3,0,0]=4 6084 B11R1.605 CCOc1c(occc1=O)C 34a_100000031901_100000210202 [0,1,0,0,0,0|2,0,1]=4 6085 B11R1.605 CCSc1c(ccc[n+]1[O-])C 62a_100000210202_100116209805 [0,1,0,0,0,0|2,0,1]=4 6086 B11R1.605 CCSc1c(cccc1Br)Br 62a_100000210202_100009994525 [0,1,0,0,0,0|2,0,0]=3 6087 B11R1.605 CCSc1c(cccc1Br)Br 62a_100009994525_100000210202 [0,1,0,0,0,0|2,0,0]=3 6088 B11R1.605 CCSc1c(cccc1Br)C 62a_100000210202_100010141302 [0,1,0,0,0,0|2,0,0]=3 6089 B11R1.605 CCSc1c(cccc1Br)C 62a_100010141302_100000210202 [0,1,0,0,0,0|2,0,0]=3 6090 B11R1.605 CCSc1c(cccc1Br)Cl 62a_100000210202_100010214488 [0,1,0,0,0,0|2,0,0]=3 6091 B11R1.605 CCSc1c(cccc1Br)Cl 62a_100010214488_100000210202 [0,1,0,0,0,0|2,0,0]=3 6092 B11R1.605 CCSc1c(cccc1Br)F 62a_100000210202_100011219512 [0,1,0,0,0,0|2,0,0]=3 6093 B11R1.605 CCSc1c(cccc1Br)F 62a_100011219512_100000210202 [0,1,0,0,0,0|2,0,0]=3 6094 B11R1.605 CCSc1c(cccc1Br)N 62a_100000210202_100020590159 [0,1,0,0,0,0|2,0,0]=3 6095 B11R1.605 CCSc1c(cccc1Br)N 62a_100020590159_100000210202 [0,1,0,0,0,0|2,0,0]=3 6096 B11R1.605 CCSc1c(cccc1Br)O 62a_100000210202_100010187912 [0,1,0,0,0,0|1,0,0]=2 6097 B11R1.605 CCSc1c(cccc1Br)O 62a_100010187912_100000210202 [0,1,0,0,0,0|1,0,0]=2 6098 B11R1.605 CCSc1c(cccc1C)C 62a_100000033847_100000210202 [0,1,0,0,0,0|2,0,0]=3 6099 B11R1.605 CCSc1c(cccc1C)C 62a_100000210202_100000033847 [0,1,0,0,0,0|2,0,0]=3 6100 B11R1.605 CCSc1c(cccc1Cl)C 62a_100000043165_100000210202 [0,1,0,0,0,0|2,0,0]=3 6101 B11R1.605 CCSc1c(cccc1Cl)C 62a_100000210202_100000043165 [0,1,0,0,0,0|2,0,0]=3 6102 B11R1.605 CCSc1c(cccc1Cl)Cl 62a_100000034237_100000210202 [0,1,0,0,0,0|2,0,0]=3 6103 B11R1.605 CCSc1c(cccc1Cl)Cl 62a_100000210202_100000034237 [0,1,0,0,0,0|2,0,0]=3 6104 B11R1.605 CCSc1c(cccc1Cl)F 62a_100000050007_100000210202 [0,1,0,0,0,0|2,0,0]=3 6105 B11R1.605 CCSc1c(cccc1Cl)F 62a_100000210202_100000050007 [0,1,0,0,0,0|2,0,0]=3 6106 B11R1.605 CCSc1c(cccc1Cl)N 62a_100000049713_100000210202 [0,1,0,0,0,0|2,0,0]=3 6107 B11R1.605 CCSc1c(cccc1Cl)N 62a_100000210202_100000049713 [0,1,0,0,0,0|2,0,0]=3 6108 B11R1.605 CCSc1c(cccc1Cl)O 62a_100000210202_100000050174 [0,1,0,0,0,0|1,0,0]=2 6109 B11R1.605 CCSc1c(cccc1F)C 62a_100000210202_100011218421 [0,1,0,0,0,0|2,0,0]=3 6110 B11R1.605 CCSc1c(cccc1F)C 62a_100011218421_100000210202 [0,1,0,0,0,0|2,0,0]=3 6111 B11R1.605 CCSc1c(cccc1F)F 62a_100000210202_100000693133 [0,1,0,0,0,0|2,0,0]=3 6112 B11R1.605 CCSc1c(cccc1F)F 62a_100000693133_100000210202 [0,1,0,0,0,0|2,0,0]=3 6113 B11R1.605 CCSc1c(cccc1F)N 62a_100000210202_100000690935 [0,1,0,0,0,0|2,0,0]=3 6114 B11R1.605 CCSc1c(cccc1F)N 62a_100000690935_100000210202 [0,1,0,0,0,0|2,0,0]=3 6115 B11R1.605 CCSc1c(cccc1F)O 62a_100000210202_100009820682 [0,1,0,0,0,0|1,0,0]=2 6116 B11R1.605 CCSc1c(cccc1F)O 62a_100009820682_100000210202 [0,1,0,0,0,0|1,0,0]=2 6117 B11R1.605 CCSc1c(cccc1N)C 62a_100000210202_100000684715 [0,1,0,0,0,0|2,0,0]=3 6118 B11R1.605 CCSc1c(cccc1N)C 62a_100000684715_100000210202 [0,1,0,0,0,0|2,0,0]=3 6119 B11R1.605 CCSc1c(cccc1O)C 62a_100000210202_100000686692 [0,1,0,0,0,0|1,0,0]=2 6120 B11R1.605 CCSc1c(cccc1O)C 62a_100000686692_100000210202 [0,1,0,0,0,0|1,0,0]=2 6121 B11R1.605 CCSc1c(cccc1O)N 62a_100000210202_100012183704 [0,1,0,0,0,0|1,0,0]=2 6122 B11R1.605 CCSc1c(cccc1O)N 62a_100012183704_100000210202 [0,1,0,0,0,0|1,0,0]=2 6123 B11R1.605 CCSc1c(cccc1O)O 62a_100000210202_100010205330 [0,1,0,0,0,0|1,0,0]=2 6124 B11R1.605 CCSc1c(ccnc1C)C 62a_100000210202_100012000501 [0,1,0,0,0,0|3,0,0]=4 6125 B11R1.605 CCSc1c(ccnc1C)C 62a_100012000501_100000210202 [0,1,0,0,0,0|3,0,0]=4 6126 B11R1.605 CCSc1c(ccnc1C)N 62a_100000210202_100010243816 [0,1,0,0,0,0|3,0,0]=4 6127 B11R1.605 CCSc1c(ccnc1C)N 62a_100010243816_100000210202 [0,1,0,0,0,0|3,0,0]=4 6128 B11R1.605 CCSc1c(ccnc1Cl)Br 62a_100000210202_100009814607 [0,1,0,0,0,0|3,0,0]=4 6129 B11R1.605 CCSc1c(ccnc1Cl)Br 62a_100009814607_100000210202 [0,1,0,0,0,0|3,0,0]=4 6130 B11R1.605 CCSc1c(ccnc1Cl)C 62a_100000210202_100010248874 [0,1,0,0,0,0|3,0,0]=4 6131 B11R1.605 CCSc1c(ccnc1Cl)C 62a_100010248874_100000210202 [0,1,0,0,0,0|3,0,0]=4 6132 B11R1.605 CCSc1c(ccnc1Cl)Cl 62a_100000050019_100000210202 [0,1,0,0,0,0|3,0,0]=4 6133 B11R1.605 CCSc1c(ccnc1Cl)Cl 62a_100000210202_100000050019 [0,1,0,0,0,0|3,0,0]=4 6134 B11R1.605 CCSc1c(ccnc1Cl)F 62a_100000210202_100000716511 [0,1,0,0,0,0|3,0,0]=4 6135 B11R1.605 CCSc1c(ccnc1Cl)F 62a_100000716511_100000210202 [0,1,0,0,0,0|3,0,0]=4 6136 B11R1.605 CCSc1c(ccnc1Cl)N 62a_100000210202_100010208016 [0,1,0,0,0,0|3,0,0]=4 6137 B11R1.605 CCSc1c(ccnc1Cl)N 62a_100010208016_100000210202 [0,1,0,0,0,0|3,0,0]=4 6138 B11R1.605 CCSc1c(ccnc1F)C 62a_100000210202_100009818256 [0,1,0,0,0,0|3,0,0]=4 6139 B11R1.605 CCSc1c(ccnc1F)C 62a_100009818256_100000210202 [0,1,0,0,0,0|3,0,0]=4 6140 B11R1.605 CCSc1c(ccnc1F)F 62a_100000210202_100009874084 [0,1,0,0,0,0|3,0,0]=4 6141 B11R1.605 CCSc1c(ccnc1F)F 62a_100009874084_100000210202 [0,1,0,0,0,0|3,0,0]=4 6142 B11R1.605 CCSc1c(ccnc1F)N 62a_100000210202_100010381272 [0,1,0,0,0,0|3,0,0]=4 6143 B11R1.605 CCSc1c(ccnc1F)N 62a_100010381272_100000210202 [0,1,0,0,0,0|3,0,0]=4 6144 B11R1.605 CCSc1c(ccnc1N)C 62a_100000210202_100011998619 [0,1,0,0,0,0|3,0,0]=4 6145 B11R1.605 CCSc1c(ccnc1N)C 62a_100011998619_100000210202 [0,1,0,0,0,0|3,0,0]=4 6146 B11R1.605 CCSc1c(ccnc1N)Cl 62a_100000210202_100010199028 [0,1,0,0,0,0|3,0,0]=4 6147 B11R1.605 CCSc1c(ccnc1N)Cl 62a_100010199028_100000210202 [0,1,0,0,0,0|3,0,0]=4 6148 B11R1.605 CCSc1c(ccnc1O)C 62a_100000210202_100012000493 [0,1,0,0,0,0|2,0,0]=3 6149 B11R1.605 CCSc1c(ccnc1O)C 62a_100012000493_100000210202 [0,1,0,0,0,0|2,0,0]=3 6150 B11R1.605 CCSc1c(ccnc1O)O 62a_100000210202_200009817435 [0,1,0,0,0,0|2,0,0]=3 6151 B11R1.605 CCSc1c(cn[nH]c1=O)O 62a_100000210202_100000116976 [0,1,0,0,0,0|3,0,0]=4 6152 B11R1.605 CCSc1c(cncc1Br)Br 62a_100000210202_100010172828 [0,1,0,0,0,0|3,0,0]=4 6153 B11R1.605 CCSc1c(cncc1Br)Br 62a_100010172828_100000210202 [0,1,0,0,0,0|3,0,0]=4 6154 B11R1.605 CCSc1c(cncc1C)C 62a_100000210202_100009817138 [0,1,0,0,0,0|3,0,0]=4 6155 B11R1.605 CCSc1c(cncc1C)C 62a_100009817138_100000210202 [0,1,0,0,0,0|3,0,0]=4 6156 B11R1.605 CCSc1c(cncc1Cl)Cl 62a_100000036193_100000210202 [0,1,0,0,0,0|3,0,0]=4 6157 B11R1.605 CCSc1c(cncc1Cl)Cl 62a_100000210202_100000036193 [0,1,0,0,0,0|3,0,0]=4 6158 B11R1.605 CCSc1c(cncc1F)F 62a_100000210202_100000760538 [0,1,0,0,0,0|3,0,0]=4 6159 B11R1.605 CCSc1c(cncc1F)F 62a_100000760538_100000210202 [0,1,0,0,0,0|3,0,0]=4 6160 B11R1.605 CCSc1c(ncnc1O)O 62a_100000210202_100000006518 [0,1,0,0,0,0|3,0,0]=4 6161 B11R1.605 CNCc1c(cccc1Br)Br 207a_100102657272_100010233043 [0,1,0,0,0,0|2,0,0]=3 6162 B11R1.605 CNCc1c(cccc1Br)Br 26a_100102657272_100000736428 [0,1,0,0,0,0|2,0,0]=3 6163 B11R1.605 CNCc1c(cccc1Br)Br 270004a_106832991635_100010233043 [0,1,0,0,0,0|2,0,0]=3 6164 B11R1.605 CNCc1c(cccc1Br)C 207a_100102657272_100009881667 [0,1,0,0,0,0|2,0,0]=3 6165 B11R1.605 CNCc1c(cccc1Br)C 2230a_106832991635_100010146847 [0,1,0,0,0,0|2,0,0]=3 6166 B11R1.605 CNCc1c(cccc1Br)C 26a_100102657272_100009817157 [0,1,0,0,0,0|2,0,0]=3 6167 B11R1.605 CNCc1c(cccc1Br)C 270004a_106832991635_100009881667 [0,1,0,0,0,0|2,0,0]=3 6168 B11R1.605 CNCc1c(cccc1Br)C 34a_100102657272_100010146847 [0,1,0,0,0,0|2,0,0]=3 6169 B11R1.605 CNCc1c(cccc1Br)C 7a_106832991635_100010146847 [0,1,0,0,0,0|2,0,0]=3 6170 B11R1.605 CNCc1c(cccc1Br)Cl 207a_100102657272_100011249081 [0,1,0,0,0,0|2,0,0]=3 6171 B11R1.605 CNCc1c(cccc1Br)Cl 2230a_106832991635_100010138402 [0,1,0,0,0,0|2,0,0]=3 6172 B11R1.605 CNCc1c(cccc1Br)Cl 26a_100102657272_100010214474 [0,1,0,0,0,0|2,0,0]=3 6173 B11R1.605 CNCc1c(cccc1Br)Cl 270004a_106832991635_100011249081 [0,1,0,0,0,0|2,0,0]=3 6174 B11R1.605 CNCc1c(cccc1Br)Cl 34a_100102657272_100010138402 [0,1,0,0,0,0|2,0,0]=3 6175 B11R1.605 CNCc1c(cccc1Br)Cl 7a_106832991635_100010138402 [0,1,0,0,0,0|2,0,0]=3 6176 B11R1.605 CNCc1c(cccc1Br)F 207a_100102657272_100000752695 [0,1,0,0,0,0|2,0,0]=3 6177 B11R1.605 CNCc1c(cccc1Br)F 2230a_106832991635_100012145669 [0,1,0,0,0,0|2,0,0]=3 6178 B11R1.605 CNCc1c(cccc1Br)F 26a_100102657272_100009813666 [0,1,0,0,0,0|2,0,0]=3 6179 B11R1.605 CNCc1c(cccc1Br)F 270004a_106832991635_100000752695 [0,1,0,0,0,0|2,0,0]=3 6180 B11R1.605 CNCc1c(cccc1Br)F 34a_100012349121_200000210301 [0,1,0,0,0,0|2,0,0]=3 6181 B11R1.605 CNCc1c(cccc1Br)F 34a_100102657272_100012145669 [0,1,0,0,0,0|2,0,0]=3 6182 B11R1.605 CNCc1c(cccc1Br)F 7a_106832991635_100000696636 [0,1,0,0,0,0|2,0,0]=3 6183 B11R1.605 CNCc1c(cccc1C)C 207a_100102657272_100000758299 [0,1,0,0,0,0|2,0,0]=3 6184 B11R1.605 CNCc1c(cccc1C)C 2230a_106832991635_100000758300 [0,1,0,0,0,0|2,0,0]=3 6185 B11R1.605 CNCc1c(cccc1C)C 270004a_106832991635_100000758299 [0,1,0,0,0,0|2,0,0]=3 6186 B11R1.605 CNCc1c(cccc1C)C 34a_100000689800_200000210301 [0,1,0,0,0,0|2,0,0]=3 6187 B11R1.605 CNCc1c(cccc1C)C 34a_100102657272_100000758300 [0,1,0,0,0,0|2,0,0]=3 6188 B11R1.605 CNCc1c(cccc1C)C 7a_106832991635_100000758300 [0,1,0,0,0,0|2,0,0]=3 6189 B11R1.605 CNCc1c(cccc1Cl)C 207a_100102657272_100000041122 [0,1,0,0,0,0|2,0,0]=3 6190 B11R1.605 CNCc1c(cccc1Cl)C 270004a_106832991635_100000041122 [0,1,0,0,0,0|2,0,0]=3 6191 B11R1.605 CNCc1c(cccc1Cl)Cl 207a_100102657272_100000189306 [0,1,0,0,0,0|2,0,0]=3 6192 B11R1.605 CNCc1c(cccc1Cl)Cl 2230a_100000174884_200000210301 [0,1,0,0,0,0|2,0,0]=3 6193 B11R1.605 CNCc1c(cccc1Cl)Cl 2230a_106832991635_100000187851 [0,1,0,0,0,0|2,0,0]=3 6194 B11R1.605 CNCc1c(cccc1Cl)Cl 26a_100102657272_100000211709 [0,1,0,0,0,0|2,0,0]=3 6195 B11R1.605 CNCc1c(cccc1Cl)Cl 270004a_106832991635_100000189306 [0,1,0,0,0,0|2,0,0]=3 6196 B11R1.605 CNCc1c(cccc1Cl)Cl 34a_100000174884_200000210301 [0,1,0,0,0,0|2,0,0]=3 6197 B11R1.605 CNCc1c(cccc1Cl)Cl 34a_100102657272_100000187851 [0,1,0,0,0,0|2,0,0]=3 6198 B11R1.605 CNCc1c(cccc1Cl)Cl 7a_106832991635_100000187851 [0,1,0,0,0,0|2,0,0]=3 6199 B11R1.605 CNCc1c(cccc1Cl)F 207a_100102657272_100000210083 [0,1,0,0,0,0|2,0,0]=3 6200 B11R1.605 CNCc1c(cccc1Cl)F 2230a_106832991635_100000187852 [0,1,0,0,0,0|2,0,0]=3 6201 B11R1.605 CNCc1c(cccc1Cl)F 270004a_106832991635_100000210083 [0,1,0,0,0,0|2,0,0]=3 6202 B11R1.605 CNCc1c(cccc1Cl)F 34a_100000174883_200000210301 [0,1,0,0,0,0|2,0,0]=3 6203 B11R1.605 CNCc1c(cccc1Cl)F 34a_100102657272_100000187852 [0,1,0,0,0,0|2,0,0]=3 6204 B11R1.605 CNCc1c(cccc1Cl)F 7a_106832991635_100000187852 [0,1,0,0,0,0|2,0,0]=3 6205 B11R1.605 CNCc1c(cccc1F)C 207a_100102657272_100000069827 [0,1,0,0,0,0|2,0,0]=3 6206 B11R1.605 CNCc1c(cccc1F)C 2230a_106832991635_100009814554 [0,1,0,0,0,0|2,0,0]=3 6207 B11R1.605 CNCc1c(cccc1F)C 270004a_106832991635_100000069827 [0,1,0,0,0,0|2,0,0]=3 6208 B11R1.605 CNCc1c(cccc1F)C 34a_100000762012_200000210301 [0,1,0,0,0,0|2,0,0]=3 6209 B11R1.605 CNCc1c(cccc1F)C 34a_100102657272_100009814554 [0,1,0,0,0,0|2,0,0]=3 6210 B11R1.605 CNCc1c(cccc1F)C 7a_106832991635_100009814554 [0,1,0,0,0,0|2,0,0]=3 6211 B11R1.605 CNCc1c(cccc1F)F 207a_100102657272_100000211061 [0,1,0,0,0,0|2,0,0]=3 6212 B11R1.605 CNCc1c(cccc1F)F 2230a_106832991635_100000698325 [0,1,0,0,0,0|2,0,0]=3 6213 B11R1.605 CNCc1c(cccc1F)F 270004a_106832991635_100000211061 [0,1,0,0,0,0|2,0,0]=3 6214 B11R1.605 CNCc1c(cccc1F)F 34a_100000688400_200000210301 [0,1,0,0,0,0|2,0,0]=3 6215 B11R1.605 CNCc1c(cccc1F)F 34a_100102657272_100000698325 [0,1,0,0,0,0|2,0,0]=3 6216 B11R1.605 CNCc1c(cccc1F)F 7a_106832991635_100000698325 [0,1,0,0,0,0|2,0,0]=3 6217 B11R1.605 CNCc1c(cccc1F)O 271570a_203496583355_106744473292 [0,1,0,0,0,0|1,0,0]=2 6218 B11R1.605 CNCc1c(cccc1I)Br 2230a_106832991635_100010146611 [0,1,0,0,0,0|2,0,0]=3 6219 B11R1.605 CNCc1c(cccc1I)Br 26a_100102657272_100010084509 [0,1,0,0,0,0|2,0,0]=3 6220 B11R1.605 CNCc1c(cccc1I)Br 34a_100102657272_100010146611 [0,1,0,0,0,0|2,0,0]=3 6221 B11R1.605 CNCc1c(cccc1I)Br 7a_106832991635_100010146611 [0,1,0,0,0,0|2,0,0]=3 6222 B11R1.605 CNCc1c(cccc1I)C 2230a_106832991635_100010150146 [0,1,0,0,0,0|2,0,0]=3 6223 B11R1.605 CNCc1c(cccc1I)C 34a_100102657272_100010150146 [0,1,0,0,0,0|2,0,0]=3 6224 B11R1.605 CNCc1c(cccc1I)C 7a_106832991635_100010150146 [0,1,0,0,0,0|2,0,0]=3 6225 B11R1.605 CNCc1c(cccc1I)Cl 207a_100102657272_100010147682 [0,1,0,0,0,0|2,0,0]=3 6226 B11R1.605 CNCc1c(cccc1I)Cl 270004a_106832991635_100010147682 [0,1,0,0,0,0|2,0,0]=3 6227 B11R1.605 CNCc1c(cccc1I)F 207a_100102657272_100010178011 [0,1,0,0,0,0|2,0,0]=3 6228 B11R1.605 CNCc1c(cccc1I)F 2230a_106832991635_100010149602 [0,1,0,0,0,0|2,0,0]=3 6229 B11R1.605 CNCc1c(cccc1I)F 270004a_106832991635_100010178011 [0,1,0,0,0,0|2,0,0]=3 6230 B11R1.605 CNCc1c(cccc1I)F 34a_100102657272_100010149602 [0,1,0,0,0,0|2,0,0]=3 6231 B11R1.605 CNCc1c(cccc1I)F 7a_106832991635_100010149602 [0,1,0,0,0,0|2,0,0]=3 6232 B11R1.605 CNCc1c(ccnc1F)C 207a_100102657272_100000087869 [0,1,0,0,0,0|3,0,0]=4 6233 B11R1.605 CNCc1c(cncc1Br)Br 207a_100102657272_100000689152 [0,1,0,0,0,0|3,0,0]=4 6234 B11R1.605 CNCc1c(cncc1Br)Br 270004a_106832991635_100000689152 [0,1,0,0,0,0|3,0,0]=4 6235 B11R1.605 CNCc1c(cncc1Br)Cl 207a_100102657272_100010064873 [0,1,0,0,0,0|3,0,0]=4 6236 B11R1.605 CNCc1c(cncc1Br)Cl 270004a_106832991635_100010064873 [0,1,0,0,0,0|3,0,0]=4 6237 B11R1.605 CNCc1c(cncc1Br)F 207a_100102657272_100010064882 [0,1,0,0,0,0|3,0,0]=4 6238 B11R1.605 CNCc1c(cncc1Br)F 270004a_106832991635_100010064882 [0,1,0,0,0,0|3,0,0]=4 6239 B11R1.605 CNCc1c(cncc1Cl)Cl 207a_100102657272_100000067493 [0,1,0,0,0,0|3,0,0]=4 6240 B11R1.605 CNCc1c(cncc1Cl)Cl 2230a_106832991635_200009872113 [0,1,0,0,0,0|3,0,0]=4 6241 B11R1.605 CNCc1c(cncc1Cl)Cl 270004a_106832991635_100000067493 [0,1,0,0,0,0|3,0,0]=4 6242 B11R1.605 CNCc1c(cncc1Cl)Cl 34a_100102657272_200009872113 [0,1,0,0,0,0|3,0,0]=4 6243 B11R1.605 CNCc1c(cncc1Cl)Cl 7a_106832991635_200009872113 [0,1,0,0,0,0|3,0,0]=4 6244 B11R1.605 CNCc1c(cncc1F)F 207a_100102657272_100000068831 [0,1,0,0,0,0|3,0,0]=4 6245 B11R1.605 COCc1c(cccc1Br)Br 34a_100010172814_200000210301 [0,1,0,0,0,0|2,0,0]=3 6246 B11R1.605 COCc1c(cccc1Br)Br 7a_100010172814_200000210301 [0,1,0,0,0,0|2,0,0]=3 6247 B11R1.605 COCc1c(cccc1Br)C 34a_100138415774_100010146847 [0,1,0,0,0,0|2,0,0]=3 6248 B11R1.605 COCc1c(cccc1Br)Cl 34a_100138415774_100010138402 [0,1,0,0,0,0|2,0,0]=3 6249 B11R1.605 COCc1c(cccc1Br)F 34a_100012355691_200000210301 [0,1,0,0,0,0|2,0,0]=3 6250 B11R1.605 COCc1c(cccc1Br)F 34a_100138415774_100012145669 [0,1,0,0,0,0|2,0,0]=3 6251 B11R1.605 COCc1c(cccc1Br)F 7a_100012355691_200000210301 [0,1,0,0,0,0|2,0,0]=3 6252 B11R1.605 COCc1c(cccc1Br)N 34a_100000747656_200000210301 [0,1,0,0,0,0|2,0,0]=3 6253 B11R1.605 COCc1c(cccc1C)C 34a_100011933981_200000210301 [0,1,0,0,0,0|2,0,0]=3 6254 B11R1.605 COCc1c(cccc1C)C 34a_100138415774_100000758300 [0,1,0,0,0,0|2,0,0]=3 6255 B11R1.605 COCc1c(cccc1C)C 7a_100011933981_200000210301 [0,1,0,0,0,0|2,0,0]=3 6256 B11R1.605 COCc1c(cccc1Cl)C 34a_100000082531_200000210301 [0,1,0,0,0,0|2,0,0]=3 6257 B11R1.605 COCc1c(cccc1Cl)C 7a_100000082531_200000210301 [0,1,0,0,0,0|2,0,0]=3 6258 B11R1.605 COCc1c(cccc1Cl)Cl 34a_100000215722_200000210301 [0,1,0,0,0,0|2,0,0]=3 6259 B11R1.605 COCc1c(cccc1Cl)Cl 34a_100138415774_100000187851 [0,1,0,0,0,0|2,0,0]=3 6260 B11R1.605 COCc1c(cccc1Cl)Cl 7a_100000215722_200000210301 [0,1,0,0,0,0|2,0,0]=3 6261 B11R1.605 COCc1c(cccc1Cl)F 34a_100000215723_200000210301 [0,1,0,0,0,0|2,0,0]=3 6262 B11R1.605 COCc1c(cccc1Cl)F 34a_100138415774_100000187852 [0,1,0,0,0,0|2,0,0]=3 6263 B11R1.605 COCc1c(cccc1Cl)F 7a_100000215723_200000210301 [0,1,0,0,0,0|2,0,0]=3 6264 B11R1.605 COCc1c(cccc1Cl)N 34a_100011916388_200000210301 [0,1,0,0,0,0|2,0,0]=3 6265 B11R1.605 COCc1c(cccc1F)C 34a_100000057874_200000210301 [0,1,0,0,0,0|2,0,0]=3 6266 B11R1.605 COCc1c(cccc1F)C 34a_100138415774_100009814554 [0,1,0,0,0,0|2,0,0]=3 6267 B11R1.605 COCc1c(cccc1F)C 7a_100000057874_200000210301 [0,1,0,0,0,0|2,0,0]=3 6268 B11R1.605 COCc1c(cccc1F)F 34a_100000698215_200000210301 [0,1,0,0,0,0|2,0,0]=3 6269 B11R1.605 COCc1c(cccc1F)F 34a_100138415774_100000698325 [0,1,0,0,0,0|2,0,0]=3 6270 B11R1.605 COCc1c(cccc1F)F 7a_100000698215_200000210301 [0,1,0,0,0,0|2,0,0]=3 6271 B11R1.605 COCc1c(cccc1F)N 34a_100011846719_200000210301 [0,1,0,0,0,0|2,0,0]=3 6272 B11R1.605 COCc1c(cccc1I)Br 34a_100138415774_100010146611 [0,1,0,0,0,0|2,0,0]=3 6273 B11R1.605 COCc1c(cccc1I)C 34a_100138415774_100010150146 [0,1,0,0,0,0|2,0,0]=3 6274 B11R1.605 COCc1c(cccc1I)F 34a_100010214973_200000210301 [0,1,0,0,0,0|2,0,0]=3 6275 B11R1.605 COCc1c(cccc1I)F 34a_100138415774_100010149602 [0,1,0,0,0,0|2,0,0]=3 6276 B11R1.605 COCc1c(cccc1I)F 7a_100010214973_200000210301 [0,1,0,0,0,0|2,0,0]=3 6277 B11R1.605 COCc1c(ccnc1Br)Br 34a_200015784018_200000210301 [0,1,0,0,0,0|3,0,0]=4 6278 B11R1.605 COCc1c(ccnc1Br)Br 7a_200015784018_200000210301 [0,1,0,0,0,0|3,0,0]=4 6279 B11R1.605 COCc1c(ccnc1Cl)Cl 34a_200009882739_200000210301 [0,1,0,0,0,0|3,0,0]=4 6280 B11R1.605 COCc1c(ccnc1Cl)Cl 7a_200009882739_200000210301 [0,1,0,0,0,0|3,0,0]=4 6281 B11R1.605 COCc1c(ccnc1Cl)I 7a_100000047008_200000210301 [0,1,0,0,0,0|3,0,0]=4 6282 B11R1.605 COCc1c(ccnc1F)I 34a_100000050056_200000210301 [0,1,0,0,0,0|3,0,0]=4 6283 B11R1.605 COCc1c(ccnc1F)I 7a_100000050056_200000210301 [0,1,0,0,0,0|3,0,0]=4 6284 B11R1.605 COCc1c(cncc1Cl)Cl 34a_100138415774_200009872113 [0,1,0,0,0,0|3,0,0]=4 6285 B11R1.605 CSCc1c(cccc1Br)C 62a_100010146847_200000210301 [0,1,0,0,0,0|2,0,0]=3 6286 B11R1.605 CSCc1c(cccc1Br)C 62a_200000210301_100010146847 [0,1,0,0,0,0|2,0,0]=3 6287 B11R1.605 CSCc1c(cccc1Br)Cl 62a_100010138402_200000210301 [0,1,0,0,0,0|2,0,0]=3 6288 B11R1.605 CSCc1c(cccc1Br)Cl 62a_200000210301_100010138402 [0,1,0,0,0,0|2,0,0]=3 6289 B11R1.605 CSCc1c(cccc1Br)F 62a_100012145669_200000210301 [0,1,0,0,0,0|2,0,0]=3 6290 B11R1.605 CSCc1c(cccc1Br)F 62a_200000210301_100012145669 [0,1,0,0,0,0|2,0,0]=3 6291 B11R1.605 CSCc1c(cccc1C)C 62a_100000758300_200000210301 [0,1,0,0,0,0|2,0,0]=3 6292 B11R1.605 CSCc1c(cccc1C)C 62a_200000210301_100000758300 [0,1,0,0,0,0|2,0,0]=3 6293 B11R1.605 CSCc1c(cccc1Cl)Cl 62a_100000187851_200000210301 [0,1,0,0,0,0|2,0,0]=3 6294 B11R1.605 CSCc1c(cccc1Cl)Cl 62a_200000210301_100000187851 [0,1,0,0,0,0|2,0,0]=3 6295 B11R1.605 CSCc1c(cccc1Cl)F 62a_100000187852_200000210301 [0,1,0,0,0,0|2,0,0]=3 6296 B11R1.605 CSCc1c(cccc1Cl)F 62a_200000210301_100000187852 [0,1,0,0,0,0|2,0,0]=3 6297 B11R1.605 CSCc1c(cccc1F)C 62a_100009814554_200000210301 [0,1,0,0,0,0|2,0,0]=3 6298 B11R1.605 CSCc1c(cccc1F)C 62a_200000210301_100009814554 [0,1,0,0,0,0|2,0,0]=3 6299 B11R1.605 CSCc1c(cccc1F)F 62a_100000709179_200000210301 [0,1,0,0,0,0|2,0,0]=3 6300 B11R1.605 CSCc1c(cccc1F)F 62a_200000210301_100000698325 [0,1,0,0,0,0|2,0,0]=3 6301 B11R1.605 CSCc1c(cccc1I)Br 62a_100010146611_200000210301 [0,1,0,0,0,0|2,0,0]=3 6302 B11R1.605 CSCc1c(cccc1I)Br 62a_200000210301_100010146611 [0,1,0,0,0,0|2,0,0]=3 6303 B11R1.605 CSCc1c(cccc1I)C 62a_100010150146_200000210301 [0,1,0,0,0,0|2,0,0]=3 6304 B11R1.605 CSCc1c(cccc1I)C 62a_200000210301_100010150146 [0,1,0,0,0,0|2,0,0]=3 6305 B11R1.605 CSCc1c(cccc1I)F 62a_100010149602_200000210301 [0,1,0,0,0,0|2,0,0]=3 6306 B11R1.605 CSCc1c(cccc1I)F 62a_200000210301_100010149602 [0,1,0,0,0,0|2,0,0]=3 6307 B11R1.605 CSCc1c(cncc1Cl)Cl 62a_200000210301_200009872113 [0,1,0,0,0,0|3,0,0]=4 6308 B11R1.605 CSCc1c(cncc1Cl)Cl 62a_200009872113_200000210301 [0,1,0,0,0,0|3,0,0]=4 6309 B11R1.605 Cc1cccc(c1CC#N)O 271570a_203496583355_100010147027 [0,1,0,0,0,0|1,0,1]=3 6310 B11R1.605 Cc1cccc(c1CN[13CH3])C 34a_100000689800_200025704644 [0,1,0,0,0,0|2,0,0]=3 6311 B11R1.605 Cc1cccc(c1CN[13CH3])F 34a_100000762012_200025704644 [0,1,0,0,0,0|2,0,0]=3 6312 B11R1.605 Cc1cccc(c1CO[13CH3])C 34a_100011933981_200025704644 [0,1,0,0,0,0|2,0,0]=3 6313 B11R1.605 Cc1cccc(c1CO[13CH3])C 7a_100011933981_200025704644 [0,1,0,0,0,0|2,0,0]=3 6314 B11R1.605 Cc1cccc(c1CO[13CH3])Cl 34a_100000082531_200025704644 [0,1,0,0,0,0|2,0,0]=3 6315 B11R1.605 Cc1cccc(c1CO[13CH3])Cl 7a_100000082531_200025704644 [0,1,0,0,0,0|2,0,0]=3 6316 B11R1.605 Cc1cccc(c1CO[13CH3])F 34a_100000057874_200025704644 [0,1,0,0,0,0|2,0,0]=3 6317 B11R1.605 Cc1cccc(c1CO[13CH3])F 7a_100000057874_200025704644 [0,1,0,0,0,0|2,0,0]=3 6318 B11R1.605 Cc1cccc(c1CS[13CH3])Br 62a_100010146847_200025704644 [0,1,0,0,0,0|2,0,0]=3 6319 B11R1.605 Cc1cccc(c1CS[13CH3])Br 62a_200025704644_100010146847 [0,1,0,0,0,0|2,0,0]=3 6320 B11R1.605 Cc1cccc(c1CS[13CH3])C 62a_100000758300_200025704644 [0,1,0,0,0,0|2,0,0]=3 6321 B11R1.605 Cc1cccc(c1CS[13CH3])C 62a_200025704644_100000758300 [0,1,0,0,0,0|2,0,0]=3 6322 B11R1.605 Cc1cccc(c1CS[13CH3])F 62a_100009814554_200025704644 [0,1,0,0,0,0|2,0,0]=3 6323 B11R1.605 Cc1cccc(c1CS[13CH3])F 62a_200025704644_100009814554 [0,1,0,0,0,0|2,0,0]=3 6324 B11R1.605 Cc1cccc(c1CS[13CH3])I 62a_100010150146_200025704644 [0,1,0,0,0,0|2,0,0]=3 6325 B11R1.605 Cc1cccc(c1CS[13CH3])I 62a_200025704644_100010150146 [0,1,0,0,0,0|2,0,0]=3 6326 B11R1.605 Cc1cccc(c1NCF)Br 34a_100011834072_100015361967 [0,1,0,0,0,0|3,0,0]=4 6327 B11R1.605 Cc1cccc(c1NCF)C 34a_100000185769_100015361967 [0,1,0,0,0,0|3,0,0]=4 6328 B11R1.605 Cc1cccc(c1NCF)Cl 34a_100000756524_100015361967 [0,1,0,0,0,0|3,0,0]=4 6329 B11R1.605 Cc1cccc(c1NCF)F 34a_100000766463_100015361967 [0,1,0,0,0,0|3,0,0]=4 6330 B11R1.605 Cc1cccc(c1NCF)O 34a_100000743429_100015361967 [0,1,0,0,0,0|2,0,0]=3 6331 B11R1.605 Cc1cccc(c1OCF)Br 34a_100009817157_100015361967 [0,1,0,0,0,0|3,0,0]=4 6332 B11R1.605 Cc1cccc(c1OCF)Br 7a_100009817157_100015361967 [0,1,0,0,0,0|3,0,0]=4 6333 B11R1.605 Cc1cccc(c1OCF)C 34a_100000210341_100015361967 [0,1,0,0,0,0|3,0,0]=4 6334 B11R1.605 Cc1cccc(c1OCF)C 7a_100000210341_100015361967 [0,1,0,0,0,0|3,0,0]=4 6335 B11R1.605 Cc1cccc(c1OCF)Cl 34a_100000033731_100015361967 [0,1,0,0,0,0|3,0,0]=4 6336 B11R1.605 Cc1cccc(c1OCF)Cl 7a_100000033731_100015361967 [0,1,0,0,0,0|3,0,0]=4 6337 B11R1.605 Cc1cccc(c1OCF)F 34a_100011659162_100015361967 [0,1,0,0,0,0|3,0,0]=4 6338 B11R1.605 Cc1cccc(c1OCF)F 7a_100011659162_100015361967 [0,1,0,0,0,0|3,0,0]=4 6339 B11R1.605 Cc1cccc(c1OCF)N 34a_100000756359_100015361967 [0,1,0,0,0,0|3,0,0]=4 6340 B11R1.605 Cc1cccc(c1OCF)N 7a_100000756359_100015361967 [0,1,0,0,0,0|3,0,0]=4 6341 B11R1.605 Cc1cccc(c1SCF)Br 62a_100010141302_100015361967 [0,1,0,0,0,0|3,0,0]=4 6342 B11R1.605 Cc1cccc(c1SCF)Br 62a_100015361967_100010141302 [0,1,0,0,0,0|3,0,0]=4 6343 B11R1.605 Cc1cccc(c1SCF)C 62a_100000033847_100015361967 [0,1,0,0,0,0|3,0,0]=4 6344 B11R1.605 Cc1cccc(c1SCF)C 62a_100015361967_100000033847 [0,1,0,0,0,0|3,0,0]=4 6345 B11R1.605 Cc1cccc(c1SCF)Cl 62a_100000043165_100015361967 [0,1,0,0,0,0|3,0,0]=4 6346 B11R1.605 Cc1cccc(c1SCF)Cl 62a_100015361967_100000043165 [0,1,0,0,0,0|3,0,0]=4 6347 B11R1.605 Cc1cccc(c1SCF)F 62a_100011218421_100015361967 [0,1,0,0,0,0|3,0,0]=4 6348 B11R1.605 Cc1cccc(c1SCF)F 62a_100015361967_100011218421 [0,1,0,0,0,0|3,0,0]=4 6349 B11R1.605 Cc1cccc(c1SCF)N 62a_100000684715_100015361967 [0,1,0,0,0,0|3,0,0]=4 6350 B11R1.605 Cc1cccc(c1SCF)N 62a_100015361967_100000684715 [0,1,0,0,0,0|3,0,0]=4 6351 B11R1.605 Cc1cccc(c1SCF)O 62a_100000686692_100015361967 [0,1,0,0,0,0|2,0,0]=3 6352 B11R1.605 Cc1cccc(c1SCF)O 62a_100015361967_100000686692 [0,1,0,0,0,0|2,0,0]=3 6353 B11R1.605 Cc1ccnc(c1SCF)O 62a_100012000493_100015361967 [0,1,0,0,0,0|3,0,0]=4 6354 B11R1.605 Cc1ccnc(c1SCF)O 62a_100015361967_100012000493 [0,1,0,0,0,0|3,0,0]=4 6355 B11R1.605 FCNc1c(cccc1Br)Br 34a_100000690995_100015361967 [0,1,0,0,0,0|3,0,0]=4 6356 B11R1.605 FCNc1c(cccc1Br)Cl 34a_100102946385_100015361967 [0,1,0,0,0,0|3,0,0]=4 6357 B11R1.605 FCNc1c(cccc1Br)F 34a_100000684712_100015361967 [0,1,0,0,0,0|3,0,0]=4 6358 B11R1.605 FCNc1c(cccc1Cl)Cl 34a_100000210028_100015361967 [0,1,0,0,0,0|3,0,0]=4 6359 B11R1.605 FCNc1c(cccc1Cl)F 34a_100000760031_100015361967 [0,1,0,0,0,0|3,0,0]=4 6360 B11R1.605 FCNc1c(cccc1F)F 34a_100000210704_100015361967 [0,1,0,0,0,0|3,0,0]=4 6361 B11R1.605 FCNc1c(cccc1I)F 34a_100000042321_100015361967 [0,1,0,0,0,0|3,0,0]=4 6362 B11R1.605 FCOc1c(cccc1Br)Br 34a_100000736428_100015361967 [0,1,0,0,0,0|3,0,0]=4 6363 B11R1.605 FCOc1c(cccc1Br)Br 7a_100000736428_100015361967 [0,1,0,0,0,0|3,0,0]=4 6364 B11R1.605 FCOc1c(cccc1Br)Cl 34a_100010214474_100015361967 [0,1,0,0,0,0|3,0,0]=4 6365 B11R1.605 FCOc1c(cccc1Br)Cl 7a_100010214474_100015361967 [0,1,0,0,0,0|3,0,0]=4 6366 B11R1.605 FCOc1c(cccc1Br)F 34a_100009813666_100015361967 [0,1,0,0,0,0|3,0,0]=4 6367 B11R1.605 FCOc1c(cccc1Br)F 7a_100009813666_100015361967 [0,1,0,0,0,0|3,0,0]=4 6368 B11R1.605 FCOc1c(cccc1Cl)Cl 34a_100000211709_100015361967 [0,1,0,0,0,0|3,0,0]=4 6369 B11R1.605 FCOc1c(cccc1Cl)Cl 7a_100000211709_100015361967 [0,1,0,0,0,0|3,0,0]=4 6370 B11R1.605 FCOc1c(cccc1Cl)F 34a_100000694953_100015361967 [0,1,0,0,0,0|3,0,0]=4 6371 B11R1.605 FCOc1c(cccc1Cl)F 7a_100000694953_100015361967 [0,1,0,0,0,0|3,0,0]=4 6372 B11R1.605 FCOc1c(cccc1F)F 34a_100000230165_100015361967 [0,1,0,0,0,0|3,0,0]=4 6373 B11R1.605 FCOc1c(cccc1F)F 7a_100000230165_100015361967 [0,1,0,0,0,0|3,0,0]=4 6374 B11R1.605 FCOc1c(cccc1I)Br 34a_100010084509_100015361967 [0,1,0,0,0,0|3,0,0]=4 6375 B11R1.605 FCOc1c(cccc1I)Br 7a_100010084509_100015361967 [0,1,0,0,0,0|3,0,0]=4 6376 B11R1.605 FCOc1c(cccc1I)Cl 34a_100010202889_100015361967 [0,1,0,0,0,0|3,0,0]=4 6377 B11R1.605 FCOc1c(cccc1I)Cl 7a_100010202889_100015361967 [0,1,0,0,0,0|3,0,0]=4 6378 B11R1.605 FCOc1c(cccc1I)F 34a_100010186298_100015361967 [0,1,0,0,0,0|3,0,0]=4 6379 B11R1.605 FCOc1c(cccc1I)F 7a_100010186298_100015361967 [0,1,0,0,0,0|3,0,0]=4 6380 B11R1.605 FCSc1c(cccc1Br)Br 62a_100009994525_100015361967 [0,1,0,0,0,0|3,0,0]=4 6381 B11R1.605 FCSc1c(cccc1Br)Br 62a_100015361967_100009994525 [0,1,0,0,0,0|3,0,0]=4 6382 B11R1.605 FCSc1c(cccc1Br)Cl 62a_100010214488_100015361967 [0,1,0,0,0,0|3,0,0]=4 6383 B11R1.605 FCSc1c(cccc1Br)Cl 62a_100015361967_100010214488 [0,1,0,0,0,0|3,0,0]=4 6384 B11R1.605 FCSc1c(cccc1Br)F 62a_100011219512_100015361967 [0,1,0,0,0,0|3,0,0]=4 6385 B11R1.605 FCSc1c(cccc1Br)F 62a_100015361967_100011219512 [0,1,0,0,0,0|3,0,0]=4 6386 B11R1.605 FCSc1c(cccc1Cl)Cl 62a_100000034237_100015361967 [0,1,0,0,0,0|3,0,0]=4 6387 B11R1.605 FCSc1c(cccc1Cl)Cl 62a_100015361967_100000034237 [0,1,0,0,0,0|3,0,0]=4 6388 B11R1.605 FCSc1c(cccc1Cl)F 62a_100000050007_100015361967 [0,1,0,0,0,0|3,0,0]=4 6389 B11R1.605 FCSc1c(cccc1Cl)F 62a_100015361967_100000050007 [0,1,0,0,0,0|3,0,0]=4 6390 B11R1.605 FCSc1c(cccc1F)F 62a_100000693133_100015361967 [0,1,0,0,0,0|3,0,0]=4 6391 B11R1.605 FCSc1c(cccc1F)F 62a_100015361967_100000693133 [0,1,0,0,0,0|3,0,0]=4 6392 B11R1.605 N#CCc1c(cccc1F)O 271570a_203496583355_100009817144 [0,1,0,0,0,0|1,0,1]=3 6393 B11R1.605 N#CSc1c(cccc1F)O 271570a_203496583355_100025703568 [0,1,0,0,0,0|2,0,1]=4 6394 B11R1.605 Nc1cccc(c1OCF)Br 34a_100011934915_100015361967 [0,1,0,0,0,0|3,0,0]=4 6395 B11R1.605 Nc1cccc(c1OCF)Cl 34a_100000754742_100015361967 [0,1,0,0,0,0|3,0,0]=4 6396 B11R1.605 Nc1cccc(c1OCF)F 34a_100011934987_100015361967 [0,1,0,0,0,0|3,0,0]=4 6397 B11R1.605 Nc1cccc(c1OCF)I 34a_100010084371_100015361967 [0,1,0,0,0,0|3,0,0]=4 6398 B11R1.605 Nc1cccc(c1OCF)N 34a_200016994477_100015361967 [0,1,0,0,0,0|3,0,0]=4 6399 B11R1.605 Nc1cccc(c1SCF)Br 62a_100015361967_100020590159 [0,1,0,0,0,0|3,0,0]=4 6400 B11R1.605 Nc1cccc(c1SCF)Br 62a_100020590159_100015361967 [0,1,0,0,0,0|3,0,0]=4 6401 B11R1.605 Nc1cccc(c1SCF)Cl 62a_100000049713_100015361967 [0,1,0,0,0,0|3,0,0]=4 6402 B11R1.605 Nc1cccc(c1SCF)Cl 62a_100015361967_100000049713 [0,1,0,0,0,0|3,0,0]=4 6403 B11R1.605 Nc1cccc(c1SCF)F 62a_100000690935_100015361967 [0,1,0,0,0,0|3,0,0]=4 6404 B11R1.605 Nc1cccc(c1SCF)F 62a_100015361967_100000690935 [0,1,0,0,0,0|3,0,0]=4 6405 B11R1.605 Nc1cccc(c1SCF)O 62a_100012183704_100015361967 [0,1,0,0,0,0|2,0,0]=3 6406 B11R1.605 Nc1cccc(c1SCF)O 62a_100015361967_100012183704 [0,1,0,0,0,0|2,0,0]=3 6407 B11R1.605 Oc1cccc(c1NCF)Br 34a_100011934926_100015361967 [0,1,0,0,0,0|2,0,0]=3 6408 B11R1.605 Oc1cccc(c1NCF)Cl 34a_100012022510_100015361967 [0,1,0,0,0,0|2,0,0]=3 6409 B11R1.605 Oc1cccc(c1NCF)F 34a_100020591140_100015361967 [0,1,0,0,0,0|2,0,0]=3 6410 B11R1.605 Oc1cccc(c1SCF)Br 62a_100010187912_100015361967 [0,1,0,0,0,0|2,0,0]=3 6411 B11R1.605 Oc1cccc(c1SCF)Br 62a_100015361967_100010187912 [0,1,0,0,0,0|2,0,0]=3 6412 B11R1.605 Oc1cccc(c1SCF)Cl 62a_100015361967_100000050174 [0,1,0,0,0,0|2,0,0]=3 6413 B11R1.605 Oc1cccc(c1SCF)F 62a_100009820682_100015361967 [0,1,0,0,0,0|2,0,0]=3 6414 B11R1.605 Oc1cccc(c1SCF)F 62a_100015361967_100009820682 [0,1,0,0,0,0|2,0,0]=3 6415 B11R1.605 Oc1cccc(c1SCF)O 62a_100015361967_100010205330 [0,1,0,0,0,0|2,0,0]=3 6416 B11R1.605 Oc1ccnc(c1SCF)O 62a_100015361967_200009817435 [0,1,0,0,0,0|3,0,0]=4 6417 B11R1.605 [13CH3]NCc1c(cccc1Br)F 34a_100012349121_200025704644 [0,1,0,0,0,0|2,0,0]=3 6418 B11R1.605 [13CH3]NCc1c(cccc1Cl)Cl 2230a_100000174884_200025704644 [0,1,0,0,0,0|2,0,0]=3 6419 B11R1.605 [13CH3]NCc1c(cccc1Cl)Cl 34a_100000174884_200025704644 [0,1,0,0,0,0|2,0,0]=3 6420 B11R1.605 [13CH3]NCc1c(cccc1Cl)F 34a_100000174883_200025704644 [0,1,0,0,0,0|2,0,0]=3 6421 B11R1.605 [13CH3]NCc1c(cccc1F)F 34a_100000688400_200025704644 [0,1,0,0,0,0|2,0,0]=3 6422 B11R1.605 [13CH3]OCc1c(cccc1Br)Br 34a_100010172814_200025704644 [0,1,0,0,0,0|2,0,0]=3 6423 B11R1.605 [13CH3]OCc1c(cccc1Br)Br 7a_100010172814_200025704644 [0,1,0,0,0,0|2,0,0]=3 6424 B11R1.605 [13CH3]OCc1c(cccc1Br)F 34a_100012355691_200025704644 [0,1,0,0,0,0|2,0,0]=3 6425 B11R1.605 [13CH3]OCc1c(cccc1Br)F 7a_100012355691_200025704644 [0,1,0,0,0,0|2,0,0]=3 6426 B11R1.605 [13CH3]OCc1c(cccc1Br)N 34a_100000747656_200025704644 [0,1,0,0,0,0|2,0,0]=3 6427 B11R1.605 [13CH3]OCc1c(cccc1Cl)Cl 34a_100000215722_200025704644 [0,1,0,0,0,0|2,0,0]=3 6428 B11R1.605 [13CH3]OCc1c(cccc1Cl)Cl 7a_100000215722_200025704644 [0,1,0,0,0,0|2,0,0]=3 6429 B11R1.605 [13CH3]OCc1c(cccc1Cl)F 34a_100000215723_200025704644 [0,1,0,0,0,0|2,0,0]=3 6430 B11R1.605 [13CH3]OCc1c(cccc1Cl)F 7a_100000215723_200025704644 [0,1,0,0,0,0|2,0,0]=3 6431 B11R1.605 [13CH3]OCc1c(cccc1Cl)N 34a_100011916388_200025704644 [0,1,0,0,0,0|2,0,0]=3 6432 B11R1.605 [13CH3]OCc1c(cccc1F)F 34a_100000698215_200025704644 [0,1,0,0,0,0|2,0,0]=3 6433 B11R1.605 [13CH3]OCc1c(cccc1F)F 7a_100000698215_200025704644 [0,1,0,0,0,0|2,0,0]=3 6434 B11R1.605 [13CH3]OCc1c(cccc1F)N 34a_100011846719_200025704644 [0,1,0,0,0,0|2,0,0]=3 6435 B11R1.605 [13CH3]OCc1c(cccc1I)F 34a_100010214973_200025704644 [0,1,0,0,0,0|2,0,0]=3 6436 B11R1.605 [13CH3]OCc1c(cccc1I)F 7a_100010214973_200025704644 [0,1,0,0,0,0|2,0,0]=3 6437 B11R1.605 [13CH3]OCc1c(ccnc1Br)Br 34a_200015784018_200025704644 [0,1,0,0,0,0|3,0,0]=4 6438 B11R1.605 [13CH3]OCc1c(ccnc1Br)Br 7a_200015784018_200025704644 [0,1,0,0,0,0|3,0,0]=4 6439 B11R1.605 [13CH3]OCc1c(ccnc1Cl)Cl 34a_200009882739_200025704644 [0,1,0,0,0,0|3,0,0]=4 6440 B11R1.605 [13CH3]OCc1c(ccnc1Cl)Cl 7a_200009882739_200025704644 [0,1,0,0,0,0|3,0,0]=4 6441 B11R1.605 [13CH3]OCc1c(ccnc1Cl)I 7a_100000047008_200025704644 [0,1,0,0,0,0|3,0,0]=4 6442 B11R1.605 [13CH3]OCc1c(ccnc1F)I 34a_100000050056_200025704644 [0,1,0,0,0,0|3,0,0]=4 6443 B11R1.605 [13CH3]OCc1c(ccnc1F)I 7a_100000050056_200025704644 [0,1,0,0,0,0|3,0,0]=4 6444 B11R1.605 [13CH3]SCc1c(cccc1Br)Cl 62a_100010138402_200025704644 [0,1,0,0,0,0|2,0,0]=3 6445 B11R1.605 [13CH3]SCc1c(cccc1Br)Cl 62a_200025704644_100010138402 [0,1,0,0,0,0|2,0,0]=3 6446 B11R1.605 [13CH3]SCc1c(cccc1Br)F 62a_100012145669_200025704644 [0,1,0,0,0,0|2,0,0]=3 6447 B11R1.605 [13CH3]SCc1c(cccc1Br)F 62a_200025704644_100012145669 [0,1,0,0,0,0|2,0,0]=3 6448 B11R1.605 [13CH3]SCc1c(cccc1Cl)Cl 62a_100000187851_200025704644 [0,1,0,0,0,0|2,0,0]=3 6449 B11R1.605 [13CH3]SCc1c(cccc1Cl)Cl 62a_200025704644_100000187851 [0,1,0,0,0,0|2,0,0]=3 6450 B11R1.605 [13CH3]SCc1c(cccc1Cl)F 62a_100000187852_200025704644 [0,1,0,0,0,0|2,0,0]=3 6451 B11R1.605 [13CH3]SCc1c(cccc1Cl)F 62a_200025704644_100000187852 [0,1,0,0,0,0|2,0,0]=3 6452 B11R1.605 [13CH3]SCc1c(cccc1F)F 62a_100000709179_200025704644 [0,1,0,0,0,0|2,0,0]=3 6453 B11R1.605 [13CH3]SCc1c(cccc1F)F 62a_200025704644_100000698325 [0,1,0,0,0,0|2,0,0]=3 6454 B11R1.605 [13CH3]SCc1c(cccc1I)Br 62a_100010146611_200025704644 [0,1,0,0,0,0|2,0,0]=3 6455 B11R1.605 [13CH3]SCc1c(cccc1I)Br 62a_200025704644_100010146611 [0,1,0,0,0,0|2,0,0]=3 6456 B11R1.605 [13CH3]SCc1c(cccc1I)F 62a_100010149602_200025704644 [0,1,0,0,0,0|2,0,0]=3 6457 B11R1.605 [13CH3]SCc1c(cccc1I)F 62a_200025704644_100010149602 [0,1,0,0,0,0|2,0,0]=3 6458 B11R1.605 [13CH3]SCc1c(cncc1Cl)Cl 62a_200009872113_200025704644 [0,1,0,0,0,0|3,0,0]=4 6459 B11R1.605 [13CH3]SCc1c(cncc1Cl)Cl 62a_200025704644_200009872113 [0,1,0,0,0,0|3,0,0]=4 6460 B11R1.605 [N-]=[N+]=Nc1c(cccc1F)O 271570a_203496583355_100102717373 [0,1,0,0,0,0|3,0,0]=4 6461 B9R0.18 C=CC=CC(=O)CCCC 1458a_100016291481_100000210211 [0,0,1,0,0,0|0,0,2]=3 6462 B9R0.18 C=CC=CC(=O)CCCF 1458a_100016291481_100011934791 [0,0,1,0,0,0|1,0,2]=4 6463 B9R0.18 C=CC=CC(=O)CCCO 1458a_100016291481_100011215043 [0,0,1,0,0,0|1,0,2]=4 6464 B9R0.18 C=CC=CC(=O)CCOC 1458a_100016291481_100000233755 [0,0,1,0,0,0|1,0,2]=4 6465 B9R0.18 C=CC=CC(=O)CCSC 1458a_100016291481_100000751147 [0,0,1,0,0,0|1,0,2]=4 6466 B9R0.18 C=CC=CC(=O)NCCC 1626a_100020643023_100016291481 [0,0,1,0,0,0|1,0,1]=3 6467 B9R0.18 C=CC=CC(=O)NCCF 1626a_100000724931_100016291481 [0,0,1,0,0,0|2,0,1]=4 6468 B9R0.18 C=CC=CC(=O)NNCC 22a_100000756455_100016291481 [0,0,1,0,0,0|2,0,1]=4 6469 B9R0.45 C/C=C/C=C/COCCC 34a_100016283227_100000210303 [0,0,1,0,0,0|2,0,1]=4 6470 B9R0.45 CC=CC=CC=NNCC 4a_100000756455_100000691131 [0,0,1,0,0,0|3,0,0]=4 6471 B9R0.45 CCC/C=C/C=C/COC 34a_100016294078_200000210301 [0,0,1,0,0,0|2,0,1]=4 6472 B9R0.45 CCC/C=C/C=C/CO[13CH3] 34a_100016294078_200025704644 [0,0,1,0,0,0|2,0,1]=4 6473 B11R2.10 CN1Cc2ccccc2C1 2230a_100000752595_200000210301 [0,0,0,1,0,0|2,0,0]=3 6474 B11R2.10 CN1Cc2ccccc2C1 269982a_100000752595_200000210301 [0,0,0,1,0,0|2,0,0]=3 6475 B11R2.10 CN1Cc2ccccc2C1 34a_100000752595_200000210301 [0,0,0,1,0,0|2,0,0]=3 6476 B11R2.10 CN1Cc2cccnc2C1 269982a_100000726175_200000210301 [0,0,0,1,0,0|3,0,0]=4 6477 B11R2.10 CN1Cc2ccncc2C1 2230a_100000730608_200000210301 [0,0,0,1,0,0|3,0,0]=4 6478 B11R2.10 CN1Cc2ccncc2C1 269982a_100000730608_200000210301 [0,0,0,1,0,0|3,0,0]=4 6479 B11R2.10 Oc1cc2ccccc2o1 271570a_203496583355_100010159458 [0,0,0,1,0,0|1,0,2]=4 6480 B11R2.10 [13CH3]N1Cc2ccccc2C1 2230a_100000752595_200025704644 [0,0,0,1,0,0|2,0,0]=3 6481 B11R2.10 [13CH3]N1Cc2ccccc2C1 269982a_100000752595_200025704644 [0,0,0,1,0,0|2,0,0]=3 6482 B11R2.10 [13CH3]N1Cc2ccccc2C1 34a_100000752595_200025704644 [0,0,0,1,0,0|2,0,0]=3 6483 B11R2.10 [13CH3]N1Cc2cccnc2C1 269982a_100000726175_200025704644 [0,0,0,1,0,0|3,0,0]=4 6484 B11R2.10 [13CH3]N1Cc2ccncc2C1 2230a_100000730608_200025704644 [0,0,0,1,0,0|3,0,0]=4 6485 B11R2.10 [13CH3]N1Cc2ccncc2C1 269982a_100000730608_200025704644 [0,0,0,1,0,0|3,0,0]=4 6486 B11R2.55 Brc1ccccc1C2CC2 271570a_100011220607_100000695589 [0,0,0,1,0,0|1,0,0]=2 6487 B11R2.55 Brc1cccnc1C2CC2 271570a_100011220607_100000696092 [0,0,0,1,0,0|2,0,0]=3 6488 B11R2.55 Brc1ccncc1C2CC2 271570a_100011220607_100010138639 [0,0,0,1,0,0|2,0,0]=3 6489 B11R2.55 Brc1cnccc1C2CC2 271570a_100011220607_100000726257 [0,0,0,1,0,0|2,0,0]=3 6490 B11R2.55 Brc1ncccc1C2CC2 271570a_100011220607_100010202626 [0,0,0,1,0,0|2,0,0]=3 6491 B11R2.55 Brc1ncncc1C2CC2 271570a_100011220607_200012461658 [0,0,0,1,0,0|3,0,0]=4 6492 B11R2.55 C[n+]1ccccc1C2CC2 271570a_100011220607_100000212160 [0,0,0,1,0,0|2,0,0]=3 6493 B11R2.55 Cc1ccccc1C2CC2 271570a_100011220607_100000210755 [0,0,0,1,0,0|1,0,0]=2 6494 B11R2.55 Cc1cccnc1C2CC2 271570a_100011220607_100000751373 [0,0,0,1,0,0|2,0,0]=3 6495 B11R2.55 Cc1ccncc1C2CC2 271570a_100011220607_100000761580 [0,0,0,1,0,0|2,0,0]=3 6496 B11R2.55 Cc1ccnnc1C2CC2 271570a_100011220607_100000089043 [0,0,0,1,0,0|3,0,0]=4 6497 B11R2.55 Cc1cnccc1C2CC2 271570a_100011220607_100015191297 [0,0,0,1,0,0|2,0,0]=3 6498 B11R2.55 Cc1cncnc1C2CC2 271570a_100011220607_100011998708 [0,0,0,1,0,0|3,0,0]=4 6499 B11R2.55 Cc1ncccc1C2CC2 271570a_100011220607_100000751574 [0,0,0,1,0,0|2,0,0]=3 6500 B11R2.55 Cc1nccnc1C2CC2 271570a_100011220607_100011999405 [0,0,0,1,0,0|3,0,0]=4 6501 B11R2.55 Cc1ncncc1C2CC2 271570a_100011220607_100009819671 [0,0,0,1,0,0|3,0,0]=4 6502 B11R2.55 Clc1ccccc1C2CC2 271570a_100011220607_100000764095 [0,0,0,1,0,0|1,0,0]=2 6503 B11R2.55 Clc1cccnc1C2CC2 271570a_100011220607_100011356963 [0,0,0,1,0,0|2,0,0]=3 6504 B11R2.55 Clc1ccncc1C2CC2 271570a_100011220607_100009995489 [0,0,0,1,0,0|2,0,0]=3 6505 B11R2.55 Clc1cnccc1C2CC2 271570a_100011220607_100000708259 [0,0,0,1,0,0|2,0,0]=3 6506 B11R2.55 Clc1ncccc1C2CC2 271570a_100011220607_100000036424 [0,0,0,1,0,0|2,0,0]=3 6507 B11R2.55 Clc1ncncc1C2CC2 271570a_100011220607_100000758962 [0,0,0,1,0,0|3,0,0]=4 6508 B11R2.55 Fc1ccccc1C2CC2 271570a_100011220607_100011215700 [0,0,0,1,0,0|1,0,0]=2 6509 B11R2.55 Fc1cccnc1C2CC2 271570a_100011220607_100000685392 [0,0,0,1,0,0|2,0,0]=3 6510 B11R2.55 Fc1ccncc1C2CC2 271570a_100011220607_100009820683 [0,0,0,1,0,0|2,0,0]=3 6511 B11R2.55 Fc1cnccc1C2CC2 271570a_100011220607_100000047030 [0,0,0,1,0,0|2,0,0]=3 6512 B11R2.55 Fc1cncnc1C2CC2 271570a_100011220607_100000069762 [0,0,0,1,0,0|3,0,0]=4 6513 B11R2.55 Fc1ncccc1C2CC2 271570a_100011220607_100009816115 [0,0,0,1,0,0|2,0,0]=3 6514 B11R2.55 Fc1nccnc1C2CC2 271570a_100011220607_200010125657 [0,0,0,1,0,0|3,0,0]=4 6515 B11R2.55 Nc1ccccc1C2CC2 271570a_100011220607_100000210017 [0,0,0,1,0,0|1,0,0]=2 6516 B11R2.55 Nc1cccnc1C2CC2 271570a_100011220607_100000688686 [0,0,0,1,0,0|2,0,0]=3 6517 B11R2.55 Nc1ccncc1C2CC2 271570a_100011220607_100000047001 [0,0,0,1,0,0|2,0,0]=3 6518 B11R2.55 Nc1cnccc1C2CC2 271570a_100011220607_100009815883 [0,0,0,1,0,0|2,0,0]=3 6519 B11R2.55 Nc1cncnc1C2CC2 271570a_100011220607_100000709731 [0,0,0,1,0,0|3,0,0]=4 6520 B11R2.55 Nc1cnncc1C2CC2 271570a_100011220607_100009829405 [0,0,0,1,0,0|3,0,0]=4 6521 B11R2.55 Nc1ncccc1C2CC2 271570a_100011220607_100000045569 [0,0,0,1,0,0|2,0,0]=3 6522 B11R2.55 Nc1nccnc1C2CC2 271570a_100011220607_100000747729 [0,0,0,1,0,0|3,0,0]=4 6523 B11R2.55 Nc1ncncc1C2CC2 271570a_100011220607_100011996079 [0,0,0,1,0,0|3,0,0]=4 6524 B11R2.55 O=c1[nH]cccc1C2CC2 271570a_100011220607_100000050042 [0,0,0,1,0,0|1,0,1]=3 6525 B11R2.55 O=c1[nH]ccnc1C2CC2 271570a_100011220607_100000763361 [0,0,0,1,0,0|2,0,1]=4 6526 B11R2.55 O=c1[nH]nccc1C2CC2 271570a_100011220607_100000087129 [0,0,0,1,0,0|2,0,1]=4 6527 B11R2.55 O=c1cc[nH]cc1C2CC2 271570a_100011220607_100009998708 [0,0,0,1,0,0|1,0,1]=3 6528 B11R2.55 Oc1ccccc1C2CC2 271570a_100011220607_100000739446 [0,0,0,1,0,0|0,0,0]=1 6529 B11R2.55 Oc1ccccc1C2CC2 271570a_203496583355_100009819954 [0,0,0,1,0,0|0,0,0]=1 6530 B11R2.55 Oc1cccnc1C2CC2 271570a_100011220607_100000034122 [0,0,0,1,0,0|1,0,0]=2 6531 B11R2.55 Oc1cnccc1C2CC2 271570a_100011220607_100009817591 [0,0,0,1,0,0|1,0,0]=2 6532 B11R2.55 Oc1cncnc1C2CC2 271570a_203496583355_200009889426 [0,0,0,1,0,0|2,0,0]=3 6533 B11R2.55 Oc1ncccc1C2CC2 271570a_203496583355_100009851976 [0,0,0,1,0,0|1,0,0]=2 6534 B11R2.55 Oc1ncncc1C2CC2 271570a_100011220607_100000751107 [0,0,0,1,0,0|2,0,0]=3 6535 B11R2.55 S=c1cc[nH]cc1C2CC2 271570a_100011220607_200012280681 [0,0,0,1,0,0|1,1,0]=3 6536 B11R2.55 [O-][n+]1ccccc1C2CC2 271570a_100011220607_200000042595 [0,0,0,1,0,0|1,0,1]=3 6537 B11R2.106 Oc1cccc2c1CC=C2 271570a_203496583355_100009844718 [0,0,0,1,0,0|0,0,2]=3 6538 B11R2.106 Oc1cccc2c1CCC2 271570a_203496583355_100010343934 [0,0,0,1,0,0|0,0,0]=1 6539 B11R2.106 Oc1cccc2c1CCN2 271570a_203496583355_100009817896 [0,0,0,1,0,0|1,0,0]=2 6540 B11R2.106 Oc1cccc2c1CCO2 271570a_203496583355_100009819624 [0,0,0,1,0,0|1,0,0]=2 6541 B11R2.106 Oc1cccc2c1CNC2 271570a_203496583355_100000703859 [0,0,0,1,0,0|1,0,0]=2 6542 B11R2.106 Oc1cccc2c1COC2 271570a_203496583355_100010384907 [0,0,0,1,0,0|1,0,0]=2 6543 B11R2.106 Oc1cccc2c1NCC2 271570a_203496583355_100016995435 [0,0,0,1,0,0|1,0,0]=2 6544 B11R2.106 Oc1cccc2c1OCC2 271570a_203496583355_100009818991 [0,0,0,1,0,0|1,0,0]=2 6545 B11R2.106 Oc1cccc2c1OCO2 271570a_203496583355_100009814252 [0,0,0,1,0,0|2,0,0]=3 6546 B11R2.106 Oc1cccc2c1[nH]cc2 271570a_203496583355_100009813418 [0,0,0,1,0,0|1,0,2]=4 6547 B11R2.106 Oc1cccc2c1[nH]nc2 271570a_203496583355_100009816125 [0,0,0,1,0,0|2,0,1]=4 6548 B11R2.106 Oc1cccc2c1[nH]nn2 271570a_203496583355_100009820029 [0,0,0,1,0,0|3,0,0]=4 6549 B11R2.106 Oc1cccc2c1cc[nH]2 271570a_203496583355_100000685724 [0,0,0,1,0,0|1,0,2]=4 6550 B11R2.106 Oc1cccc2c1cco2 271570a_203496583355_100000756496 [0,0,0,1,0,0|1,0,2]=4 6551 B11R2.106 Oc1cccc2c1ccs2 271570a_203496583355_100009816950 [0,0,0,1,0,0|1,0,2]=4 6552 B11R2.106 Oc1cccc2c1cn[nH]2 271570a_203496583355_100000753301 [0,0,0,1,0,0|2,0,1]=4 6553 B11R2.106 Oc1cccc2c1cno2 271570a_203496583355_100009818589 [0,0,0,1,0,0|2,0,1]=4 6554 B11R2.106 Oc1cccc2c1nc[nH]2 271570a_203496583355_100011935113 [0,0,0,1,0,0|2,0,1]=4 6555 B11R2.106 Oc1cccc2c1nco2 271570a_203496583355_100009816834 [0,0,0,1,0,0|2,0,1]=4 6556 B11R2.106 Oc1cccc2c1ncs2 271570a_203496583355_100000726125 [0,0,0,1,0,0|2,0,1]=4 6557 B11R2.106 Oc1cccc2c1non2 271570a_203496583355_100009820244 [0,0,0,1,0,0|3,0,0]=4 6558 B11R2.106 Oc1cccc2c1nsn2 271570a_203496583355_100000742359 [0,0,0,1,0,0|3,0,0]=4 6559 B11R2.106 Oc1cccc2c1occ2 271570a_203496583355_100011935138 [0,0,0,1,0,0|1,0,2]=4 6560 B11R2.106 Oc1cccc2c1ocn2 271570a_203496583355_100000728214 [0,0,0,1,0,0|2,0,1]=4 6561 B11R2.106 Oc1cccc2c1onc2 271570a_203496583355_100000765530 [0,0,0,1,0,0|2,0,1]=4 6562 B11R2.106 Oc1cccc2c1scc2 271570a_203496583355_100000766737 [0,0,0,1,0,0|1,0,2]=4 6563 B11R2.106 Oc1cccc2c1scn2 271570a_203496583355_100010246326 [0,0,0,1,0,0|2,0,1]=4 6564 B11R2.106 Oc1ccnc2c1CCC2 271570a_203496583355_100000102697 [0,0,0,1,0,0|1,0,0]=2 6565 B11R2.106 Oc1nccc2c1CCN2 271570a_203496583355_100000104060 [0,0,0,1,0,0|2,0,0]=3 6566 B11R2.106 Oc1ncnc2c1CCC2 271570a_203496583355_100000750143 [0,0,0,1,0,0|2,0,0]=3 6567 B11R2.106 Oc1ncnc2c1CCN2 271570a_203496583355_200000104052 [0,0,0,1,0,0|3,0,0]=4 6568 B11R2.988 CNC1Cc2c1cccc2 7a_106832991635_100009813401 [0,0,0,1,0,0|2,0,0]=3 6569 B11R2.988 CSC1Cc2c1cccc2 62a_100009813401_200000210301 [0,0,0,1,0,0|2,0,0]=3 6570 B11R2.988 CSC1Cc2c1cccc2 62a_200000210301_100009813401 [0,0,0,1,0,0|2,0,0]=3 6571 B11R2.988 [13CH3]SC1Cc2c1cccc2 62a_100009813401_200025704644 [0,0,0,1,0,0|2,0,0]=3 6572 B11R2.988 [13CH3]SC1Cc2c1cccc2 62a_200025704644_100009813401 [0,0,0,1,0,0|2,0,0]=3 6573 B9R1.33 CCSc1ccsc1C 62a_100000210202_100000684487 [0,0,0,0,1,0|3,0,0]=4 6574 B9R1.33 CCSc1ccsc1C 62a_100000684487_100000210202 [0,0,0,0,1,0|3,0,0]=4 6575 B9R1.33 CCSc1cscc1Br 62a_100000210202_100010143727 [0,0,0,0,1,0|3,0,0]=4 6576 B9R1.33 CCSc1cscc1Br 62a_100010143727_100000210202 [0,0,0,0,1,0|3,0,0]=4 6577 B9R1.33 CCSc1cscc1C 62a_100000210202_100000759966 [0,0,0,0,1,0|3,0,0]=4 6578 B9R1.33 CCSc1cscc1C 62a_100000759966_100000210202 [0,0,0,0,1,0|3,0,0]=4 6579 B9R1.33 CCSc1sccc1Br 62a_100000210202_100012361411 [0,0,0,0,1,0|3,0,0]=4 6580 B9R1.33 CCSc1sccc1Br 62a_100012361411_100000210202 [0,0,0,0,1,0|3,0,0]=4 6581 B9R1.33 CCSc1sccc1C 62a_100000210202_100010247149 [0,0,0,0,1,0|3,0,0]=4 6582 B9R1.33 CCSc1sccc1C 62a_100010247149_100000210202 [0,0,0,0,1,0|3,0,0]=4 6583 B9R1.33 CNCc1cccn1C 270004a_106832991635_100000211633 [0,0,0,0,1,0|3,0,0]=4 6584 B9R1.33 CNCc1cccn1C 34a_100011219357_200000210301 [0,0,0,0,1,0|3,0,0]=4 6585 B9R1.33 CNCc1ccsc1Br 207a_100102657272_100009816921 [0,0,0,0,1,0|3,0,0]=4 6586 B9R1.33 CNCc1ccsc1Br 2230a_100000727803_200000210301 [0,0,0,0,1,0|3,0,0]=4 6587 B9R1.33 CNCc1ccsc1Br 2230a_106832991635_100009814289 [0,0,0,0,1,0|3,0,0]=4 6588 B9R1.33 CNCc1ccsc1Br 270004a_106832991635_100009816921 [0,0,0,0,1,0|3,0,0]=4 6589 B9R1.33 CNCc1ccsc1Br 34a_100000727803_200000210301 [0,0,0,0,1,0|3,0,0]=4 6590 B9R1.33 CNCc1ccsc1Br 34a_100102657272_100009814289 [0,0,0,0,1,0|3,0,0]=4 6591 B9R1.33 CNCc1ccsc1Br 7a_106832991635_100009814289 [0,0,0,0,1,0|3,0,0]=4 6592 B9R1.33 CNCc1ccsc1Cl 207a_100102657272_100000089901 [0,0,0,0,1,0|3,0,0]=4 6593 B9R1.33 CNCc1ccsc1Cl 2230a_106832991635_100010167017 [0,0,0,0,1,0|3,0,0]=4 6594 B9R1.33 CNCc1ccsc1Cl 270004a_106832991635_100000089901 [0,0,0,0,1,0|3,0,0]=4 6595 B9R1.33 CNCc1ccsc1Cl 34a_100102657272_100010167017 [0,0,0,0,1,0|3,0,0]=4 6596 B9R1.33 CNCc1ccsc1Cl 7a_106832991635_100010167017 [0,0,0,0,1,0|3,0,0]=4 6597 B9R1.33 CNCc1ccsc1O 271570a_203496583355_100009817074 [0,0,0,0,1,0|2,0,0]=3 6598 B9R1.33 CNCc1cscc1Br 207a_100102657272_100000685484 [0,0,0,0,1,0|3,0,0]=4 6599 B9R1.33 CNCc1cscc1Br 270004a_106832991635_100000685484 [0,0,0,0,1,0|3,0,0]=4 6600 B9R1.33 CNCc1cscc1O 271570a_203496583355_100011935083 [0,0,0,0,1,0|2,0,0]=3 6601 B9R1.33 CNCc1occc1Br 270004a_106832991635_100000756499 [0,0,0,0,1,0|3,0,0]=4 6602 B9R1.33 CNCc1occc1C 207a_100102657272_100000763527 [0,0,0,0,1,0|3,0,0]=4 6603 B9R1.33 CNCc1occc1C 270004a_106832991635_100000763527 [0,0,0,0,1,0|3,0,0]=4 6604 B9R1.33 CNCc1sccc1Br 207a_100102657272_100000766043 [0,0,0,0,1,0|3,0,0]=4 6605 B9R1.33 CNCc1sccc1Br 270004a_106832991635_100000766043 [0,0,0,0,1,0|3,0,0]=4 6606 B9R1.33 CNCc1sccc1C 207a_100102657272_100000210881 [0,0,0,0,1,0|3,0,0]=4 6607 B9R1.33 CNCc1sccc1C 2230a_100000238519_200000210301 [0,0,0,0,1,0|3,0,0]=4 6608 B9R1.33 CNCc1sccc1C 270004a_106832991635_100000210881 [0,0,0,0,1,0|3,0,0]=4 6609 B9R1.33 CNCc1sccc1C 34a_100000238519_200000210301 [0,0,0,0,1,0|3,0,0]=4 6610 B9R1.33 CNCc1sccc1Cl 207a_100102657272_100000722334 [0,0,0,0,1,0|3,0,0]=4 6611 B9R1.33 CNCc1sccc1Cl 2230a_100011934584_200000210301 [0,0,0,0,1,0|3,0,0]=4 6612 B9R1.33 CNCc1sccc1Cl 270004a_106832991635_100000722334 [0,0,0,0,1,0|3,0,0]=4 6613 B9R1.33 CNCc1sccc1Cl 34a_100011934584_200000210301 [0,0,0,0,1,0|3,0,0]=4 6614 B9R1.33 CNCc1sccc1O 271570a_203496583355_100000767120 [0,0,0,0,1,0|2,0,0]=3 6615 B9R1.33 COCc1ccoc1C 34a_100011219433_200000210301 [0,0,0,0,1,0|3,0,0]=4 6616 B9R1.33 COCc1ccoc1C 7a_100011219433_200000210301 [0,0,0,0,1,0|3,0,0]=4 6617 B9R1.33 COCc1ccsc1Br 34a_100009816922_200000210301 [0,0,0,0,1,0|3,0,0]=4 6618 B9R1.33 COCc1ccsc1Br 34a_100138415774_100009814289 [0,0,0,0,1,0|3,0,0]=4 6619 B9R1.33 COCc1ccsc1Br 7a_100009816922_200000210301 [0,0,0,0,1,0|3,0,0]=4 6620 B9R1.33 COCc1ccsc1Cl 34a_100138415774_100010167017 [0,0,0,0,1,0|3,0,0]=4 6621 B9R1.33 COCc1cscc1Br 34a_100000724555_200000210301 [0,0,0,0,1,0|3,0,0]=4 6622 B9R1.33 COCc1occc1C 34a_100011273948_200000210301 [0,0,0,0,1,0|3,0,0]=4 6623 B9R1.33 COCc1occc1C 7a_100011273948_200000210301 [0,0,0,0,1,0|3,0,0]=4 6624 B9R1.33 COCc1sccc1Br 34a_100000702026_200000210301 [0,0,0,0,1,0|3,0,0]=4 6625 B9R1.33 COCc1sccc1C 34a_100000238368_200000210301 [0,0,0,0,1,0|3,0,0]=4 6626 B9R1.33 COCc1sccc1C 7a_100000238368_200000210301 [0,0,0,0,1,0|3,0,0]=4 6627 B9R1.33 COCc1sccc1Cl 34a_100000722387_200000210301 [0,0,0,0,1,0|3,0,0]=4 6628 B9R1.33 COCc1sccc1Cl 7a_100000722387_200000210301 [0,0,0,0,1,0|3,0,0]=4 6629 B9R1.33 CSCc1ccsc1Br 62a_100009814289_200000210301 [0,0,0,0,1,0|3,0,0]=4 6630 B9R1.33 CSCc1ccsc1Br 62a_200000210301_100009814289 [0,0,0,0,1,0|3,0,0]=4 6631 B9R1.33 CSCc1ccsc1Cl 62a_100010167017_200000210301 [0,0,0,0,1,0|3,0,0]=4 6632 B9R1.33 CSCc1ccsc1Cl 62a_200000210301_100010167017 [0,0,0,0,1,0|3,0,0]=4 6633 B9R1.33 Cc1ccoc1CO[13CH3] 34a_100011273948_200025704644 [0,0,0,0,1,0|3,0,0]=4 6634 B9R1.33 Cc1ccoc1CO[13CH3] 7a_100011273948_200025704644 [0,0,0,0,1,0|3,0,0]=4 6635 B9R1.33 Cc1ccsc1CN[13CH3] 2230a_100000238519_200025704644 [0,0,0,0,1,0|3,0,0]=4 6636 B9R1.33 Cc1ccsc1CN[13CH3] 34a_100000238519_200025704644 [0,0,0,0,1,0|3,0,0]=4 6637 B9R1.33 Cc1ccsc1CO[13CH3] 34a_100000238368_200025704644 [0,0,0,0,1,0|3,0,0]=4 6638 B9R1.33 Cc1ccsc1CO[13CH3] 7a_100000238368_200025704644 [0,0,0,0,1,0|3,0,0]=4 6639 B9R1.33 Cc1occc1CO[13CH3] 34a_100011219433_200025704644 [0,0,0,0,1,0|3,0,0]=4 6640 B9R1.33 Cc1occc1CO[13CH3] 7a_100011219433_200025704644 [0,0,0,0,1,0|3,0,0]=4 6641 B9R1.33 Cn1cccc1CN[13CH3] 34a_100011219357_200025704644 [0,0,0,0,1,0|3,0,0]=4 6642 B9R1.33 [13CH3]NCc1ccsc1Br 2230a_100000727803_200025704644 [0,0,0,0,1,0|3,0,0]=4 6643 B9R1.33 [13CH3]NCc1ccsc1Br 34a_100000727803_200025704644 [0,0,0,0,1,0|3,0,0]=4 6644 B9R1.33 [13CH3]NCc1sccc1Cl 2230a_100011934584_200025704644 [0,0,0,0,1,0|3,0,0]=4 6645 B9R1.33 [13CH3]NCc1sccc1Cl 34a_100011934584_200025704644 [0,0,0,0,1,0|3,0,0]=4 6646 B9R1.33 [13CH3]OCc1ccsc1Br 34a_100009816922_200025704644 [0,0,0,0,1,0|3,0,0]=4 6647 B9R1.33 [13CH3]OCc1ccsc1Br 7a_100009816922_200025704644 [0,0,0,0,1,0|3,0,0]=4 6648 B9R1.33 [13CH3]OCc1cscc1Br 34a_100000724555_200025704644 [0,0,0,0,1,0|3,0,0]=4 6649 B9R1.33 [13CH3]OCc1sccc1Br 34a_100000702026_200025704644 [0,0,0,0,1,0|3,0,0]=4 6650 B9R1.33 [13CH3]OCc1sccc1Cl 34a_100000722387_200025704644 [0,0,0,0,1,0|3,0,0]=4 6651 B9R1.33 [13CH3]OCc1sccc1Cl 7a_100000722387_200025704644 [0,0,0,0,1,0|3,0,0]=4 6652 B9R1.33 [13CH3]SCc1ccsc1Br 62a_100009814289_200025704644 [0,0,0,0,1,0|3,0,0]=4 6653 B9R1.33 [13CH3]SCc1ccsc1Br 62a_200025704644_100009814289 [0,0,0,0,1,0|3,0,0]=4 6654 B9R1.33 [13CH3]SCc1ccsc1Cl 62a_100010167017_200025704644 [0,0,0,0,1,0|3,0,0]=4 6655 B9R1.33 [13CH3]SCc1ccsc1Cl 62a_200025704644_100010167017 [0,0,0,0,1,0|3,0,0]=4 6656 B11R1.5 CCOc1cccccc1=O 34a_100000036025_100000210202 [0,0,0,0,0,1|1,0,1]=3 6657 B11R1.5 CCOc1cccccc1=O 7a_100000036025_100000210202 [0,0,0,0,0,1|1,0,1]=3 6658 B11R1.5 O=c1cccccc1OCF 34a_100000036025_100015361967 [0,0,0,0,0,1|2,0,1]=4 6659 B11R1.5 O=c1cccccc1OCF 7a_100000036025_100015361967 [0,0,0,0,0,1|2,0,1]=4 6660 B8R0.1 C=CC=CC(=O)CCC 1458a_100016291481_100000210303 [1,0,1,0,0,0|0,0,1]=3 6661 B8R0.1 C=CC=CC(=O)CCF 1458a_100016291481_100011217306 [1,0,1,0,0,0|1,0,1]=4 6662 B8R0.1 C=CC=CC(=O)CCO 1458a_100016291481_100000211926 [1,0,1,0,0,0|1,0,1]=4 6663 B8R1.2 C=Cc1ccccc1 271570a_100011290941_100000210277 [2,0,0,0,0,0|0,0,2]=4 6664 B8R1.2 CNc1ccccc1 34a_100000106764_200000210301 [2,0,0,0,0,0|1,0,0]=3 6665 B8R1.2 COc1ccccc1 34a_100000210340_200000210301 [2,0,0,0,0,0|1,0,0]=3 6666 B8R1.2 COc1ccccc1 7a_100000210340_200000210301 [2,0,0,0,0,0|1,0,0]=3 6667 B8R1.2 COc1cccnc1 34a_100000210849_200000210301 [2,0,0,0,0,0|2,0,0]=4 6668 B8R1.2 COc1cccnc1 7a_100000210849_200000210301 [2,0,0,0,0,0|2,0,0]=4 6669 B8R1.2 COc1ccncc1 34a_100000212176_200000210301 [2,0,0,0,0,0|2,0,0]=4 6670 B8R1.2 CSc1ccccc1 62a_100000719477_200000210301 [2,0,0,0,0,0|1,0,0]=3 6671 B8R1.2 CSc1ccccc1 62a_200000210301_100000041952 [2,0,0,0,0,0|1,0,0]=3 6672 B8R1.2 CSc1ccccn1 62a_100011216584_200000210301 [2,0,0,0,0,0|2,0,0]=4 6673 B8R1.2 CSc1ccccn1 62a_200000210301_100011216584 [2,0,0,0,0,0|2,0,0]=4 6674 B8R1.2 CSc1cccnc1 62a_100000210063_200000210301 [2,0,0,0,0,0|2,0,0]=4 6675 B8R1.2 CSc1cccnc1 62a_200000210301_100000210063 [2,0,0,0,0,0|2,0,0]=4 6676 B8R1.2 CSc1ccncc1 62a_100000728582_200000210301 [2,0,0,0,0,0|2,0,0]=4 6677 B8R1.2 CSc1ccncc1 62a_200000210301_100000728582 [2,0,0,0,0,0|2,0,0]=4 6678 B8R1.2 [13CH3]Nc1ccccc1 34a_100000106764_200025704644 [2,0,0,0,0,0|1,0,0]=3 6679 B8R1.2 [13CH3]Oc1ccccc1 34a_100000210340_200025704644 [2,0,0,0,0,0|1,0,0]=3 6680 B8R1.2 [13CH3]Oc1ccccc1 7a_100000210340_200025704644 [2,0,0,0,0,0|1,0,0]=3 6681 B8R1.2 [13CH3]Oc1cccnc1 34a_100000210849_200025704644 [2,0,0,0,0,0|2,0,0]=4 6682 B8R1.2 [13CH3]Oc1cccnc1 7a_100000210849_200025704644 [2,0,0,0,0,0|2,0,0]=4 6683 B8R1.2 [13CH3]Oc1ccncc1 34a_100000212176_200025704644 [2,0,0,0,0,0|2,0,0]=4 6684 B8R1.2 [13CH3]Sc1ccccc1 62a_100000719477_200025704644 [2,0,0,0,0,0|1,0,0]=3 6685 B8R1.2 [13CH3]Sc1ccccc1 62a_200025704644_100000041952 [2,0,0,0,0,0|1,0,0]=3 6686 B8R1.2 [13CH3]Sc1ccccn1 62a_100011216584_200025704644 [2,0,0,0,0,0|2,0,0]=4 6687 B8R1.2 [13CH3]Sc1ccccn1 62a_200025704644_100011216584 [2,0,0,0,0,0|2,0,0]=4 6688 B8R1.2 [13CH3]Sc1cccnc1 62a_100000210063_200025704644 [2,0,0,0,0,0|2,0,0]=4 6689 B8R1.2 [13CH3]Sc1cccnc1 62a_200025704644_100000210063 [2,0,0,0,0,0|2,0,0]=4 6690 B8R1.2 [13CH3]Sc1ccncc1 62a_100000728582_200025704644 [2,0,0,0,0,0|2,0,0]=4 6691 B8R1.2 [13CH3]Sc1ccncc1 62a_200025704644_100000728582 [2,0,0,0,0,0|2,0,0]=4 6692 B8R1.5 C[n+]1ccccc1O 271570a_203496583355_100000212160 [2,0,0,0,0,0|1,0,0]=3 6693 B8R1.5 Cc1ccccc1O 271570a_203496583355_100000210755 [2,0,0,0,0,0|0,0,0]=2 6694 B8R1.5 Cc1cccnc1O 271570a_203496583355_100000751373 [2,0,0,0,0,0|1,0,0]=3 6695 B8R1.5 Cc1ccncc1O 271570a_203496583355_100000761580 [2,0,0,0,0,0|1,0,0]=3 6696 B8R1.5 Cc1ccnnc1O 271570a_203496583355_100000089043 [2,0,0,0,0,0|2,0,0]=4 6697 B8R1.5 Cc1cnccc1O 271570a_203496583355_100015191297 [2,0,0,0,0,0|1,0,0]=3 6698 B8R1.5 Cc1cncnc1O 271570a_203496583355_100011998708 [2,0,0,0,0,0|2,0,0]=4 6699 B8R1.5 Cc1ncccc1O 271570a_203496583355_100000751574 [2,0,0,0,0,0|1,0,0]=3 6700 B8R1.5 Cc1nccnc1O 271570a_203496583355_100011999405 [2,0,0,0,0,0|2,0,0]=4 6701 B8R1.5 Cc1ncncc1O 271570a_203496583355_100009819671 [2,0,0,0,0,0|2,0,0]=4 6702 B8R1.5 Nc1ccccc1O 271570a_203496583355_100000210017 [2,0,0,0,0,0|1,0,0]=3 6703 B8R1.5 Nc1cccnc1O 271570a_203496583355_100000688686 [2,0,0,0,0,0|2,0,0]=4 6704 B8R1.5 Nc1ccncc1O 271570a_203496583355_100000047001 [2,0,0,0,0,0|2,0,0]=4 6705 B8R1.5 Nc1cnccc1O 271570a_203496583355_100009815883 [2,0,0,0,0,0|2,0,0]=4 6706 B8R1.5 Nc1ncccc1O 271570a_203496583355_100000045569 [2,0,0,0,0,0|2,0,0]=4 6707 B8R1.5 O=c1[nH]cccc1O 271570a_203496583355_100000050042 [2,0,0,0,0,0|2,0,0]=4 6708 B8R1.5 O=c1cc[nH]cc1O 271570a_203496583355_100009998708 [2,0,0,0,0,0|2,0,0]=4 6709 B8R1.5 Oc1c[nH]ccc1=S 271570a_203496583355_200012280681 [2,0,0,0,0,0|2,0,0]=4 6710 B8R1.5 Oc1ccccc1Br 271570a_203496583355_100000695589 [2,0,0,0,0,0|1,0,0]=3 6711 B8R1.5 Oc1ccccc1Cl 271570a_203496583355_100000764095 [2,0,0,0,0,0|1,0,0]=3 6712 B8R1.5 Oc1ccccc1F 271570a_203496583355_100011215700 [2,0,0,0,0,0|1,0,0]=3 6713 B8R1.5 Oc1ccccc1O 271570a_203496583355_100000739446 [2,0,0,0,0,0|1,0,0]=3 6714 B8R1.5 Oc1cccnc1Br 271570a_203496583355_100010202626 [2,0,0,0,0,0|2,0,0]=4 6715 B8R1.5 Oc1cccnc1Cl 271570a_203496583355_100000036424 [2,0,0,0,0,0|2,0,0]=4 6716 B8R1.5 Oc1cccnc1F 271570a_203496583355_100009816115 [2,0,0,0,0,0|2,0,0]=4 6717 B8R1.5 Oc1cccnc1O 271570a_203496583355_100000034122 [2,0,0,0,0,0|2,0,0]=4 6718 B8R1.5 Oc1ccncc1Br 271570a_203496583355_100000726257 [2,0,0,0,0,0|2,0,0]=4 6719 B8R1.5 Oc1ccncc1Cl 271570a_203496583355_100000708259 [2,0,0,0,0,0|2,0,0]=4 6720 B8R1.5 Oc1ccncc1F 271570a_203496583355_100000047030 [2,0,0,0,0,0|2,0,0]=4 6721 B8R1.5 Oc1ccncc1O 271570a_203496583355_100009817591 [2,0,0,0,0,0|2,0,0]=4 6722 B8R1.5 Oc1cnccc1Br 271570a_203496583355_100010138639 [2,0,0,0,0,0|2,0,0]=4 6723 B8R1.5 Oc1cnccc1Cl 271570a_203496583355_100009995489 [2,0,0,0,0,0|2,0,0]=4 6724 B8R1.5 Oc1cnccc1F 271570a_203496583355_100009820683 [2,0,0,0,0,0|2,0,0]=4 6725 B8R1.5 Oc1ncccc1Br 271570a_203496583355_100000696092 [2,0,0,0,0,0|2,0,0]=4 6726 B8R1.5 Oc1ncccc1Cl 271570a_203496583355_100011356963 [2,0,0,0,0,0|2,0,0]=4 6727 B8R1.5 Oc1ncccc1F 271570a_203496583355_100000685392 [2,0,0,0,0,0|2,0,0]=4 6728 B8R1.5 [O-][n+]1ccccc1O 271570a_203496583355_200000042595 [2,0,0,0,0,0|2,0,0]=4 6729 B10R0.18 C=CC=CC(=O)CC(C)CC 1458a_100016291481_100000748023 [0,1,1,0,0,0|0,0,2]=4 6730 B10R0.18 C=CC=CC(=O)CC(O)CC 1458a_100016291481_100011218378 [0,1,1,0,0,0|0,0,2]=4 6731 B10R0.18 C=CC=CC(=O)C[C@@H](C)CC 1458a_100016291481_100009816398 [0,1,1,0,0,0|0,0,2]=4 6732 B10R0.18 C=CC=CC(=O)NC(C)CC 1626a_100000209981_100016291481 [0,1,1,0,0,0|1,0,1]=4 6733 B10R0.19 C=CC=CC(=O)C(C)CCC 1458a_100016291481_100000766640 [0,1,1,0,0,0|0,0,2]=4 6734 B10R0.19 C=CC=CC(=O)N(C)CCC 1626a_100000747261_100016291481 [0,1,1,0,0,0|1,0,1]=4 6735 B10R0.19 C=CCC(=O)/C(=C/CCC)/C 1458a_200020648666_100000210623 [0,1,1,0,0,0|1,0,1]=4 6736 B10R0.78 C=CC=CC(=O)CCC(C)C 1458a_100016291481_100000210312 [0,1,1,0,0,0|0,0,2]=4 6737 B10R0.78 C=CC=CC(=O)CCC(C)O 1458a_100016291481_100012276601 [0,1,1,0,0,0|0,0,2]=4 6738 B10R0.78 C=CC=CC(=O)NCC(C)C 1626a_100000210953_100016291481 [0,1,1,0,0,0|1,0,1]=4 6739 B10R0.91 C/C=C/C=CC(=O)CCCC 1458a_100000185730_100000210211 [0,1,1,0,0,0|0,0,2]=4 6740 B10R0.91 C/C=C/C=CC(=O)NCCC 11a_100020643023_100000185730 [0,1,1,0,0,0|1,0,1]=4 6741 B10R0.91 C/C=C/C=CC(=O)NCCC 1626a_100020643023_100000185730 [0,1,1,0,0,0|1,0,1]=4 6742 B10R0.91 C/C=C/C=CC(=O)NCCC 240690a_100020643023_100000185730 [0,1,1,0,0,0|1,0,1]=4 6743 B10R0.91 C=CC=CC(=O)C/C=C\CC 1458a_100016291481_100103147603 [0,1,1,0,0,0|0,0,2]=4 6744 B10R0.91 C=CC=CC(=O)CCCCC 1458a_100016291481_100000210326 [0,1,1,0,0,0|0,0,2]=4 6745 B10R0.91 C=CC=CC(=O)CCCCF 1458a_100016291481_100000729493 [0,1,1,0,0,0|0,0,2]=4 6746 B10R0.91 C=CC=CC(=O)CCCCO 1458a_100016291481_100000210776 [0,1,1,0,0,0|0,0,2]=4 6747 B10R0.91 C=CC=CC(=O)CCCOC 1458a_100016291481_100000740836 [0,1,1,0,0,0|0,0,2]=4 6748 B10R0.91 C=CC=CC(=O)CCOCC 1458a_100016291481_100011215890 [0,1,1,0,0,0|0,0,2]=4 6749 B10R0.91 C=CC=CC(=O)CCSCC 1458a_100016291481_100000757381 [0,1,1,0,0,0|0,0,2]=4 6750 B10R0.91 C=CC=CC(=O)NCCCC 1626a_100000102301_100016291481 [0,1,1,0,0,0|0,0,2]=4 6751 B10R0.91 C=CC=CC(=O)NCCCF 1626a_100015189416_100016291481 [0,1,1,0,0,0|1,0,1]=4 6752 B10R0.91 C=CC=CC(=O)NCCOC 1626a_100000209980_100016291481 [0,1,1,0,0,0|1,0,1]=4 6753 B10R0.91 C=CC=CC(=O)NCCSC 1626a_100020590264_100016291481 [0,1,1,0,0,0|1,0,1]=4 6754 B10R0.91 C=CC=CC(=O)NNCCC 22a_100000740057_100016291481 [0,1,1,0,0,0|1,0,1]=4 6755 B10R0.71 CC=CC=CC=NNCCC 4a_100000740057_100000691131 [0,1,1,0,0,0|2,0,0]=4 6756 B10R0.74 CCC/C=C/C=CC(=O)CC 1458a_200016258893_100000210202 [0,1,1,0,0,0|1,0,1]=4 6757 B10R0.74 CCC/C=C/C=CC(=O)CF 1458a_200016258893_100015361967 [0,1,1,0,0,0|1,0,1]=4 6758 B10R0.74 CCC/C=C/C=CC(=O)NC 11a_106832991635_200016258893 [0,1,1,0,0,0|2,0,0]=4 6759 B10R0.74 CCC/C=C/C=CC(=O)NC 1626a_100102657272_200016258893 [0,1,1,0,0,0|2,0,0]=4 6760 B10R0.74 CCC/C=C/C=CC(=O)NC 240690a_100102657272_200016258893 [0,1,1,0,0,0|2,0,0]=4 6761 B10R1.1 C/C=C/c1ccc(cc1)O 271570a_203496583355_100016259036 [1,1,0,0,0,0|0,0,2]=4 6762 B10R1.1 CC=Cc1ccc(cc1)Br 271570a_100016259895_100000752885 [1,1,0,0,0,0|0,0,2]=4 6763 B10R1.1 CC=Cc1ccc(cc1)C 271570a_100016259895_100000186775 [1,1,0,0,0,0|0,0,2]=4 6764 B10R1.1 CC=Cc1ccc(cc1)Cl 271570a_100016259895_100000755918 [1,1,0,0,0,0|0,0,2]=4 6765 B10R1.1 CC=Cc1ccc(cc1)F 271570a_100016259895_100000211213 [1,1,0,0,0,0|0,0,2]=4 6766 B10R1.1 CC=Cc1ccc(cc1)N 271570a_100016259895_100000185761 [1,1,0,0,0,0|0,0,2]=4 6767 B10R1.1 CC=Cc1ccc(cc1)O 271570a_100016259895_100000185759 [1,1,0,0,0,0|0,0,2]=4 6768 B10R1.1 CCCc1ccc(cc1)O 271570a_203496583355_100000750032 [1,1,0,0,0,0|0,0,0]=2 6769 B10R1.1 CCCc1cnc(nc1)O 271570a_203496583355_100000039067 [1,1,0,0,0,0|2,0,0]=4 6770 B10R1.1 CCNc1ccc(cc1)Br 2230a_100000210018_100000210202 [1,1,0,0,0,0|1,0,0]=3 6771 B10R1.1 CCNc1ccc(cc1)Br 34a_100000210018_100000210202 [1,1,0,0,0,0|1,0,0]=3 6772 B10R1.1 CCNc1ccc(cc1)C 34a_100000124888_100000210202 [1,1,0,0,0,0|1,0,0]=3 6773 B10R1.1 CCNc1ccc(cc1)Cl 2230a_100000210052_100000210202 [1,1,0,0,0,0|1,0,0]=3 6774 B10R1.1 CCNc1ccc(cc1)Cl 34a_100000210052_100000210202 [1,1,0,0,0,0|1,0,0]=3 6775 B10R1.1 CCNc1ccc(cc1)F 34a_100000185862_100000210202 [1,1,0,0,0,0|1,0,0]=3 6776 B10R1.1 CCNc1ccc(cc1)I 34a_100000185761_100000210202 [1,1,0,0,0,0|1,0,0]=3 6777 B10R1.1 CCNc1ccc(cc1)O 271570a_203496583355_100000219632 [1,1,0,0,0,0|1,0,0]=3 6778 B10R1.1 CCNc1ccc(cc1)O 34a_100000185829_100000210202 [1,1,0,0,0,0|1,0,0]=3 6779 B10R1.1 CCNc1ccc(cn1)Br 27a_100015525214_100000686858 [1,1,0,0,0,0|2,0,0]=4 6780 B10R1.1 CCNc1ccc(cn1)O 271570a_203496583355_100000741496 [1,1,0,0,0,0|2,0,0]=4 6781 B10R1.1 CCOc1ccc(=O)[nH]c1 34a_100000075641_100000210202 [1,1,0,0,0,0|2,0,0]=4 6782 B10R1.1 CCOc1ccc(cc1)Br 34a_100000185759_100000210202 [1,1,0,0,0,0|1,0,0]=3 6783 B10R1.1 CCOc1ccc(cc1)Br 7a_100000185759_100000210202 [1,1,0,0,0,0|1,0,0]=3 6784 B10R1.1 CCOc1ccc(cc1)C 34a_100000210336_100000210202 [1,1,0,0,0,0|1,0,0]=3 6785 B10R1.1 CCOc1ccc(cc1)C 7a_100000210336_100000210202 [1,1,0,0,0,0|1,0,0]=3 6786 B10R1.1 CCOc1ccc(cc1)Cl 34a_100000210216_100000210202 [1,1,0,0,0,0|1,0,0]=3 6787 B10R1.1 CCOc1ccc(cc1)Cl 7a_100000210216_100000210202 [1,1,0,0,0,0|1,0,0]=3 6788 B10R1.1 CCOc1ccc(cc1)F 34a_100000210339_100000210202 [1,1,0,0,0,0|1,0,0]=3 6789 B10R1.1 CCOc1ccc(cc1)I 34a_100000212066_100000210202 [1,1,0,0,0,0|1,0,0]=3 6790 B10R1.1 CCOc1ccc(cc1)I 7a_100000212066_100000210202 [1,1,0,0,0,0|1,0,0]=3 6791 B10R1.1 CCOc1ccc(cc1)N 34a_100000185829_100000210202 [1,1,0,0,0,0|1,0,0]=3 6792 B10R1.1 CCOc1ccc(cc1)O 271570a_203496583355_100000169946 [1,1,0,0,0,0|1,0,0]=3 6793 B10R1.1 CCOc1ccc(cn1)C 34a_100000759353_100000210202 [1,1,0,0,0,0|2,0,0]=4 6794 B10R1.1 CCOc1ccc(cn1)Cl 34a_100011215309_100000210202 [1,1,0,0,0,0|2,0,0]=4 6795 B10R1.1 CCOc1ccc(cn1)F 34a_100000742473_100000210202 [1,1,0,0,0,0|2,0,0]=4 6796 B10R1.1 CCOc1ccc(cn1)N 34a_100000729260_100000210202 [1,1,0,0,0,0|2,0,0]=4 6797 B10R1.1 CCOc1ccc(cn1)O 271570a_203496583355_100011219444 [1,1,0,0,0,0|2,0,0]=4 6798 B10R1.1 CCOc1ccc(nc1)Br 34a_100000685995_100000210202 [1,1,0,0,0,0|2,0,0]=4 6799 B10R1.1 CCOc1ccc(nc1)Br 7a_100000685995_100000210202 [1,1,0,0,0,0|2,0,0]=4 6800 B10R1.1 CCOc1ccc(nc1)C 34a_100000745506_100000210202 [1,1,0,0,0,0|2,0,0]=4 6801 B10R1.1 CCOc1ccc(nc1)C 7a_100000745506_100000210202 [1,1,0,0,0,0|2,0,0]=4 6802 B10R1.1 CCOc1ccc(nc1)Cl 34a_100000744096_100000210202 [1,1,0,0,0,0|2,0,0]=4 6803 B10R1.1 CCOc1ccc(nc1)Cl 7a_100000744096_100000210202 [1,1,0,0,0,0|2,0,0]=4 6804 B10R1.1 CCOc1ccc(nc1)F 34a_100000688820_100000210202 [1,1,0,0,0,0|2,0,0]=4 6805 B10R1.1 CCOc1ccc(nc1)F 7a_100000688820_100000210202 [1,1,0,0,0,0|2,0,0]=4 6806 B10R1.1 CCOc1ccc(nc1)I 34a_100000687607_100000210202 [1,1,0,0,0,0|2,0,0]=4 6807 B10R1.1 CCOc1ccc(nc1)I 7a_100000687607_100000210202 [1,1,0,0,0,0|2,0,0]=4 6808 B10R1.1 CCOc1ccc(nc1)N 34a_100015188713_100000210202 [1,1,0,0,0,0|2,0,0]=4 6809 B10R1.1 CCOc1ccc(nc1)N 7a_100015188713_100000210202 [1,1,0,0,0,0|2,0,0]=4 6810 B10R1.1 CCOc1ccc(nc1)O 271570a_203496583355_100000753957 [1,1,0,0,0,0|2,0,0]=4 6811 B10R1.1 CCSc1cc[n+](cc1)[O-] 62a_100000210202_100000039755 [1,1,0,0,0,0|2,0,0]=4 6812 B10R1.1 CCSc1ccc(=O)[nH]c1 62a_100000210202_100000212171 [1,1,0,0,0,0|2,0,0]=4 6813 B10R1.1 CCSc1ccc(=O)[nH]c1 62a_100000212171_100000210202 [1,1,0,0,0,0|2,0,0]=4 6814 B10R1.1 CCSc1ccc(cc1)Br 62a_100000210202_100000752885 [1,1,0,0,0,0|1,0,0]=3 6815 B10R1.1 CCSc1ccc(cc1)Br 62a_100000752885_100000210202 [1,1,0,0,0,0|1,0,0]=3 6816 B10R1.1 CCSc1ccc(cc1)C 62a_100000186775_100000210202 [1,1,0,0,0,0|1,0,0]=3 6817 B10R1.1 CCSc1ccc(cc1)C 62a_100000210202_100000186775 [1,1,0,0,0,0|1,0,0]=3 6818 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000210202_100000755918 [1,1,0,0,0,0|1,0,0]=3 6819 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000755918_100000210202 [1,1,0,0,0,0|1,0,0]=3 6820 B10R1.1 CCSc1ccc(cc1)F 62a_100000210202_100000211213 [1,1,0,0,0,0|1,0,0]=3 6821 B10R1.1 CCSc1ccc(cc1)F 62a_100000211213_100000210202 [1,1,0,0,0,0|1,0,0]=3 6822 B10R1.1 CCSc1ccc(cc1)N 62a_100000185761_100000210202 [1,1,0,0,0,0|1,0,0]=3 6823 B10R1.1 CCSc1ccc(cc1)N 62a_100000210202_100000185761 [1,1,0,0,0,0|1,0,0]=3 6824 B10R1.1 CCSc1ccc(cc1)O 271570a_203496583355_200009811893 [1,1,0,0,0,0|1,0,0]=3 6825 B10R1.1 CCSc1ccc(cc1)O 62a_100000210202_100000185759 [1,1,0,0,0,0|1,0,0]=3 6826 B10R1.1 CCSc1ccc(cn1)Br 62a_100000210202_100000686858 [1,1,0,0,0,0|2,0,0]=4 6827 B10R1.1 CCSc1ccc(cn1)Br 62a_100000686858_100000210202 [1,1,0,0,0,0|2,0,0]=4 6828 B10R1.1 CCSc1ccc(cn1)C 62a_100000210202_100000754016 [1,1,0,0,0,0|2,0,0]=4 6829 B10R1.1 CCSc1ccc(cn1)C 62a_100011192072_100000210202 [1,1,0,0,0,0|2,0,0]=4 6830 B10R1.1 CCSc1ccc(cn1)Cl 62a_100000210202_100011356976 [1,1,0,0,0,0|2,0,0]=4 6831 B10R1.1 CCSc1ccc(cn1)Cl 62a_100011356976_100000210202 [1,1,0,0,0,0|2,0,0]=4 6832 B10R1.1 CCSc1ccc(cn1)F 62a_100000210202_100000744514 [1,1,0,0,0,0|2,0,0]=4 6833 B10R1.1 CCSc1ccc(cn1)F 62a_100000744514_100000210202 [1,1,0,0,0,0|2,0,0]=4 6834 B10R1.1 CCSc1ccc(cn1)N 62a_100000210202_100000737798 [1,1,0,0,0,0|2,0,0]=4 6835 B10R1.1 CCSc1ccc(cn1)N 62a_100000737798_100000210202 [1,1,0,0,0,0|2,0,0]=4 6836 B10R1.1 CCSc1ccc(cn1)O 271570a_203496583355_100000690189 [1,1,0,0,0,0|2,0,0]=4 6837 B10R1.1 CCSc1ccc(cn1)O 62a_100000210202_100000744096 [1,1,0,0,0,0|2,0,0]=4 6838 B10R1.1 CCSc1ccc(cn1)O 62a_100000685995_100000210202 [1,1,0,0,0,0|2,0,0]=4 6839 B10R1.1 CCSc1ccc(nc1)Br 62a_100000210202_100009814638 [1,1,0,0,0,0|2,0,0]=4 6840 B10R1.1 CCSc1ccc(nc1)Br 62a_100009814638_100000210202 [1,1,0,0,0,0|2,0,0]=4 6841 B10R1.1 CCSc1ccc(nc1)C 62a_100000210202_100000751577 [1,1,0,0,0,0|2,0,0]=4 6842 B10R1.1 CCSc1ccc(nc1)C 62a_100000751577_100000210202 [1,1,0,0,0,0|2,0,0]=4 6843 B10R1.1 CCSc1ccc(nc1)Cl 62a_100000034144_100000210202 [1,1,0,0,0,0|2,0,0]=4 6844 B10R1.1 CCSc1ccc(nc1)Cl 62a_100000210202_100000034144 [1,1,0,0,0,0|2,0,0]=4 6845 B10R1.1 CCSc1ccc(nc1)F 62a_100000042367_100000210202 [1,1,0,0,0,0|2,0,0]=4 6846 B10R1.1 CCSc1ccc(nc1)F 62a_100000210202_100000042367 [1,1,0,0,0,0|2,0,0]=4 6847 B10R1.1 CCSc1ccc(nc1)N 62a_100000187370_100000210202 [1,1,0,0,0,0|2,0,0]=4 6848 B10R1.1 CCSc1ccc(nc1)N 62a_100000210202_100000187370 [1,1,0,0,0,0|2,0,0]=4 6849 B10R1.1 CNCc1ccc(cc1)Br 207a_100102657272_100000186029 [1,1,0,0,0,0|1,0,0]=3 6850 B10R1.1 CNCc1ccc(cc1)Br 2230a_100000174875_200000210301 [1,1,0,0,0,0|1,0,0]=3 6851 B10R1.1 CNCc1ccc(cc1)Br 2230a_106832991635_100011217064 [1,1,0,0,0,0|1,0,0]=3 6852 B10R1.1 CNCc1ccc(cc1)Br 26a_100102657272_100000185759 [1,1,0,0,0,0|1,0,0]=3 6853 B10R1.1 CNCc1ccc(cc1)Br 270004a_106832991635_100000186029 [1,1,0,0,0,0|1,0,0]=3 6854 B10R1.1 CNCc1ccc(cc1)Br 34a_100000174875_200000210301 [1,1,0,0,0,0|1,0,0]=3 6855 B10R1.1 CNCc1ccc(cc1)Br 34a_100102657272_100000189115 [1,1,0,0,0,0|1,0,0]=3 6856 B10R1.1 CNCc1ccc(cc1)Br 7a_106832991635_100011217064 [1,1,0,0,0,0|1,0,0]=3 6857 B10R1.1 CNCc1ccc(cc1)C 207a_100102657272_100000211033 [1,1,0,0,0,0|1,0,0]=3 6858 B10R1.1 CNCc1ccc(cc1)C 2230a_100000174908_200000210301 [1,1,0,0,0,0|1,0,0]=3 6859 B10R1.1 CNCc1ccc(cc1)C 2230a_106832991635_100000210814 [1,1,0,0,0,0|1,0,0]=3 6860 B10R1.1 CNCc1ccc(cc1)C 26a_100102657272_200020625495 [1,1,0,0,0,0|1,0,0]=3 6861 B10R1.1 CNCc1ccc(cc1)C 270004a_106832991635_100000211033 [1,1,0,0,0,0|1,0,0]=3 6862 B10R1.1 CNCc1ccc(cc1)C 34a_100000174908_200000210301 [1,1,0,0,0,0|1,0,0]=3 6863 B10R1.1 CNCc1ccc(cc1)C 34a_100102657272_100000210814 [1,1,0,0,0,0|1,0,0]=3 6864 B10R1.1 CNCc1ccc(cc1)C 7a_106832991635_100000210814 [1,1,0,0,0,0|1,0,0]=3 6865 B10R1.1 CNCc1ccc(cc1)Cl 207a_100102657272_100000189385 [1,1,0,0,0,0|1,0,0]=3 6866 B10R1.1 CNCc1ccc(cc1)Cl 2230a_100000174871_200000210301 [1,1,0,0,0,0|1,0,0]=3 6867 B10R1.1 CNCc1ccc(cc1)Cl 2230a_106832991635_100000694040 [1,1,0,0,0,0|1,0,0]=3 6868 B10R1.1 CNCc1ccc(cc1)Cl 270004a_106832991635_100000189385 [1,1,0,0,0,0|1,0,0]=3 6869 B10R1.1 CNCc1ccc(cc1)Cl 34a_100000174871_200000210301 [1,1,0,0,0,0|1,0,0]=3 6870 B10R1.1 CNCc1ccc(cc1)Cl 34a_100102657272_100000694040 [1,1,0,0,0,0|1,0,0]=3 6871 B10R1.1 CNCc1ccc(cc1)Cl 7a_106832991635_100000187161 [1,1,0,0,0,0|1,0,0]=3 6872 B10R1.1 CNCc1ccc(cc1)F 207a_100102657272_100000210084 [1,1,0,0,0,0|1,0,0]=3 6873 B10R1.1 CNCc1ccc(cc1)F 2230a_100000174882_200000210301 [1,1,0,0,0,0|1,0,0]=3 6874 B10R1.1 CNCc1ccc(cc1)F 2230a_106832991635_100000198546 [1,1,0,0,0,0|1,0,0]=3 6875 B10R1.1 CNCc1ccc(cc1)F 270004a_106832991635_100000210084 [1,1,0,0,0,0|1,0,0]=3 6876 B10R1.1 CNCc1ccc(cc1)F 34a_100000174882_200000210301 [1,1,0,0,0,0|1,0,0]=3 6877 B10R1.1 CNCc1ccc(cc1)F 34a_100102657272_100000198546 [1,1,0,0,0,0|1,0,0]=3 6878 B10R1.1 CNCc1ccc(cc1)F 7a_106832991635_100000198546 [1,1,0,0,0,0|1,0,0]=3 6879 B10R1.1 CNCc1ccc(cc1)I 207a_100102657272_100000188517 [1,1,0,0,0,0|1,0,0]=3 6880 B10R1.1 CNCc1ccc(cc1)I 2230a_100016989417_200000210301 [1,1,0,0,0,0|1,0,0]=3 6881 B10R1.1 CNCc1ccc(cc1)I 2230a_106832991635_100000189116 [1,1,0,0,0,0|1,0,0]=3 6882 B10R1.1 CNCc1ccc(cc1)I 34a_100016989417_200000210301 [1,1,0,0,0,0|1,0,0]=3 6883 B10R1.1 CNCc1ccc(cc1)I 34a_100102657272_100000189116 [1,1,0,0,0,0|1,0,0]=3 6884 B10R1.1 CNCc1ccc(cc1)I 7a_106832991635_100000189116 [1,1,0,0,0,0|1,0,0]=3 6885 B10R1.1 CNCc1ccc(cc1)O 271570a_203496583355_100000180866 [1,1,0,0,0,0|1,0,0]=3 6886 B10R1.1 CNCc1ccc(cc1)O 34a_100000185549_200000210301 [1,1,0,0,0,0|1,0,0]=3 6887 B10R1.1 CNCc1ccc(cn1)Br 207a_100102657272_100000754260 [1,1,0,0,0,0|2,0,0]=4 6888 B10R1.1 CNCc1ccc(cn1)Br 2230a_106832991635_100000702658 [1,1,0,0,0,0|2,0,0]=4 6889 B10R1.1 CNCc1ccc(cn1)Br 270004a_106832991635_100000754260 [1,1,0,0,0,0|2,0,0]=4 6890 B10R1.1 CNCc1ccc(cn1)Br 34a_100015188789_200000210301 [1,1,0,0,0,0|2,0,0]=4 6891 B10R1.1 CNCc1ccc(cn1)Br 34a_100102657272_100000702658 [1,1,0,0,0,0|2,0,0]=4 6892 B10R1.1 CNCc1ccc(cn1)Br 7a_106832991635_100000702658 [1,1,0,0,0,0|2,0,0]=4 6893 B10R1.1 CNCc1ccc(cn1)C 207a_100102657272_100000050478 [1,1,0,0,0,0|2,0,0]=4 6894 B10R1.1 CNCc1ccc(cn1)C 2230a_106832991635_100000691093 [1,1,0,0,0,0|2,0,0]=4 6895 B10R1.1 CNCc1ccc(cn1)C 270004a_106832991635_100000050478 [1,1,0,0,0,0|2,0,0]=4 6896 B10R1.1 CNCc1ccc(cn1)C 34a_100015187455_200000210301 [1,1,0,0,0,0|2,0,0]=4 6897 B10R1.1 CNCc1ccc(cn1)C 34a_100102657272_100000691093 [1,1,0,0,0,0|2,0,0]=4 6898 B10R1.1 CNCc1ccc(cn1)C 7a_106832991635_100000691093 [1,1,0,0,0,0|2,0,0]=4 6899 B10R1.1 CNCc1ccc(cn1)Cl 207a_100102657272_100011361569 [1,1,0,0,0,0|2,0,0]=4 6900 B10R1.1 CNCc1ccc(cn1)Cl 2230a_106832991635_100012066911 [1,1,0,0,0,0|2,0,0]=4 6901 B10R1.1 CNCc1ccc(cn1)Cl 270004a_106832991635_100011361569 [1,1,0,0,0,0|2,0,0]=4 6902 B10R1.1 CNCc1ccc(cn1)Cl 34a_100000697193_200000210301 [1,1,0,0,0,0|2,0,0]=4 6903 B10R1.1 CNCc1ccc(cn1)Cl 34a_100102657272_100012066911 [1,1,0,0,0,0|2,0,0]=4 6904 B10R1.1 CNCc1ccc(cn1)Cl 7a_106832991635_100012066911 [1,1,0,0,0,0|2,0,0]=4 6905 B10R1.1 CNCc1ccc(cn1)F 207a_100102657272_100011934744 [1,1,0,0,0,0|2,0,0]=4 6906 B10R1.1 CNCc1ccc(cn1)F 2230a_106832991635_100000703193 [1,1,0,0,0,0|2,0,0]=4 6907 B10R1.1 CNCc1ccc(cn1)F 270004a_106832991635_100011934744 [1,1,0,0,0,0|2,0,0]=4 6908 B10R1.1 CNCc1ccc(cn1)F 34a_100020620131_200000210301 [1,1,0,0,0,0|2,0,0]=4 6909 B10R1.1 CNCc1ccc(cn1)F 34a_100102657272_100000703193 [1,1,0,0,0,0|2,0,0]=4 6910 B10R1.1 CNCc1ccc(cn1)F 7a_106832991635_100000703193 [1,1,0,0,0,0|2,0,0]=4 6911 B10R1.1 CNCc1ccc(nc1)Br 2230a_100009817727_200000210301 [1,1,0,0,0,0|2,0,0]=4 6912 B10R1.1 CNCc1ccc(nc1)Br 2230a_106832991635_100009831999 [1,1,0,0,0,0|2,0,0]=4 6913 B10R1.1 CNCc1ccc(nc1)Br 34a_100009817727_200000210301 [1,1,0,0,0,0|2,0,0]=4 6914 B10R1.1 CNCc1ccc(nc1)Br 34a_100102657272_100009831999 [1,1,0,0,0,0|2,0,0]=4 6915 B10R1.1 CNCc1ccc(nc1)Br 7a_106832991635_100009831999 [1,1,0,0,0,0|2,0,0]=4 6916 B10R1.1 CNCc1ccc(nc1)C 2230a_106832991635_100016987292 [1,1,0,0,0,0|2,0,0]=4 6917 B10R1.1 CNCc1ccc(nc1)C 270004a_106832991635_100000743784 [1,1,0,0,0,0|2,0,0]=4 6918 B10R1.1 CNCc1ccc(nc1)C 34a_100000740942_200000210301 [1,1,0,0,0,0|2,0,0]=4 6919 B10R1.1 CNCc1ccc(nc1)C 34a_100102657272_100016987292 [1,1,0,0,0,0|2,0,0]=4 6920 B10R1.1 CNCc1ccc(nc1)C 7a_106832991635_100016987292 [1,1,0,0,0,0|2,0,0]=4 6921 B10R1.1 CNCc1ccc(nc1)Cl 2230a_100000735879_200000210301 [1,1,0,0,0,0|2,0,0]=4 6922 B10R1.1 CNCc1ccc(nc1)Cl 2230a_106832991635_100000735431 [1,1,0,0,0,0|2,0,0]=4 6923 B10R1.1 CNCc1ccc(nc1)Cl 34a_100000735879_200000210301 [1,1,0,0,0,0|2,0,0]=4 6924 B10R1.1 CNCc1ccc(nc1)Cl 34a_100102657272_100000735431 [1,1,0,0,0,0|2,0,0]=4 6925 B10R1.1 CNCc1ccc(nc1)Cl 7a_106832991635_100000735431 [1,1,0,0,0,0|2,0,0]=4 6926 B10R1.1 CNCc1ccc(nc1)F 2230a_100000101913_200000210301 [1,1,0,0,0,0|2,0,0]=4 6927 B10R1.1 CNCc1ccc(nc1)F 2230a_106832991635_100009820150 [1,1,0,0,0,0|2,0,0]=4 6928 B10R1.1 CNCc1ccc(nc1)F 34a_100000101913_200000210301 [1,1,0,0,0,0|2,0,0]=4 6929 B10R1.1 CNCc1ccc(nc1)F 34a_100102657272_100000099788 [1,1,0,0,0,0|2,0,0]=4 6930 B10R1.1 CNCc1ccc(nc1)F 7a_106832991635_100009820150 [1,1,0,0,0,0|2,0,0]=4 6931 B10R1.1 CNCc1ccc(nc1)O 207a_100102657272_100011361521 [1,1,0,0,0,0|2,0,0]=4 6932 B10R1.1 CNCc1ccc(nc1)O 2230a_100000757128_200000210301 [1,1,0,0,0,0|2,0,0]=4 6933 B10R1.1 CNCc1ccc(nc1)O 271570a_203496583355_100000026953 [1,1,0,0,0,0|2,0,0]=4 6934 B10R1.1 COCc1cc[n+](cc1)C 34a_100009831711_200000210301 [1,1,0,0,0,0|2,0,0]=4 6935 B10R1.1 COCc1cc[n+](cc1)[O-] 34a_100000031831_200000210301 [1,1,0,0,0,0|2,0,0]=4 6936 B10R1.1 COCc1cc[n+](cc1)[O-] 7a_100000031831_200000210301 [1,1,0,0,0,0|2,0,0]=4 6937 B10R1.1 COCc1ccc(=O)[nH]c1 34a_100011999846_200000210301 [1,1,0,0,0,0|2,0,0]=4 6938 B10R1.1 COCc1ccc(cc1)Br 34a_100000695286_200000210301 [1,1,0,0,0,0|1,0,0]=3 6939 B10R1.1 COCc1ccc(cc1)Br 34a_100138415774_100000189115 [1,1,0,0,0,0|1,0,0]=3 6940 B10R1.1 COCc1ccc(cc1)C 34a_100011215236_200000210301 [1,1,0,0,0,0|1,0,0]=3 6941 B10R1.1 COCc1ccc(cc1)C 34a_100138415774_100000210814 [1,1,0,0,0,0|1,0,0]=3 6942 B10R1.1 COCc1ccc(cc1)C 7a_100011215236_200000210301 [1,1,0,0,0,0|1,0,0]=3 6943 B10R1.1 COCc1ccc(cc1)Cl 34a_100000211118_200000210301 [1,1,0,0,0,0|1,0,0]=3 6944 B10R1.1 COCc1ccc(cc1)Cl 34a_100138415774_100000694040 [1,1,0,0,0,0|1,0,0]=3 6945 B10R1.1 COCc1ccc(cc1)Cl 7a_100000211118_200000210301 [1,1,0,0,0,0|1,0,0]=3 6946 B10R1.1 COCc1ccc(cc1)F 34a_100000210977_200000210301 [1,1,0,0,0,0|1,0,0]=3 6947 B10R1.1 COCc1ccc(cc1)F 34a_100138415774_100000198546 [1,1,0,0,0,0|1,0,0]=3 6948 B10R1.1 COCc1ccc(cc1)F 7a_100000210977_200000210301 [1,1,0,0,0,0|1,0,0]=3 6949 B10R1.1 COCc1ccc(cc1)I 34a_100000690907_200000210301 [1,1,0,0,0,0|1,0,0]=3 6950 B10R1.1 COCc1ccc(cc1)I 34a_100138415774_100000189116 [1,1,0,0,0,0|1,0,0]=3 6951 B10R1.1 COCc1ccc(cc1)I 7a_100000690907_200000210301 [1,1,0,0,0,0|1,0,0]=3 6952 B10R1.1 COCc1ccc(cc1)N 34a_100011215238_200000210301 [1,1,0,0,0,0|1,0,0]=3 6953 B10R1.1 COCc1ccc(cc1)O 271570a_203496583355_100011493685 [1,1,0,0,0,0|1,0,0]=3 6954 B10R1.1 COCc1ccc(cn1)Br 34a_100000754261_200000210301 [1,1,0,0,0,0|2,0,0]=4 6955 B10R1.1 COCc1ccc(cn1)Br 34a_100138415774_100000702658 [1,1,0,0,0,0|2,0,0]=4 6956 B10R1.1 COCc1ccc(cn1)C 34a_100012001401_200000210301 [1,1,0,0,0,0|2,0,0]=4 6957 B10R1.1 COCc1ccc(cn1)C 34a_100138415774_100000691093 [1,1,0,0,0,0|2,0,0]=4 6958 B10R1.1 COCc1ccc(cn1)Cl 34a_100000703999_200000210301 [1,1,0,0,0,0|2,0,0]=4 6959 B10R1.1 COCc1ccc(cn1)Cl 34a_100138415774_100012066911 [1,1,0,0,0,0|2,0,0]=4 6960 B10R1.1 COCc1ccc(cn1)F 34a_100011999454_200000210301 [1,1,0,0,0,0|2,0,0]=4 6961 B10R1.1 COCc1ccc(cn1)F 34a_100138415774_100000703193 [1,1,0,0,0,0|2,0,0]=4 6962 B10R1.1 COCc1ccc(cn1)N 34a_100011998161_200000210301 [1,1,0,0,0,0|2,0,0]=4 6963 B10R1.1 COCc1ccc(nc1)Br 34a_100009816760_200000210301 [1,1,0,0,0,0|2,0,0]=4 6964 B10R1.1 COCc1ccc(nc1)Br 34a_100138415774_100009831999 [1,1,0,0,0,0|2,0,0]=4 6965 B10R1.1 COCc1ccc(nc1)Br 7a_100009816760_200000210301 [1,1,0,0,0,0|2,0,0]=4 6966 B10R1.1 COCc1ccc(nc1)C 34a_100011248133_200000210301 [1,1,0,0,0,0|2,0,0]=4 6967 B10R1.1 COCc1ccc(nc1)C 34a_100138415774_100016987292 [1,1,0,0,0,0|2,0,0]=4 6968 B10R1.1 COCc1ccc(nc1)Cl 34a_100000755211_200000210301 [1,1,0,0,0,0|2,0,0]=4 6969 B10R1.1 COCc1ccc(nc1)Cl 34a_100138415774_100000735431 [1,1,0,0,0,0|2,0,0]=4 6970 B10R1.1 COCc1ccc(nc1)Cl 7a_100000755211_200000210301 [1,1,0,0,0,0|2,0,0]=4 6971 B10R1.1 COCc1ccc(nc1)F 34a_100000079959_200000210301 [1,1,0,0,0,0|2,0,0]=4 6972 B10R1.1 COCc1ccc(nc1)F 34a_100138415774_100000099788 [1,1,0,0,0,0|2,0,0]=4 6973 B10R1.1 COCc1ccc(nc1)N 34a_100000704267_200000210301 [1,1,0,0,0,0|2,0,0]=4 6974 B10R1.1 CSCc1ccc(cc1)Br 62a_100000189115_200000210301 [1,1,0,0,0,0|1,0,0]=3 6975 B10R1.1 CSCc1ccc(cc1)Br 62a_200000210301_100000189115 [1,1,0,0,0,0|1,0,0]=3 6976 B10R1.1 CSCc1ccc(cc1)C 62a_100000210814_200000210301 [1,1,0,0,0,0|1,0,0]=3 6977 B10R1.1 CSCc1ccc(cc1)C 62a_200000210301_100000210814 [1,1,0,0,0,0|1,0,0]=3 6978 B10R1.1 CSCc1ccc(cc1)Cl 62a_100000187161_200000210301 [1,1,0,0,0,0|1,0,0]=3 6979 B10R1.1 CSCc1ccc(cc1)Cl 62a_200000210301_100000187161 [1,1,0,0,0,0|1,0,0]=3 6980 B10R1.1 CSCc1ccc(cc1)F 62a_100000198546_200000210301 [1,1,0,0,0,0|1,0,0]=3 6981 B10R1.1 CSCc1ccc(cc1)F 62a_200000210301_100000187164 [1,1,0,0,0,0|1,0,0]=3 6982 B10R1.1 CSCc1ccc(cc1)I 62a_100000189116_200000210301 [1,1,0,0,0,0|1,0,0]=3 6983 B10R1.1 CSCc1ccc(cc1)I 62a_200000210301_100000189116 [1,1,0,0,0,0|1,0,0]=3 6984 B10R1.1 CSCc1ccc(cn1)Br 62a_100000702658_200000210301 [1,1,0,0,0,0|2,0,0]=4 6985 B10R1.1 CSCc1ccc(cn1)Br 62a_200000210301_100000702658 [1,1,0,0,0,0|2,0,0]=4 6986 B10R1.1 CSCc1ccc(cn1)C 62a_100000691093_200000210301 [1,1,0,0,0,0|2,0,0]=4 6987 B10R1.1 CSCc1ccc(cn1)C 62a_200000210301_100000691093 [1,1,0,0,0,0|2,0,0]=4 6988 B10R1.1 CSCc1ccc(cn1)Cl 62a_100012066911_200000210301 [1,1,0,0,0,0|2,0,0]=4 6989 B10R1.1 CSCc1ccc(cn1)Cl 62a_200000210301_100000697101 [1,1,0,0,0,0|2,0,0]=4 6990 B10R1.1 CSCc1ccc(cn1)F 62a_100000703193_200000210301 [1,1,0,0,0,0|2,0,0]=4 6991 B10R1.1 CSCc1ccc(cn1)F 62a_200000210301_100000703193 [1,1,0,0,0,0|2,0,0]=4 6992 B10R1.1 CSCc1ccc(nc1)Br 62a_100009831999_200000210301 [1,1,0,0,0,0|2,0,0]=4 6993 B10R1.1 CSCc1ccc(nc1)Br 62a_200000210301_100009831999 [1,1,0,0,0,0|2,0,0]=4 6994 B10R1.1 CSCc1ccc(nc1)C 62a_100016987292_200000210301 [1,1,0,0,0,0|2,0,0]=4 6995 B10R1.1 CSCc1ccc(nc1)C 62a_200000210301_100016987292 [1,1,0,0,0,0|2,0,0]=4 6996 B10R1.1 CSCc1ccc(nc1)Cl 62a_100000735431_200000210301 [1,1,0,0,0,0|2,0,0]=4 6997 B10R1.1 CSCc1ccc(nc1)Cl 62a_200000210301_100000735431 [1,1,0,0,0,0|2,0,0]=4 6998 B10R1.1 CSCc1ccc(nc1)F 62a_100009820150_200000210301 [1,1,0,0,0,0|2,0,0]=4 6999 B10R1.1 CSCc1ccc(nc1)F 62a_200000210301_100000099788 [1,1,0,0,0,0|2,0,0]=4 7000 B10R1.1 CSCc1ccc(nc1)O 271570a_203496583355_100000753673 [1,1,0,0,0,0|2,0,0]=4 7001 B10R1.1 C[n+]1ccc(cc1)CO[13CH3] 34a_100009831711_200025704644 [1,1,0,0,0,0|2,0,0]=4 7002 B10R1.1 Cc1ccc(cc1)CN[13CH3] 2230a_100000174908_200025704644 [1,1,0,0,0,0|1,0,0]=3 7003 B10R1.1 Cc1ccc(cc1)CN[13CH3] 34a_100000174908_200025704644 [1,1,0,0,0,0|1,0,0]=3 7004 B10R1.1 Cc1ccc(cc1)CO[13CH3] 34a_100011215236_200025704644 [1,1,0,0,0,0|1,0,0]=3 7005 B10R1.1 Cc1ccc(cc1)CO[13CH3] 7a_100011215236_200025704644 [1,1,0,0,0,0|1,0,0]=3 7006 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_100000210814_200025704644 [1,1,0,0,0,0|1,0,0]=3 7007 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000210814 [1,1,0,0,0,0|1,0,0]=3 7008 B10R1.1 Cc1ccc(cc1)NCF 34a_100000124888_100015361967 [1,1,0,0,0,0|2,0,0]=4 7009 B10R1.1 Cc1ccc(cc1)OCF 34a_100000210336_100015361967 [1,1,0,0,0,0|2,0,0]=4 7010 B10R1.1 Cc1ccc(cc1)OCF 7a_100000210336_100015361967 [1,1,0,0,0,0|2,0,0]=4 7011 B10R1.1 Cc1ccc(cc1)SCF 62a_100000186775_100015361967 [1,1,0,0,0,0|2,0,0]=4 7012 B10R1.1 Cc1ccc(cc1)SCF 62a_100015361967_100000186775 [1,1,0,0,0,0|2,0,0]=4 7013 B10R1.1 Cc1ccc(cn1)CN[13CH3] 34a_100000740942_200025704644 [1,1,0,0,0,0|2,0,0]=4 7014 B10R1.1 Cc1ccc(cn1)CO[13CH3] 34a_100011248133_200025704644 [1,1,0,0,0,0|2,0,0]=4 7015 B10R1.1 Cc1ccc(cn1)CS[13CH3] 62a_100016987292_200025704644 [1,1,0,0,0,0|2,0,0]=4 7016 B10R1.1 Cc1ccc(cn1)CS[13CH3] 62a_200025704644_100016987292 [1,1,0,0,0,0|2,0,0]=4 7017 B10R1.1 Cc1ccc(nc1)CN[13CH3] 34a_100015187455_200025704644 [1,1,0,0,0,0|2,0,0]=4 7018 B10R1.1 Cc1ccc(nc1)CO[13CH3] 34a_100012001401_200025704644 [1,1,0,0,0,0|2,0,0]=4 7019 B10R1.1 Cc1ccc(nc1)CS[13CH3] 62a_100000691093_200025704644 [1,1,0,0,0,0|2,0,0]=4 7020 B10R1.1 Cc1ccc(nc1)CS[13CH3] 62a_200025704644_100000691093 [1,1,0,0,0,0|2,0,0]=4 7021 B10R1.1 FCNc1ccc(cc1)Br 34a_100000210018_100015361967 [1,1,0,0,0,0|2,0,0]=4 7022 B10R1.1 FCNc1ccc(cc1)Cl 34a_100000210052_100015361967 [1,1,0,0,0,0|2,0,0]=4 7023 B10R1.1 FCNc1ccc(cc1)F 34a_100000185862_100015361967 [1,1,0,0,0,0|2,0,0]=4 7024 B10R1.1 FCNc1ccc(cc1)I 34a_100000185761_100015361967 [1,1,0,0,0,0|2,0,0]=4 7025 B10R1.1 FCOc1ccc(cc1)Br 34a_100000185759_100015361967 [1,1,0,0,0,0|2,0,0]=4 7026 B10R1.1 FCOc1ccc(cc1)Br 7a_100000185759_100015361967 [1,1,0,0,0,0|2,0,0]=4 7027 B10R1.1 FCOc1ccc(cc1)Cl 34a_100000210216_100015361967 [1,1,0,0,0,0|2,0,0]=4 7028 B10R1.1 FCOc1ccc(cc1)Cl 7a_100000210216_100015361967 [1,1,0,0,0,0|2,0,0]=4 7029 B10R1.1 FCOc1ccc(cc1)F 34a_100000210339_100015361967 [1,1,0,0,0,0|2,0,0]=4 7030 B10R1.1 FCOc1ccc(cc1)I 34a_100000212066_100015361967 [1,1,0,0,0,0|2,0,0]=4 7031 B10R1.1 FCOc1ccc(cc1)I 7a_100000212066_100015361967 [1,1,0,0,0,0|2,0,0]=4 7032 B10R1.1 FCSc1ccc(cc1)Br 62a_100000752885_100015361967 [1,1,0,0,0,0|2,0,0]=4 7033 B10R1.1 FCSc1ccc(cc1)Br 62a_100015361967_100000752885 [1,1,0,0,0,0|2,0,0]=4 7034 B10R1.1 FCSc1ccc(cc1)Cl 62a_100000755918_100015361967 [1,1,0,0,0,0|2,0,0]=4 7035 B10R1.1 FCSc1ccc(cc1)Cl 62a_100015361967_100000755918 [1,1,0,0,0,0|2,0,0]=4 7036 B10R1.1 FCSc1ccc(cc1)F 62a_100000211213_100015361967 [1,1,0,0,0,0|2,0,0]=4 7037 B10R1.1 FCSc1ccc(cc1)F 62a_100015361967_100000211213 [1,1,0,0,0,0|2,0,0]=4 7038 B10R1.1 N#CCc1ccc(cc1)O 271570a_203496583355_100011217881 [1,1,0,0,0,0|1,0,1]=4 7039 B10R1.1 NCCc1ccc(cc1)O 271570a_203496583355_100000755846 [1,1,0,0,0,0|1,0,0]=3 7040 B10R1.1 NNCc1ccc(cc1)O 271570a_203496583355_100016993955 [1,1,0,0,0,0|2,0,0]=4 7041 B10R1.1 Nc1ccc(cc1)OCF 34a_100000185829_100015361967 [1,1,0,0,0,0|2,0,0]=4 7042 B10R1.1 Nc1ccc(cc1)SCF 62a_100000185761_100015361967 [1,1,0,0,0,0|2,0,0]=4 7043 B10R1.1 Nc1ccc(cc1)SCF 62a_100015361967_100000185761 [1,1,0,0,0,0|2,0,0]=4 7044 B10R1.1 O=CCc1ccc(cc1)O 271570a_203496583355_100011361690 [1,1,0,0,0,0|1,0,1]=4 7045 B10R1.1 OCCc1ccc(cc1)O 271570a_203496583355_100000766406 [1,1,0,0,0,0|1,0,0]=3 7046 B10R1.1 OCCc1ccc(cn1)O 271570a_203496583355_100012357577 [1,1,0,0,0,0|2,0,0]=4 7047 B10R1.1 OCCc1ccc(nc1)O 271570a_203496583355_100009880866 [1,1,0,0,0,0|2,0,0]=4 7048 B10R1.1 Oc1ccc(cc1)NCF 34a_100000185829_100015361967 [1,1,0,0,0,0|2,0,0]=4 7049 B10R1.1 Oc1ccc(cc1)SCF 62a_100015361967_100000185759 [1,1,0,0,0,0|2,0,0]=4 7050 B10R1.1 [13CH3]NCc1ccc(cc1)Br 2230a_100000174875_200025704644 [1,1,0,0,0,0|1,0,0]=3 7051 B10R1.1 [13CH3]NCc1ccc(cc1)Br 34a_100000174875_200025704644 [1,1,0,0,0,0|1,0,0]=3 7052 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 2230a_100000174871_200025704644 [1,1,0,0,0,0|1,0,0]=3 7053 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 34a_100000174871_200025704644 [1,1,0,0,0,0|1,0,0]=3 7054 B10R1.1 [13CH3]NCc1ccc(cc1)F 2230a_100000174882_200025704644 [1,1,0,0,0,0|1,0,0]=3 7055 B10R1.1 [13CH3]NCc1ccc(cc1)F 34a_100000174882_200025704644 [1,1,0,0,0,0|1,0,0]=3 7056 B10R1.1 [13CH3]NCc1ccc(cc1)I 2230a_100016989417_200025704644 [1,1,0,0,0,0|1,0,0]=3 7057 B10R1.1 [13CH3]NCc1ccc(cc1)I 34a_100016989417_200025704644 [1,1,0,0,0,0|1,0,0]=3 7058 B10R1.1 [13CH3]NCc1ccc(cc1)O 34a_100000185549_200025704644 [1,1,0,0,0,0|1,0,0]=3 7059 B10R1.1 [13CH3]NCc1ccc(cn1)Br 34a_100015188789_200025704644 [1,1,0,0,0,0|2,0,0]=4 7060 B10R1.1 [13CH3]NCc1ccc(cn1)Cl 34a_100000697193_200025704644 [1,1,0,0,0,0|2,0,0]=4 7061 B10R1.1 [13CH3]NCc1ccc(cn1)F 34a_100020620131_200025704644 [1,1,0,0,0,0|2,0,0]=4 7062 B10R1.1 [13CH3]NCc1ccc(nc1)Br 2230a_100009817727_200025704644 [1,1,0,0,0,0|2,0,0]=4 7063 B10R1.1 [13CH3]NCc1ccc(nc1)Br 34a_100009817727_200025704644 [1,1,0,0,0,0|2,0,0]=4 7064 B10R1.1 [13CH3]NCc1ccc(nc1)Cl 2230a_100000735879_200025704644 [1,1,0,0,0,0|2,0,0]=4 7065 B10R1.1 [13CH3]NCc1ccc(nc1)Cl 34a_100000735879_200025704644 [1,1,0,0,0,0|2,0,0]=4 7066 B10R1.1 [13CH3]NCc1ccc(nc1)F 2230a_100000101913_200025704644 [1,1,0,0,0,0|2,0,0]=4 7067 B10R1.1 [13CH3]NCc1ccc(nc1)F 34a_100000101913_200025704644 [1,1,0,0,0,0|2,0,0]=4 7068 B10R1.1 [13CH3]NCc1ccc(nc1)O 2230a_100000757128_200025704644 [1,1,0,0,0,0|2,0,0]=4 7069 B10R1.1 [13CH3]OCc1cc[n+](cc1)[O-] 34a_100000031831_200025704644 [1,1,0,0,0,0|2,0,0]=4 7070 B10R1.1 [13CH3]OCc1cc[n+](cc1)[O-] 7a_100000031831_200025704644 [1,1,0,0,0,0|2,0,0]=4 7071 B10R1.1 [13CH3]OCc1ccc(=O)[nH]c1 34a_100011999846_200025704644 [1,1,0,0,0,0|2,0,0]=4 7072 B10R1.1 [13CH3]OCc1ccc(cc1)Br 34a_100000695286_200025704644 [1,1,0,0,0,0|1,0,0]=3 7073 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 34a_100000211118_200025704644 [1,1,0,0,0,0|1,0,0]=3 7074 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 7a_100000211118_200025704644 [1,1,0,0,0,0|1,0,0]=3 7075 B10R1.1 [13CH3]OCc1ccc(cc1)F 34a_100000210977_200025704644 [1,1,0,0,0,0|1,0,0]=3 7076 B10R1.1 [13CH3]OCc1ccc(cc1)F 7a_100000210977_200025704644 [1,1,0,0,0,0|1,0,0]=3 7077 B10R1.1 [13CH3]OCc1ccc(cc1)I 34a_100000690907_200025704644 [1,1,0,0,0,0|1,0,0]=3 7078 B10R1.1 [13CH3]OCc1ccc(cc1)I 7a_100000690907_200025704644 [1,1,0,0,0,0|1,0,0]=3 7079 B10R1.1 [13CH3]OCc1ccc(cc1)N 34a_100011215238_200025704644 [1,1,0,0,0,0|1,0,0]=3 7080 B10R1.1 [13CH3]OCc1ccc(cn1)Br 34a_100000754261_200025704644 [1,1,0,0,0,0|2,0,0]=4 7081 B10R1.1 [13CH3]OCc1ccc(cn1)Cl 34a_100000703999_200025704644 [1,1,0,0,0,0|2,0,0]=4 7082 B10R1.1 [13CH3]OCc1ccc(cn1)F 34a_100011999454_200025704644 [1,1,0,0,0,0|2,0,0]=4 7083 B10R1.1 [13CH3]OCc1ccc(cn1)N 34a_100011998161_200025704644 [1,1,0,0,0,0|2,0,0]=4 7084 B10R1.1 [13CH3]OCc1ccc(nc1)Br 34a_100009816760_200025704644 [1,1,0,0,0,0|2,0,0]=4 7085 B10R1.1 [13CH3]OCc1ccc(nc1)Br 7a_100009816760_200025704644 [1,1,0,0,0,0|2,0,0]=4 7086 B10R1.1 [13CH3]OCc1ccc(nc1)Cl 34a_100000755211_200025704644 [1,1,0,0,0,0|2,0,0]=4 7087 B10R1.1 [13CH3]OCc1ccc(nc1)Cl 7a_100000755211_200025704644 [1,1,0,0,0,0|2,0,0]=4 7088 B10R1.1 [13CH3]OCc1ccc(nc1)F 34a_100000079959_200025704644 [1,1,0,0,0,0|2,0,0]=4 7089 B10R1.1 [13CH3]OCc1ccc(nc1)N 34a_100000704267_200025704644 [1,1,0,0,0,0|2,0,0]=4 7090 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_100000189115_200025704644 [1,1,0,0,0,0|1,0,0]=3 7091 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_200025704644_100000189115 [1,1,0,0,0,0|1,0,0]=3 7092 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_100000187161_200025704644 [1,1,0,0,0,0|1,0,0]=3 7093 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_200025704644_100000187161 [1,1,0,0,0,0|1,0,0]=3 7094 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_100000198546_200025704644 [1,1,0,0,0,0|1,0,0]=3 7095 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_200025704644_100000187164 [1,1,0,0,0,0|1,0,0]=3 7096 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_100000189116_200025704644 [1,1,0,0,0,0|1,0,0]=3 7097 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_200025704644_100000189116 [1,1,0,0,0,0|1,0,0]=3 7098 B10R1.1 [13CH3]SCc1ccc(cn1)Br 62a_100000702658_200025704644 [1,1,0,0,0,0|2,0,0]=4 7099 B10R1.1 [13CH3]SCc1ccc(cn1)Br 62a_200025704644_100000702658 [1,1,0,0,0,0|2,0,0]=4 7100 B10R1.1 [13CH3]SCc1ccc(cn1)Cl 62a_100012066911_200025704644 [1,1,0,0,0,0|2,0,0]=4 7101 B10R1.1 [13CH3]SCc1ccc(cn1)Cl 62a_200025704644_100000697101 [1,1,0,0,0,0|2,0,0]=4 7102 B10R1.1 [13CH3]SCc1ccc(cn1)F 62a_100000703193_200025704644 [1,1,0,0,0,0|2,0,0]=4 7103 B10R1.1 [13CH3]SCc1ccc(cn1)F 62a_200025704644_100000703193 [1,1,0,0,0,0|2,0,0]=4 7104 B10R1.1 [13CH3]SCc1ccc(nc1)Br 62a_100009831999_200025704644 [1,1,0,0,0,0|2,0,0]=4 7105 B10R1.1 [13CH3]SCc1ccc(nc1)Br 62a_200025704644_100009831999 [1,1,0,0,0,0|2,0,0]=4 7106 B10R1.1 [13CH3]SCc1ccc(nc1)Cl 62a_100000735431_200025704644 [1,1,0,0,0,0|2,0,0]=4 7107 B10R1.1 [13CH3]SCc1ccc(nc1)Cl 62a_200025704644_100000735431 [1,1,0,0,0,0|2,0,0]=4 7108 B10R1.1 [13CH3]SCc1ccc(nc1)F 62a_100009820150_200025704644 [1,1,0,0,0,0|2,0,0]=4 7109 B10R1.1 [13CH3]SCc1ccc(nc1)F 62a_200025704644_100000099788 [1,1,0,0,0,0|2,0,0]=4 7110 B10R1.10 C=CCc1cccc(c1)O 271570a_203496583355_100009816576 [1,1,0,0,0,0|0,0,2]=4 7111 B10R1.10 CC#Cc1cccc(c1)O 271570a_203496583355_200009843338 [1,1,0,0,0,0|0,0,2]=4 7112 B10R1.10 CC=Cc1cccc(c1)Br 271570a_100016259895_100000691529 [1,1,0,0,0,0|0,0,2]=4 7113 B10R1.10 CC=Cc1cccc(c1)C 271570a_100016259895_100011215228 [1,1,0,0,0,0|0,0,2]=4 7114 B10R1.10 CC=Cc1cccc(c1)Cl 271570a_100016259895_100000699651 [1,1,0,0,0,0|0,0,2]=4 7115 B10R1.10 CC=Cc1cccc(c1)F 271570a_100016259895_100000685547 [1,1,0,0,0,0|0,0,2]=4 7116 B10R1.10 CC=Cc1cccc(c1)N 271570a_100016259895_100000210019 [1,1,0,0,0,0|0,0,2]=4 7117 B10R1.10 CC=Cc1cccc(c1)O 271570a_100016259895_100000211634 [1,1,0,0,0,0|0,0,2]=4 7118 B10R1.10 CC=Cc1cccc(c1)[S] 271570a_100016259895_114929384022 [1,1,0,0,0,0|0,0,2]=4 7119 B10R1.10 CCCc1cccc(c1)O 271570a_203496583355_100000694964 [1,1,0,0,0,0|0,0,0]=2 7120 B10R1.10 CCNc1cc(ccn1)F 27a_100015525214_100000764206 [1,1,0,0,0,0|2,0,0]=4 7121 B10R1.10 CCNc1cc[nH]c(=O)c1 27a_100015525214_100000061649 [1,1,0,0,0,0|2,0,0]=4 7122 B10R1.10 CCNc1cccc(c1)Br 34a_100000210019_100000210202 [1,1,0,0,0,0|1,0,0]=3 7123 B10R1.10 CCNc1cccc(c1)C 2230a_100000188690_100000210202 [1,1,0,0,0,0|1,0,0]=3 7124 B10R1.10 CCNc1cccc(c1)C 34a_100000188690_100000210202 [1,1,0,0,0,0|1,0,0]=3 7125 B10R1.10 CCNc1cccc(c1)Cl 34a_100000185859_100000210202 [1,1,0,0,0,0|1,0,0]=3 7126 B10R1.10 CCNc1cccc(c1)F 34a_100000210047_100000210202 [1,1,0,0,0,0|1,0,0]=3 7127 B10R1.10 CCNc1cccc(c1)I 34a_100000211102_100000210202 [1,1,0,0,0,0|1,0,0]=3 7128 B10R1.10 CCNc1cccc(c1)O 271570a_203496583355_100000738899 [1,1,0,0,0,0|1,0,0]=3 7129 B10R1.10 CCNc1cccc(c1)O 34a_100000210217_100000210202 [1,1,0,0,0,0|1,0,0]=3 7130 B10R1.10 CCNc1cccc(n1)F 27a_100015525214_100009815982 [1,1,0,0,0,0|2,0,0]=4 7131 B10R1.10 CCNc1cccc(n1)O 271570a_203496583355_200020678610 [1,1,0,0,0,0|2,0,0]=4 7132 B10R1.10 CCNc1ccnc(c1)C 27a_100015525214_100000758586 [1,1,0,0,0,0|2,0,0]=4 7133 B10R1.10 CCNc1ccnc(c1)F 27a_100015525214_100009816116 [1,1,0,0,0,0|2,0,0]=4 7134 B10R1.10 CCOc1cc(ccn1)O 271570a_203496583355_100009995528 [1,1,0,0,0,0|2,0,0]=4 7135 B10R1.10 CCOc1cc[nH]c(=O)c1 34a_100000032262_100000210202 [1,1,0,0,0,0|2,0,0]=4 7136 B10R1.10 CCOc1ccc[n+](c1)[O-] 34a_100000039713_100000210202 [1,1,0,0,0,0|2,0,0]=4 7137 B10R1.10 CCOc1ccc[n+](c1)[O-] 7a_100000039713_100000210202 [1,1,0,0,0,0|2,0,0]=4 7138 B10R1.10 CCOc1cccc(=O)[nH]1 34a_100000033347_100000210202 [1,1,0,0,0,0|2,0,0]=4 7139 B10R1.10 CCOc1cccc(c1)Br 34a_100000210342_100000210202 [1,1,0,0,0,0|1,0,0]=3 7140 B10R1.10 CCOc1cccc(c1)Br 7a_100000210342_100000210202 [1,1,0,0,0,0|1,0,0]=3 7141 B10R1.10 CCOc1cccc(c1)C 34a_100000210337_100000210202 [1,1,0,0,0,0|1,0,0]=3 7142 B10R1.10 CCOc1cccc(c1)C 7a_100000210337_100000210202 [1,1,0,0,0,0|1,0,0]=3 7143 B10R1.10 CCOc1cccc(c1)Cl 34a_100000210295_100000210202 [1,1,0,0,0,0|1,0,0]=3 7144 B10R1.10 CCOc1cccc(c1)Cl 7a_100000210295_100000210202 [1,1,0,0,0,0|1,0,0]=3 7145 B10R1.10 CCOc1cccc(c1)F 34a_100000210426_100000210202 [1,1,0,0,0,0|1,0,0]=3 7146 B10R1.10 CCOc1cccc(c1)F 7a_100000210426_100000210202 [1,1,0,0,0,0|1,0,0]=3 7147 B10R1.10 CCOc1cccc(c1)I 34a_100000211634_100000210202 [1,1,0,0,0,0|1,0,0]=3 7148 B10R1.10 CCOc1cccc(c1)I 7a_100000211634_100000210202 [1,1,0,0,0,0|1,0,0]=3 7149 B10R1.10 CCOc1cccc(c1)N 34a_100000210217_100000210202 [1,1,0,0,0,0|1,0,0]=3 7150 B10R1.10 CCOc1cccc(c1)O 271570a_203496583355_100000170002 [1,1,0,0,0,0|1,0,0]=3 7151 B10R1.10 CCOc1cccc(n1)F 34a_100011432558_100000210202 [1,1,0,0,0,0|2,0,0]=4 7152 B10R1.10 CCOc1cccc(n1)O 271570a_203496583355_100000752924 [1,1,0,0,0,0|2,0,0]=4 7153 B10R1.10 CCOc1ccnc(c1)C 34a_100000688365_100000210202 [1,1,0,0,0,0|2,0,0]=4 7154 B10R1.10 CCOc1ccnc(c1)Cl 34a_100000762945_100000210202 [1,1,0,0,0,0|2,0,0]=4 7155 B10R1.10 CCOc1ccnc(c1)F 34a_100000732698_100000210202 [1,1,0,0,0,0|2,0,0]=4 7156 B10R1.10 CCOc1ccnc(c1)N 34a_100011834064_100000210202 [1,1,0,0,0,0|2,0,0]=4 7157 B10R1.10 CCOc1ccnc(c1)O 271570a_203496583355_100011922638 [1,1,0,0,0,0|2,0,0]=4 7158 B10R1.10 CCOc1cncc(c1)Br 34a_100000754920_100000210202 [1,1,0,0,0,0|2,0,0]=4 7159 B10R1.10 CCOc1cncc(c1)Br 7a_100000754920_100000210202 [1,1,0,0,0,0|2,0,0]=4 7160 B10R1.10 CCOc1cncc(c1)C 34a_100011830280_100000210202 [1,1,0,0,0,0|2,0,0]=4 7161 B10R1.10 CCOc1cncc(c1)C 7a_100011830280_100000210202 [1,1,0,0,0,0|2,0,0]=4 7162 B10R1.10 CCOc1cncc(c1)Cl 7a_100000032511_100000210202 [1,1,0,0,0,0|2,0,0]=4 7163 B10R1.10 CCOc1cncc(c1)F 34a_100011830296_100000210202 [1,1,0,0,0,0|2,0,0]=4 7164 B10R1.10 CCOc1cncc(c1)F 7a_100011830296_100000210202 [1,1,0,0,0,0|2,0,0]=4 7165 B10R1.10 CCOc1cncc(c1)N 34a_100011997051_100000210202 [1,1,0,0,0,0|2,0,0]=4 7166 B10R1.10 CCOc1cncc(c1)O 271570a_203496583355_100012029586 [1,1,0,0,0,0|2,0,0]=4 7167 B10R1.10 CCSc1cc(=O)cc[nH]1 62a_100009817434_100000210202 [1,1,0,0,0,0|2,0,0]=4 7168 B10R1.10 CCSc1cc(ccn1)C 62a_100000210202_100000750283 [1,1,0,0,0,0|2,0,0]=4 7169 B10R1.10 CCSc1cc(ccn1)C 62a_100000750283_100000210202 [1,1,0,0,0,0|2,0,0]=4 7170 B10R1.10 CCSc1cc(ccn1)Cl 62a_100000210202_100010167805 [1,1,0,0,0,0|2,0,0]=4 7171 B10R1.10 CCSc1cc(ccn1)Cl 62a_100010167805_100000210202 [1,1,0,0,0,0|2,0,0]=4 7172 B10R1.10 CCSc1cc(ccn1)F 62a_100000210202_100000764206 [1,1,0,0,0,0|2,0,0]=4 7173 B10R1.10 CCSc1cc(ccn1)F 62a_100000764206_100000210202 [1,1,0,0,0,0|2,0,0]=4 7174 B10R1.10 CCSc1cc(ccn1)N 62a_100000210202_100009814236 [1,1,0,0,0,0|2,0,0]=4 7175 B10R1.10 CCSc1cc(ccn1)N 62a_100009814236_100000210202 [1,1,0,0,0,0|2,0,0]=4 7176 B10R1.10 CCSc1cc(ccn1)O 62a_100000210202_100000762945 [1,1,0,0,0,0|2,0,0]=4 7177 B10R1.10 CCSc1cc[nH]c(=O)c1 62a_100000210202_100009816521 [1,1,0,0,0,0|2,0,0]=4 7178 B10R1.10 CCSc1cc[nH]c(=O)c1 62a_100009816521_100000210202 [1,1,0,0,0,0|2,0,0]=4 7179 B10R1.10 CCSc1ccc[n+](c1)C 62a_100000210202_100009996589 [1,1,0,0,0,0|2,0,0]=4 7180 B10R1.10 CCSc1ccc[n+](c1)C 62a_100009996589_100000210202 [1,1,0,0,0,0|2,0,0]=4 7181 B10R1.10 CCSc1ccc[n+](c1)[O-] 62a_100000210202_100009815978 [1,1,0,0,0,0|2,0,0]=4 7182 B10R1.10 CCSc1cccc(=O)[nH]1 62a_100000210202_100000752884 [1,1,0,0,0,0|2,0,0]=4 7183 B10R1.10 CCSc1cccc(c1)Br 62a_100000210202_100000691529 [1,1,0,0,0,0|1,0,0]=3 7184 B10R1.10 CCSc1cccc(c1)Br 62a_100000691529_100000210202 [1,1,0,0,0,0|1,0,0]=3 7185 B10R1.10 CCSc1cccc(c1)C 62a_100000210202_100011215228 [1,1,0,0,0,0|1,0,0]=3 7186 B10R1.10 CCSc1cccc(c1)C 62a_100011215228_100000210202 [1,1,0,0,0,0|1,0,0]=3 7187 B10R1.10 CCSc1cccc(c1)Cl 62a_100000210202_100000699651 [1,1,0,0,0,0|1,0,0]=3 7188 B10R1.10 CCSc1cccc(c1)Cl 62a_100000699651_100000210202 [1,1,0,0,0,0|1,0,0]=3 7189 B10R1.10 CCSc1cccc(c1)F 62a_100000210202_100000685547 [1,1,0,0,0,0|1,0,0]=3 7190 B10R1.10 CCSc1cccc(c1)F 62a_100000685547_100000210202 [1,1,0,0,0,0|1,0,0]=3 7191 B10R1.10 CCSc1cccc(c1)N 62a_100000210019_100000210202 [1,1,0,0,0,0|1,0,0]=3 7192 B10R1.10 CCSc1cccc(c1)N 62a_100000210202_100000210019 [1,1,0,0,0,0|1,0,0]=3 7193 B10R1.10 CCSc1cccc(c1)O 271570a_203496583355_100000703699 [1,1,0,0,0,0|1,0,0]=3 7194 B10R1.10 CCSc1cccc(c1)O 62a_100000210202_100000211634 [1,1,0,0,0,0|1,0,0]=3 7195 B10R1.10 CCSc1cccc(c1)[S] 62a_100000210202_114929384022 [1,1,0,0,0,0|1,0,0]=3 7196 B10R1.10 CCSc1cccc(c1)[S] 62a_114929384022_100000210202 [1,1,0,0,0,0|1,0,0]=3 7197 B10R1.10 CCSc1cccc(n1)Br 62a_100000210202_100000684672 [1,1,0,0,0,0|2,0,0]=4 7198 B10R1.10 CCSc1cccc(n1)Br 62a_100000684672_100000210202 [1,1,0,0,0,0|2,0,0]=4 7199 B10R1.10 CCSc1cccc(n1)C 62a_100000210202_100000742759 [1,1,0,0,0,0|2,0,0]=4 7200 B10R1.10 CCSc1cccc(n1)C 62a_100000742759_100000210202 [1,1,0,0,0,0|2,0,0]=4 7201 B10R1.10 CCSc1cccc(n1)Cl 62a_100000051397_100000210202 [1,1,0,0,0,0|2,0,0]=4 7202 B10R1.10 CCSc1cccc(n1)Cl 62a_100000210202_100000051397 [1,1,0,0,0,0|2,0,0]=4 7203 B10R1.10 CCSc1cccc(n1)F 62a_100000210202_100009815982 [1,1,0,0,0,0|2,0,0]=4 7204 B10R1.10 CCSc1cccc(n1)F 62a_100009815982_100000210202 [1,1,0,0,0,0|2,0,0]=4 7205 B10R1.10 CCSc1cccc(n1)N 62a_100000210202_100000740741 [1,1,0,0,0,0|2,0,0]=4 7206 B10R1.10 CCSc1cccc(n1)N 62a_100000740741_100000210202 [1,1,0,0,0,0|2,0,0]=4 7207 B10R1.10 CCSc1ccnc(c1)Br 62a_100000210202_100009814637 [1,1,0,0,0,0|2,0,0]=4 7208 B10R1.10 CCSc1ccnc(c1)Br 62a_100009814637_100000210202 [1,1,0,0,0,0|2,0,0]=4 7209 B10R1.10 CCSc1ccnc(c1)C 62a_100000210202_100000758586 [1,1,0,0,0,0|2,0,0]=4 7210 B10R1.10 CCSc1ccnc(c1)C 62a_100000758586_100000210202 [1,1,0,0,0,0|2,0,0]=4 7211 B10R1.10 CCSc1ccnc(c1)Cl 62a_100000035001_100000210202 [1,1,0,0,0,0|2,0,0]=4 7212 B10R1.10 CCSc1ccnc(c1)Cl 62a_100000210202_100000035001 [1,1,0,0,0,0|2,0,0]=4 7213 B10R1.10 CCSc1ccnc(c1)F 62a_100000210202_100009816116 [1,1,0,0,0,0|2,0,0]=4 7214 B10R1.10 CCSc1ccnc(c1)F 62a_100009816116_100000210202 [1,1,0,0,0,0|2,0,0]=4 7215 B10R1.10 CCSc1ccnc(c1)N 62a_100000049665_100000210202 [1,1,0,0,0,0|2,0,0]=4 7216 B10R1.10 CCSc1ccnc(c1)N 62a_100000210202_100000049665 [1,1,0,0,0,0|2,0,0]=4 7217 B10R1.10 CCSc1cncc(c1)Br 62a_100000210202_100000728054 [1,1,0,0,0,0|2,0,0]=4 7218 B10R1.10 CCSc1cncc(c1)Br 62a_100000728054_100000210202 [1,1,0,0,0,0|2,0,0]=4 7219 B10R1.10 CCSc1cncc(c1)C 62a_100000210202_100000760492 [1,1,0,0,0,0|2,0,0]=4 7220 B10R1.10 CCSc1cncc(c1)C 62a_100000760492_100000210202 [1,1,0,0,0,0|2,0,0]=4 7221 B10R1.10 CCSc1cncc(c1)Cl 62a_100000049639_100000210202 [1,1,0,0,0,0|2,0,0]=4 7222 B10R1.10 CCSc1cncc(c1)Cl 62a_100000210202_100000049639 [1,1,0,0,0,0|2,0,0]=4 7223 B10R1.10 CCSc1cncc(c1)F 62a_100000210202_100000744099 [1,1,0,0,0,0|2,0,0]=4 7224 B10R1.10 CCSc1cncc(c1)F 62a_100000744099_100000210202 [1,1,0,0,0,0|2,0,0]=4 7225 B10R1.10 CCSc1cncc(c1)N 62a_100000210202_100000687067 [1,1,0,0,0,0|2,0,0]=4 7226 B10R1.10 CCSc1cncc(c1)N 62a_100000687067_100000210202 [1,1,0,0,0,0|2,0,0]=4 7227 B10R1.10 CCSc1cncc(c1)O 62a_100000210202_100000754920 [1,1,0,0,0,0|2,0,0]=4 7228 B10R1.10 CCSc1cncc(c1)O 62a_100000754920_100000210202 [1,1,0,0,0,0|2,0,0]=4 7229 B10R1.10 CNCc1cc(ccn1)Br 2230a_106832991635_100010173614 [1,1,0,0,0,0|2,0,0]=4 7230 B10R1.10 CNCc1cc(ccn1)Br 270004a_106832991635_100009818557 [1,1,0,0,0,0|2,0,0]=4 7231 B10R1.10 CNCc1cc(ccn1)Br 34a_100102657272_100010173614 [1,1,0,0,0,0|2,0,0]=4 7232 B10R1.10 CNCc1cc(ccn1)Br 7a_106832991635_100010173614 [1,1,0,0,0,0|2,0,0]=4 7233 B10R1.10 CNCc1cc(ccn1)C 207a_100102657272_100011361488 [1,1,0,0,0,0|2,0,0]=4 7234 B10R1.10 CNCc1cc(ccn1)C 2230a_106832991635_100000718516 [1,1,0,0,0,0|2,0,0]=4 7235 B10R1.10 CNCc1cc(ccn1)C 270004a_106832991635_100011361488 [1,1,0,0,0,0|2,0,0]=4 7236 B10R1.10 CNCc1cc(ccn1)C 34a_100102657272_100000718516 [1,1,0,0,0,0|2,0,0]=4 7237 B10R1.10 CNCc1cc(ccn1)C 7a_106832991635_100000718516 [1,1,0,0,0,0|2,0,0]=4 7238 B10R1.10 CNCc1cc(ccn1)Cl 2230a_106832991635_100016988179 [1,1,0,0,0,0|2,0,0]=4 7239 B10R1.10 CNCc1cc(ccn1)Cl 270004a_106832991635_100011998288 [1,1,0,0,0,0|2,0,0]=4 7240 B10R1.10 CNCc1cc(ccn1)Cl 34a_100102657272_100016988179 [1,1,0,0,0,0|2,0,0]=4 7241 B10R1.10 CNCc1cc(ccn1)Cl 7a_106832991635_100016988179 [1,1,0,0,0,0|2,0,0]=4 7242 B10R1.10 CNCc1cc(ccn1)O 271570a_203496583355_100102954512 [1,1,0,0,0,0|2,0,0]=4 7243 B10R1.10 CNCc1cccc(=O)[nH]1 207a_100102657272_100011935257 [1,1,0,0,0,0|2,0,0]=4 7244 B10R1.10 CNCc1cccc(=O)[nH]1 2230a_100000696482_200000210301 [1,1,0,0,0,0|2,0,0]=4 7245 B10R1.10 CNCc1cccc(c1)Br 207a_100102657272_100000210085 [1,1,0,0,0,0|1,0,0]=3 7246 B10R1.10 CNCc1cccc(c1)Br 2230a_100000174977_200000210301 [1,1,0,0,0,0|1,0,0]=3 7247 B10R1.10 CNCc1cccc(c1)Br 2230a_106832991635_100000698116 [1,1,0,0,0,0|1,0,0]=3 7248 B10R1.10 CNCc1cccc(c1)Br 26a_100102657272_100000210342 [1,1,0,0,0,0|1,0,0]=3 7249 B10R1.10 CNCc1cccc(c1)Br 270004a_106832991635_100000210085 [1,1,0,0,0,0|1,0,0]=3 7250 B10R1.10 CNCc1cccc(c1)Br 34a_100000174977_200000210301 [1,1,0,0,0,0|1,0,0]=3 7251 B10R1.10 CNCc1cccc(c1)Br 34a_100102657272_100000698116 [1,1,0,0,0,0|1,0,0]=3 7252 B10R1.10 CNCc1cccc(c1)Br 7a_106832991635_100000211773 [1,1,0,0,0,0|1,0,0]=3 7253 B10R1.10 CNCc1cccc(c1)C 207a_100102657272_100000211157 [1,1,0,0,0,0|1,0,0]=3 7254 B10R1.10 CNCc1cccc(c1)C 2230a_100000185548_200000210301 [1,1,0,0,0,0|1,0,0]=3 7255 B10R1.10 CNCc1cccc(c1)C 2230a_106832991635_100000211840 [1,1,0,0,0,0|1,0,0]=3 7256 B10R1.10 CNCc1cccc(c1)C 270004a_106832991635_100000211157 [1,1,0,0,0,0|1,0,0]=3 7257 B10R1.10 CNCc1cccc(c1)C 34a_100000185548_200000210301 [1,1,0,0,0,0|1,0,0]=3 7258 B10R1.10 CNCc1cccc(c1)C 34a_100102657272_100000211840 [1,1,0,0,0,0|1,0,0]=3 7259 B10R1.10 CNCc1cccc(c1)C 7a_106832991635_100000211840 [1,1,0,0,0,0|1,0,0]=3 7260 B10R1.10 CNCc1cccc(c1)Cl 207a_100102657272_100000210801 [1,1,0,0,0,0|1,0,0]=3 7261 B10R1.10 CNCc1cccc(c1)Cl 2230a_100000174878_200000210301 [1,1,0,0,0,0|1,0,0]=3 7262 B10R1.10 CNCc1cccc(c1)Cl 2230a_106832991635_100000181238 [1,1,0,0,0,0|1,0,0]=3 7263 B10R1.10 CNCc1cccc(c1)Cl 270004a_106832991635_100000210801 [1,1,0,0,0,0|1,0,0]=3 7264 B10R1.10 CNCc1cccc(c1)Cl 34a_100000174878_200000210301 [1,1,0,0,0,0|1,0,0]=3 7265 B10R1.10 CNCc1cccc(c1)Cl 34a_100102657272_100000187163 [1,1,0,0,0,0|1,0,0]=3 7266 B10R1.10 CNCc1cccc(c1)Cl 7a_106832991635_100000187163 [1,1,0,0,0,0|1,0,0]=3 7267 B10R1.10 CNCc1cccc(c1)F 207a_100102657272_100000210812 [1,1,0,0,0,0|1,0,0]=3 7268 B10R1.10 CNCc1cccc(c1)F 2230a_100000174948_200000210301 [1,1,0,0,0,0|1,0,0]=3 7269 B10R1.10 CNCc1cccc(c1)F 2230a_106832991635_100000230114 [1,1,0,0,0,0|1,0,0]=3 7270 B10R1.10 CNCc1cccc(c1)F 270004a_106832991635_100000210812 [1,1,0,0,0,0|1,0,0]=3 7271 B10R1.10 CNCc1cccc(c1)F 34a_100000174948_200000210301 [1,1,0,0,0,0|1,0,0]=3 7272 B10R1.10 CNCc1cccc(c1)F 34a_100102657272_100000187166 [1,1,0,0,0,0|1,0,0]=3 7273 B10R1.10 CNCc1cccc(c1)F 7a_106832991635_100000230114 [1,1,0,0,0,0|1,0,0]=3 7274 B10R1.10 CNCc1cccc(c1)I 207a_100102657272_100000014684 [1,1,0,0,0,0|1,0,0]=3 7275 B10R1.10 CNCc1cccc(c1)I 2230a_100000106179_200000210301 [1,1,0,0,0,0|1,0,0]=3 7276 B10R1.10 CNCc1cccc(c1)I 2230a_106832991635_100011218688 [1,1,0,0,0,0|1,0,0]=3 7277 B10R1.10 CNCc1cccc(c1)I 270004a_106832991635_100000014684 [1,1,0,0,0,0|1,0,0]=3 7278 B10R1.10 CNCc1cccc(c1)I 34a_100000106179_200000210301 [1,1,0,0,0,0|1,0,0]=3 7279 B10R1.10 CNCc1cccc(c1)I 34a_100102657272_100011218688 [1,1,0,0,0,0|1,0,0]=3 7280 B10R1.10 CNCc1cccc(c1)I 7a_106832991635_100011218688 [1,1,0,0,0,0|1,0,0]=3 7281 B10R1.10 CNCc1cccc(c1)O 207a_100102657272_100000188321 [1,1,0,0,0,0|1,0,0]=3 7282 B10R1.10 CNCc1cccc(c1)O 2230a_100000743036_200000210301 [1,1,0,0,0,0|1,0,0]=3 7283 B10R1.10 CNCc1cccc(c1)O 2230a_106832991635_100011660834 [1,1,0,0,0,0|1,0,0]=3 7284 B10R1.10 CNCc1cccc(c1)O 270004a_106832991635_100000188321 [1,1,0,0,0,0|1,0,0]=3 7285 B10R1.10 CNCc1cccc(c1)O 271570a_203496583355_100000187585 [1,1,0,0,0,0|1,0,0]=3 7286 B10R1.10 CNCc1cccc(c1)O 34a_100000743036_200000210301 [1,1,0,0,0,0|1,0,0]=3 7287 B10R1.10 CNCc1cccc(c1)O 34a_100102657272_100011660834 [1,1,0,0,0,0|1,0,0]=3 7288 B10R1.10 CNCc1cccc(c1)O 7a_106832991635_100000084143 [1,1,0,0,0,0|1,0,0]=3 7289 B10R1.10 CNCc1cccc(n1)Br 2230a_100016987751_200000210301 [1,1,0,0,0,0|2,0,0]=4 7290 B10R1.10 CNCc1cccc(n1)Br 2230a_106832991635_100009889011 [1,1,0,0,0,0|2,0,0]=4 7291 B10R1.10 CNCc1cccc(n1)Br 270004a_106832991635_100000688028 [1,1,0,0,0,0|2,0,0]=4 7292 B10R1.10 CNCc1cccc(n1)Br 34a_100102657272_100009889011 [1,1,0,0,0,0|2,0,0]=4 7293 B10R1.10 CNCc1cccc(n1)Br 7a_106832991635_100009889011 [1,1,0,0,0,0|2,0,0]=4 7294 B10R1.10 CNCc1cccc(n1)C 207a_100102657272_100011215050 [1,1,0,0,0,0|2,0,0]=4 7295 B10R1.10 CNCc1cccc(n1)C 2230a_106832991635_100000757606 [1,1,0,0,0,0|2,0,0]=4 7296 B10R1.10 CNCc1cccc(n1)C 270004a_106832991635_100011215050 [1,1,0,0,0,0|2,0,0]=4 7297 B10R1.10 CNCc1cccc(n1)C 34a_100000701342_200000210301 [1,1,0,0,0,0|2,0,0]=4 7298 B10R1.10 CNCc1cccc(n1)C 34a_100102657272_100000757606 [1,1,0,0,0,0|2,0,0]=4 7299 B10R1.10 CNCc1cccc(n1)C 7a_106832991635_100000757606 [1,1,0,0,0,0|2,0,0]=4 7300 B10R1.10 CNCc1cccc(n1)Cl 2230a_100016990191_200000210301 [1,1,0,0,0,0|2,0,0]=4 7301 B10R1.10 CNCc1cccc(n1)Cl 2230a_106832991635_100000086093 [1,1,0,0,0,0|2,0,0]=4 7302 B10R1.10 CNCc1cccc(n1)Cl 270004a_106832991635_100011361687 [1,1,0,0,0,0|2,0,0]=4 7303 B10R1.10 CNCc1cccc(n1)Cl 34a_100102657272_100000086093 [1,1,0,0,0,0|2,0,0]=4 7304 B10R1.10 CNCc1cccc(n1)Cl 7a_106832991635_100000086093 [1,1,0,0,0,0|2,0,0]=4 7305 B10R1.10 CNCc1cccc(n1)F 2230a_100015188798_200000210301 [1,1,0,0,0,0|2,0,0]=4 7306 B10R1.10 CNCc1cccc(n1)F 2230a_106832991635_100009819644 [1,1,0,0,0,0|2,0,0]=4 7307 B10R1.10 CNCc1cccc(n1)F 270004a_106832991635_100000050434 [1,1,0,0,0,0|2,0,0]=4 7308 B10R1.10 CNCc1cccc(n1)F 34a_100015188798_200000210301 [1,1,0,0,0,0|2,0,0]=4 7309 B10R1.10 CNCc1cccc(n1)F 34a_100102657272_100009819644 [1,1,0,0,0,0|2,0,0]=4 7310 B10R1.10 CNCc1cccc(n1)F 7a_106832991635_100009819644 [1,1,0,0,0,0|2,0,0]=4 7311 B10R1.10 CNCc1cccc(n1)O 271570a_203496583355_106354212997 [1,1,0,0,0,0|2,0,0]=4 7312 B10R1.10 CNCc1ccnc(c1)Br 2230a_100025757509_200000210301 [1,1,0,0,0,0|2,0,0]=4 7313 B10R1.10 CNCc1ccnc(c1)Br 2230a_106832991635_100010243470 [1,1,0,0,0,0|2,0,0]=4 7314 B10R1.10 CNCc1ccnc(c1)Br 270004a_106832991635_100009814634 [1,1,0,0,0,0|2,0,0]=4 7315 B10R1.10 CNCc1ccnc(c1)Br 34a_100025757509_200000210301 [1,1,0,0,0,0|2,0,0]=4 7316 B10R1.10 CNCc1ccnc(c1)Br 34a_100102657272_100010243470 [1,1,0,0,0,0|2,0,0]=4 7317 B10R1.10 CNCc1ccnc(c1)Br 7a_106832991635_100010254460 [1,1,0,0,0,0|2,0,0]=4 7318 B10R1.10 CNCc1ccnc(c1)C 207a_100102657272_100011361630 [1,1,0,0,0,0|2,0,0]=4 7319 B10R1.10 CNCc1ccnc(c1)C 2230a_106832991635_200020672517 [1,1,0,0,0,0|2,0,0]=4 7320 B10R1.10 CNCc1ccnc(c1)C 270004a_106832991635_100011361630 [1,1,0,0,0,0|2,0,0]=4 7321 B10R1.10 CNCc1ccnc(c1)C 34a_100011934566_200000210301 [1,1,0,0,0,0|2,0,0]=4 7322 B10R1.10 CNCc1ccnc(c1)C 34a_100102657272_200020672517 [1,1,0,0,0,0|2,0,0]=4 7323 B10R1.10 CNCc1ccnc(c1)C 7a_106832991635_200020672517 [1,1,0,0,0,0|2,0,0]=4 7324 B10R1.10 CNCc1ccnc(c1)Cl 2230a_100015205668_200000210301 [1,1,0,0,0,0|2,0,0]=4 7325 B10R1.10 CNCc1ccnc(c1)Cl 2230a_106832991635_100000764220 [1,1,0,0,0,0|2,0,0]=4 7326 B10R1.10 CNCc1ccnc(c1)Cl 270004a_106832991635_100011290808 [1,1,0,0,0,0|2,0,0]=4 7327 B10R1.10 CNCc1ccnc(c1)Cl 34a_100015205668_200000210301 [1,1,0,0,0,0|2,0,0]=4 7328 B10R1.10 CNCc1ccnc(c1)Cl 34a_100102657272_100000764220 [1,1,0,0,0,0|2,0,0]=4 7329 B10R1.10 CNCc1ccnc(c1)Cl 7a_106832991635_100000764220 [1,1,0,0,0,0|2,0,0]=4 7330 B10R1.10 CNCc1ccnc(c1)F 2230a_100015188774_200000210301 [1,1,0,0,0,0|2,0,0]=4 7331 B10R1.10 CNCc1ccnc(c1)F 270004a_106832991635_100000068331 [1,1,0,0,0,0|2,0,0]=4 7332 B10R1.10 CNCc1ccnc(c1)F 34a_100015188774_200000210301 [1,1,0,0,0,0|2,0,0]=4 7333 B10R1.10 CNCc1ccnc(c1)O 207a_100102657272_100000688113 [1,1,0,0,0,0|2,0,0]=4 7334 B10R1.10 CNCc1cncc(c1)Br 207a_100102657272_100000687066 [1,1,0,0,0,0|2,0,0]=4 7335 B10R1.10 CNCc1cncc(c1)Br 2230a_106832991635_100000738771 [1,1,0,0,0,0|2,0,0]=4 7336 B10R1.10 CNCc1cncc(c1)Br 270004a_106832991635_100000687066 [1,1,0,0,0,0|2,0,0]=4 7337 B10R1.10 CNCc1cncc(c1)Br 34a_100102657272_100000738771 [1,1,0,0,0,0|2,0,0]=4 7338 B10R1.10 CNCc1cncc(c1)Br 7a_106832991635_100000738771 [1,1,0,0,0,0|2,0,0]=4 7339 B10R1.10 CNCc1cncc(c1)C 207a_100102657272_100011998712 [1,1,0,0,0,0|2,0,0]=4 7340 B10R1.10 CNCc1cncc(c1)C 2230a_100000692839_200000210301 [1,1,0,0,0,0|2,0,0]=4 7341 B10R1.10 CNCc1cncc(c1)C 2230a_106832991635_100000716715 [1,1,0,0,0,0|2,0,0]=4 7342 B10R1.10 CNCc1cncc(c1)C 270004a_106832991635_100011998712 [1,1,0,0,0,0|2,0,0]=4 7343 B10R1.10 CNCc1cncc(c1)C 34a_100000692839_200000210301 [1,1,0,0,0,0|2,0,0]=4 7344 B10R1.10 CNCc1cncc(c1)C 34a_100102657272_100000716715 [1,1,0,0,0,0|2,0,0]=4 7345 B10R1.10 CNCc1cncc(c1)C 7a_106832991635_100000716715 [1,1,0,0,0,0|2,0,0]=4 7346 B10R1.10 CNCc1cncc(c1)Cl 207a_100102657272_100000088910 [1,1,0,0,0,0|2,0,0]=4 7347 B10R1.10 CNCc1cncc(c1)Cl 2230a_106832991635_100016992070 [1,1,0,0,0,0|2,0,0]=4 7348 B10R1.10 CNCc1cncc(c1)Cl 2230a_200020614424_200000210301 [1,1,0,0,0,0|2,0,0]=4 7349 B10R1.10 CNCc1cncc(c1)Cl 270004a_106832991635_100000088910 [1,1,0,0,0,0|2,0,0]=4 7350 B10R1.10 CNCc1cncc(c1)Cl 34a_100102657272_100016992070 [1,1,0,0,0,0|2,0,0]=4 7351 B10R1.10 CNCc1cncc(c1)Cl 7a_106832991635_100016992070 [1,1,0,0,0,0|2,0,0]=4 7352 B10R1.10 CNCc1cncc(c1)F 207a_100102657272_100011361476 [1,1,0,0,0,0|2,0,0]=4 7353 B10R1.10 CNCc1cncc(c1)F 2230a_100011962886_200000210301 [1,1,0,0,0,0|2,0,0]=4 7354 B10R1.10 CNCc1cncc(c1)F 2230a_106832991635_100000725299 [1,1,0,0,0,0|2,0,0]=4 7355 B10R1.10 CNCc1cncc(c1)F 270004a_106832991635_100011361476 [1,1,0,0,0,0|2,0,0]=4 7356 B10R1.10 CNCc1cncc(c1)F 34a_100011962886_200000210301 [1,1,0,0,0,0|2,0,0]=4 7357 B10R1.10 CNCc1cncc(c1)F 34a_100102657272_100000725299 [1,1,0,0,0,0|2,0,0]=4 7358 B10R1.10 CNCc1cncc(c1)F 7a_106832991635_100000725299 [1,1,0,0,0,0|2,0,0]=4 7359 B10R1.10 CNCc1cncc(c1)O 207a_100102657272_100012187055 [1,1,0,0,0,0|2,0,0]=4 7360 B10R1.10 CNCc1cncc(c1)O 270004a_106832991635_100012187055 [1,1,0,0,0,0|2,0,0]=4 7361 B10R1.10 CNCc1cncc(c1)O 271570a_203496583355_103549770560 [1,1,0,0,0,0|2,0,0]=4 7362 B10R1.10 COCc1cc(ccn1)Br 34a_100138415774_100010173614 [1,1,0,0,0,0|2,0,0]=4 7363 B10R1.10 COCc1cc(ccn1)C 34a_100011998357_200000210301 [1,1,0,0,0,0|2,0,0]=4 7364 B10R1.10 COCc1cc(ccn1)C 34a_100138415774_100000718516 [1,1,0,0,0,0|2,0,0]=4 7365 B10R1.10 COCc1cc(ccn1)Cl 34a_100000748867_200000210301 [1,1,0,0,0,0|2,0,0]=4 7366 B10R1.10 COCc1cc(ccn1)Cl 34a_100138415774_100016988179 [1,1,0,0,0,0|2,0,0]=4 7367 B10R1.10 COCc1cc(ccn1)N 34a_100000692640_200000210301 [1,1,0,0,0,0|2,0,0]=4 7368 B10R1.10 COCc1ccc[n+](c1)[O-] 34a_100000037817_200000210301 [1,1,0,0,0,0|2,0,0]=4 7369 B10R1.10 COCc1ccc[n+](c1)[O-] 7a_100000037817_200000210301 [1,1,0,0,0,0|2,0,0]=4 7370 B10R1.10 COCc1cccc(c1)Br 34a_100000687537_200000210301 [1,1,0,0,0,0|1,0,0]=3 7371 B10R1.10 COCc1cccc(c1)Br 34a_100138415774_100000698116 [1,1,0,0,0,0|1,0,0]=3 7372 B10R1.10 COCc1cccc(c1)Br 7a_100000687537_200000210301 [1,1,0,0,0,0|1,0,0]=3 7373 B10R1.10 COCc1cccc(c1)C 34a_100011217746_200000210301 [1,1,0,0,0,0|1,0,0]=3 7374 B10R1.10 COCc1cccc(c1)C 34a_100138415774_100000211840 [1,1,0,0,0,0|1,0,0]=3 7375 B10R1.10 COCc1cccc(c1)C 7a_100011217746_200000210301 [1,1,0,0,0,0|1,0,0]=3 7376 B10R1.10 COCc1cccc(c1)Cl 34a_100000241301_200000210301 [1,1,0,0,0,0|1,0,0]=3 7377 B10R1.10 COCc1cccc(c1)Cl 34a_100138415774_100000187163 [1,1,0,0,0,0|1,0,0]=3 7378 B10R1.10 COCc1cccc(c1)Cl 7a_100000241301_200000210301 [1,1,0,0,0,0|1,0,0]=3 7379 B10R1.10 COCc1cccc(c1)F 34a_100000210976_200000210301 [1,1,0,0,0,0|1,0,0]=3 7380 B10R1.10 COCc1cccc(c1)F 34a_100138415774_100000187166 [1,1,0,0,0,0|1,0,0]=3 7381 B10R1.10 COCc1cccc(c1)F 7a_100000210976_200000210301 [1,1,0,0,0,0|1,0,0]=3 7382 B10R1.10 COCc1cccc(c1)I 34a_100011215336_200000210301 [1,1,0,0,0,0|1,0,0]=3 7383 B10R1.10 COCc1cccc(c1)I 34a_100138415774_100011218688 [1,1,0,0,0,0|1,0,0]=3 7384 B10R1.10 COCc1cccc(c1)I 7a_100011215336_200000210301 [1,1,0,0,0,0|1,0,0]=3 7385 B10R1.10 COCc1cccc(c1)N 34a_100000211919_200000210301 [1,1,0,0,0,0|1,0,0]=3 7386 B10R1.10 COCc1cccc(c1)O 271570a_203496583355_100011493687 [1,1,0,0,0,0|1,0,0]=3 7387 B10R1.10 COCc1cccc(c1)O 34a_100138415774_100011660834 [1,1,0,0,0,0|1,0,0]=3 7388 B10R1.10 COCc1cccc(n1)Br 34a_100000694195_200000210301 [1,1,0,0,0,0|2,0,0]=4 7389 B10R1.10 COCc1cccc(n1)Br 34a_100138415774_100009889011 [1,1,0,0,0,0|2,0,0]=4 7390 B10R1.10 COCc1cccc(n1)C 34a_100000690600_200000210301 [1,1,0,0,0,0|2,0,0]=4 7391 B10R1.10 COCc1cccc(n1)C 34a_100138415774_100000757606 [1,1,0,0,0,0|2,0,0]=4 7392 B10R1.10 COCc1cccc(n1)Cl 34a_100011998359_200000210301 [1,1,0,0,0,0|2,0,0]=4 7393 B10R1.10 COCc1cccc(n1)Cl 34a_100138415774_100000086093 [1,1,0,0,0,0|2,0,0]=4 7394 B10R1.10 COCc1cccc(n1)F 34a_100000086748_200000210301 [1,1,0,0,0,0|2,0,0]=4 7395 B10R1.10 COCc1cccc(n1)F 34a_100138415774_100009819644 [1,1,0,0,0,0|2,0,0]=4 7396 B10R1.10 COCc1ccnc(c1)Br 34a_100009814636_200000210301 [1,1,0,0,0,0|2,0,0]=4 7397 B10R1.10 COCc1ccnc(c1)Br 34a_100138415774_100010243470 [1,1,0,0,0,0|2,0,0]=4 7398 B10R1.10 COCc1ccnc(c1)Br 7a_100009814636_200000210301 [1,1,0,0,0,0|2,0,0]=4 7399 B10R1.10 COCc1ccnc(c1)C 34a_100011998630_200000210301 [1,1,0,0,0,0|2,0,0]=4 7400 B10R1.10 COCc1ccnc(c1)C 34a_100138415774_200020672517 [1,1,0,0,0,0|2,0,0]=4 7401 B10R1.10 COCc1ccnc(c1)Cl 34a_100000748751_200000210301 [1,1,0,0,0,0|2,0,0]=4 7402 B10R1.10 COCc1ccnc(c1)Cl 34a_100138415774_100000764220 [1,1,0,0,0,0|2,0,0]=4 7403 B10R1.10 COCc1ccnc(c1)F 34a_100000082451_200000210301 [1,1,0,0,0,0|2,0,0]=4 7404 B10R1.10 COCc1cncc(c1)Br 34a_100011259137_200000210301 [1,1,0,0,0,0|2,0,0]=4 7405 B10R1.10 COCc1cncc(c1)Br 34a_100138415774_100000738771 [1,1,0,0,0,0|2,0,0]=4 7406 B10R1.10 COCc1cncc(c1)Br 7a_100011259137_200000210301 [1,1,0,0,0,0|2,0,0]=4 7407 B10R1.10 COCc1cncc(c1)C 34a_100011998709_200000210301 [1,1,0,0,0,0|2,0,0]=4 7408 B10R1.10 COCc1cncc(c1)C 34a_100138415774_100000716715 [1,1,0,0,0,0|2,0,0]=4 7409 B10R1.10 COCc1cncc(c1)C 7a_100011998709_200000210301 [1,1,0,0,0,0|2,0,0]=4 7410 B10R1.10 COCc1cncc(c1)Cl 34a_100000092867_200000210301 [1,1,0,0,0,0|2,0,0]=4 7411 B10R1.10 COCc1cncc(c1)Cl 34a_100138415774_100016992070 [1,1,0,0,0,0|2,0,0]=4 7412 B10R1.10 COCc1cncc(c1)Cl 7a_100000092867_200000210301 [1,1,0,0,0,0|2,0,0]=4 7413 B10R1.10 COCc1cncc(c1)F 34a_100011962875_200000210301 [1,1,0,0,0,0|2,0,0]=4 7414 B10R1.10 COCc1cncc(c1)F 34a_100138415774_100000725299 [1,1,0,0,0,0|2,0,0]=4 7415 B10R1.10 COCc1cncc(c1)F 7a_100011962875_200000210301 [1,1,0,0,0,0|2,0,0]=4 7416 B10R1.10 COCc1cncc(c1)N 34a_100000085308_200000210301 [1,1,0,0,0,0|2,0,0]=4 7417 B10R1.10 CSCc1cc(ccn1)Br 62a_100010173614_200000210301 [1,1,0,0,0,0|2,0,0]=4 7418 B10R1.10 CSCc1cc(ccn1)Br 62a_200000210301_100010173614 [1,1,0,0,0,0|2,0,0]=4 7419 B10R1.10 CSCc1cc(ccn1)C 62a_100000718516_200000210301 [1,1,0,0,0,0|2,0,0]=4 7420 B10R1.10 CSCc1cc(ccn1)C 62a_200000210301_100000718516 [1,1,0,0,0,0|2,0,0]=4 7421 B10R1.10 CSCc1cc(ccn1)Cl 62a_100016988179_200000210301 [1,1,0,0,0,0|2,0,0]=4 7422 B10R1.10 CSCc1cc(ccn1)Cl 62a_200000210301_100016988179 [1,1,0,0,0,0|2,0,0]=4 7423 B10R1.10 CSCc1cccc(c1)Br 62a_100000211773_200000210301 [1,1,0,0,0,0|1,0,0]=3 7424 B10R1.10 CSCc1cccc(c1)Br 62a_200000210301_100000211773 [1,1,0,0,0,0|1,0,0]=3 7425 B10R1.10 CSCc1cccc(c1)C 62a_100000211840_200000210301 [1,1,0,0,0,0|1,0,0]=3 7426 B10R1.10 CSCc1cccc(c1)C 62a_200000210301_100000211840 [1,1,0,0,0,0|1,0,0]=3 7427 B10R1.10 CSCc1cccc(c1)Cl 62a_100000187163_200000210301 [1,1,0,0,0,0|1,0,0]=3 7428 B10R1.10 CSCc1cccc(c1)Cl 62a_200000210301_100000187163 [1,1,0,0,0,0|1,0,0]=3 7429 B10R1.10 CSCc1cccc(c1)F 62a_100000230114_200000210301 [1,1,0,0,0,0|1,0,0]=3 7430 B10R1.10 CSCc1cccc(c1)F 62a_200000210301_100000230114 [1,1,0,0,0,0|1,0,0]=3 7431 B10R1.10 CSCc1cccc(c1)I 62a_100011218688_200000210301 [1,1,0,0,0,0|1,0,0]=3 7432 B10R1.10 CSCc1cccc(c1)I 62a_200000210301_100011218688 [1,1,0,0,0,0|1,0,0]=3 7433 B10R1.10 CSCc1cccc(c1)O 62a_100011660834_200000210301 [1,1,0,0,0,0|1,0,0]=3 7434 B10R1.10 CSCc1cccc(c1)O 62a_200000210301_100011660834 [1,1,0,0,0,0|1,0,0]=3 7435 B10R1.10 CSCc1cccc(n1)Br 62a_100009889011_200000210301 [1,1,0,0,0,0|2,0,0]=4 7436 B10R1.10 CSCc1cccc(n1)Br 62a_200000210301_100009889011 [1,1,0,0,0,0|2,0,0]=4 7437 B10R1.10 CSCc1cccc(n1)C 62a_100000757606_200000210301 [1,1,0,0,0,0|2,0,0]=4 7438 B10R1.10 CSCc1cccc(n1)C 62a_200000210301_100000757606 [1,1,0,0,0,0|2,0,0]=4 7439 B10R1.10 CSCc1cccc(n1)Cl 62a_100000086093_200000210301 [1,1,0,0,0,0|2,0,0]=4 7440 B10R1.10 CSCc1cccc(n1)Cl 62a_200000210301_100000086093 [1,1,0,0,0,0|2,0,0]=4 7441 B10R1.10 CSCc1cccc(n1)F 62a_100009819644_200000210301 [1,1,0,0,0,0|2,0,0]=4 7442 B10R1.10 CSCc1cccc(n1)F 62a_200000210301_100009819644 [1,1,0,0,0,0|2,0,0]=4 7443 B10R1.10 CSCc1ccnc(c1)Br 62a_100010254460_200000210301 [1,1,0,0,0,0|2,0,0]=4 7444 B10R1.10 CSCc1ccnc(c1)Br 62a_200000210301_100010243470 [1,1,0,0,0,0|2,0,0]=4 7445 B10R1.10 CSCc1ccnc(c1)C 62a_200000210301_200020672517 [1,1,0,0,0,0|2,0,0]=4 7446 B10R1.10 CSCc1ccnc(c1)C 62a_200020672517_200000210301 [1,1,0,0,0,0|2,0,0]=4 7447 B10R1.10 CSCc1ccnc(c1)Cl 62a_100000764220_200000210301 [1,1,0,0,0,0|2,0,0]=4 7448 B10R1.10 CSCc1ccnc(c1)Cl 62a_200000210301_100000764220 [1,1,0,0,0,0|2,0,0]=4 7449 B10R1.10 CSCc1cncc(c1)Br 62a_100000738771_200000210301 [1,1,0,0,0,0|2,0,0]=4 7450 B10R1.10 CSCc1cncc(c1)Br 62a_200000210301_100000738771 [1,1,0,0,0,0|2,0,0]=4 7451 B10R1.10 CSCc1cncc(c1)C 62a_100000716715_200000210301 [1,1,0,0,0,0|2,0,0]=4 7452 B10R1.10 CSCc1cncc(c1)C 62a_200000210301_100000716715 [1,1,0,0,0,0|2,0,0]=4 7453 B10R1.10 CSCc1cncc(c1)Cl 62a_100016992070_200000210301 [1,1,0,0,0,0|2,0,0]=4 7454 B10R1.10 CSCc1cncc(c1)Cl 62a_200000210301_100016992070 [1,1,0,0,0,0|2,0,0]=4 7455 B10R1.10 CSCc1cncc(c1)F 62a_100000725299_200000210301 [1,1,0,0,0,0|2,0,0]=4 7456 B10R1.10 CSCc1cncc(c1)F 62a_200000210301_100000725299 [1,1,0,0,0,0|2,0,0]=4 7457 B10R1.10 Cc1cc(ccn1)CN[13CH3] 34a_100011934566_200025704644 [1,1,0,0,0,0|2,0,0]=4 7458 B10R1.10 Cc1cc(ccn1)CO[13CH3] 34a_100011998630_200025704644 [1,1,0,0,0,0|2,0,0]=4 7459 B10R1.10 Cc1cc(ccn1)CS[13CH3] 62a_200020672517_200025704644 [1,1,0,0,0,0|2,0,0]=4 7460 B10R1.10 Cc1cc(ccn1)CS[13CH3] 62a_200025704644_200020672517 [1,1,0,0,0,0|2,0,0]=4 7461 B10R1.10 Cc1cccc(c1)CN[13CH3] 2230a_100000185548_200025704644 [1,1,0,0,0,0|1,0,0]=3 7462 B10R1.10 Cc1cccc(c1)CN[13CH3] 34a_100000185548_200025704644 [1,1,0,0,0,0|1,0,0]=3 7463 B10R1.10 Cc1cccc(c1)CO[13CH3] 34a_100011217746_200025704644 [1,1,0,0,0,0|1,0,0]=3 7464 B10R1.10 Cc1cccc(c1)CO[13CH3] 7a_100011217746_200025704644 [1,1,0,0,0,0|1,0,0]=3 7465 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_100000211840_200025704644 [1,1,0,0,0,0|1,0,0]=3 7466 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_200025704644_100000211840 [1,1,0,0,0,0|1,0,0]=3 7467 B10R1.10 Cc1cccc(c1)NCF 34a_100000188690_100015361967 [1,1,0,0,0,0|2,0,0]=4 7468 B10R1.10 Cc1cccc(c1)OCF 34a_100000210337_100015361967 [1,1,0,0,0,0|2,0,0]=4 7469 B10R1.10 Cc1cccc(c1)OCF 7a_100000210337_100015361967 [1,1,0,0,0,0|2,0,0]=4 7470 B10R1.10 Cc1cccc(c1)SCF 62a_100011215228_100015361967 [1,1,0,0,0,0|2,0,0]=4 7471 B10R1.10 Cc1cccc(c1)SCF 62a_100015361967_100011215228 [1,1,0,0,0,0|2,0,0]=4 7472 B10R1.10 Cc1cccc(n1)CN[13CH3] 34a_100000701342_200025704644 [1,1,0,0,0,0|2,0,0]=4 7473 B10R1.10 Cc1cccc(n1)CO[13CH3] 34a_100000690600_200025704644 [1,1,0,0,0,0|2,0,0]=4 7474 B10R1.10 Cc1cccc(n1)CS[13CH3] 62a_100000757606_200025704644 [1,1,0,0,0,0|2,0,0]=4 7475 B10R1.10 Cc1cccc(n1)CS[13CH3] 62a_200025704644_100000757606 [1,1,0,0,0,0|2,0,0]=4 7476 B10R1.10 Cc1ccnc(c1)CO[13CH3] 34a_100011998357_200025704644 [1,1,0,0,0,0|2,0,0]=4 7477 B10R1.10 Cc1ccnc(c1)CS[13CH3] 62a_100000718516_200025704644 [1,1,0,0,0,0|2,0,0]=4 7478 B10R1.10 Cc1ccnc(c1)CS[13CH3] 62a_200025704644_100000718516 [1,1,0,0,0,0|2,0,0]=4 7479 B10R1.10 Cc1cncc(c1)CN[13CH3] 2230a_100000692839_200025704644 [1,1,0,0,0,0|2,0,0]=4 7480 B10R1.10 Cc1cncc(c1)CN[13CH3] 34a_100000692839_200025704644 [1,1,0,0,0,0|2,0,0]=4 7481 B10R1.10 Cc1cncc(c1)CO[13CH3] 34a_100011998709_200025704644 [1,1,0,0,0,0|2,0,0]=4 7482 B10R1.10 Cc1cncc(c1)CO[13CH3] 7a_100011998709_200025704644 [1,1,0,0,0,0|2,0,0]=4 7483 B10R1.10 Cc1cncc(c1)CS[13CH3] 62a_100000716715_200025704644 [1,1,0,0,0,0|2,0,0]=4 7484 B10R1.10 Cc1cncc(c1)CS[13CH3] 62a_200025704644_100000716715 [1,1,0,0,0,0|2,0,0]=4 7485 B10R1.10 FCNc1cccc(c1)Br 34a_100000210019_100015361967 [1,1,0,0,0,0|2,0,0]=4 7486 B10R1.10 FCNc1cccc(c1)Cl 34a_100000185859_100015361967 [1,1,0,0,0,0|2,0,0]=4 7487 B10R1.10 FCNc1cccc(c1)F 34a_100000210047_100015361967 [1,1,0,0,0,0|2,0,0]=4 7488 B10R1.10 FCNc1cccc(c1)I 34a_100000211102_100015361967 [1,1,0,0,0,0|2,0,0]=4 7489 B10R1.10 FCOc1cccc(c1)Br 34a_100000210342_100015361967 [1,1,0,0,0,0|2,0,0]=4 7490 B10R1.10 FCOc1cccc(c1)Br 7a_100000210342_100015361967 [1,1,0,0,0,0|2,0,0]=4 7491 B10R1.10 FCOc1cccc(c1)Cl 34a_100000210295_100015361967 [1,1,0,0,0,0|2,0,0]=4 7492 B10R1.10 FCOc1cccc(c1)Cl 7a_100000210295_100015361967 [1,1,0,0,0,0|2,0,0]=4 7493 B10R1.10 FCOc1cccc(c1)F 34a_100000210426_100015361967 [1,1,0,0,0,0|2,0,0]=4 7494 B10R1.10 FCOc1cccc(c1)F 7a_100000210426_100015361967 [1,1,0,0,0,0|2,0,0]=4 7495 B10R1.10 FCOc1cccc(c1)I 34a_100000211634_100015361967 [1,1,0,0,0,0|2,0,0]=4 7496 B10R1.10 FCOc1cccc(c1)I 7a_100000211634_100015361967 [1,1,0,0,0,0|2,0,0]=4 7497 B10R1.10 FCSc1cccc(c1)Br 62a_100000691529_100015361967 [1,1,0,0,0,0|2,0,0]=4 7498 B10R1.10 FCSc1cccc(c1)Br 62a_100015361967_100000691529 [1,1,0,0,0,0|2,0,0]=4 7499 B10R1.10 FCSc1cccc(c1)Cl 62a_100000699651_100015361967 [1,1,0,0,0,0|2,0,0]=4 7500 B10R1.10 FCSc1cccc(c1)Cl 62a_100015361967_100000699651 [1,1,0,0,0,0|2,0,0]=4 7501 B10R1.10 FCSc1cccc(c1)F 62a_100000685547_100015361967 [1,1,0,0,0,0|2,0,0]=4 7502 B10R1.10 FCSc1cccc(c1)F 62a_100015361967_100000685547 [1,1,0,0,0,0|2,0,0]=4 7503 B10R1.10 FCSc1cccc(c1)[S] 62a_100015361967_114929384022 [1,1,0,0,0,0|2,0,0]=4 7504 B10R1.10 FCSc1cccc(c1)[S] 62a_114929384022_100015361967 [1,1,0,0,0,0|2,0,0]=4 7505 B10R1.10 N#CCc1cccc(c1)O 271570a_203496583355_100000034040 [1,1,0,0,0,0|1,0,1]=4 7506 B10R1.10 NCCc1cccc(c1)O 271570a_203496583355_100011207229 [1,1,0,0,0,0|1,0,0]=3 7507 B10R1.10 NNCc1cccc(c1)O 271570a_203496583355_100000686200 [1,1,0,0,0,0|2,0,0]=4 7508 B10R1.10 Nc1cccc(c1)OCF 34a_100000210217_100015361967 [1,1,0,0,0,0|2,0,0]=4 7509 B10R1.10 Nc1cccc(c1)SCF 62a_100000210019_100015361967 [1,1,0,0,0,0|2,0,0]=4 7510 B10R1.10 Nc1cccc(c1)SCF 62a_100015361967_100000210019 [1,1,0,0,0,0|2,0,0]=4 7511 B10R1.10 O=CCc1cccc(c1)O 271570a_203496583355_200000698211 [1,1,0,0,0,0|1,0,1]=4 7512 B10R1.10 OCCc1cccc(c1)O 271570a_203496583355_100011217444 [1,1,0,0,0,0|1,0,0]=3 7513 B10R1.10 OCCc1cccc(n1)O 271570a_203496583355_100010221043 [1,1,0,0,0,0|2,0,0]=4 7514 B10R1.10 Oc1cccc(c1)NCF 34a_100000210217_100015361967 [1,1,0,0,0,0|2,0,0]=4 7515 B10R1.10 Oc1cccc(c1)SCF 62a_100015361967_100000211634 [1,1,0,0,0,0|2,0,0]=4 7516 B10R1.10 [13CH3]NCc1cccc(=O)[nH]1 2230a_100000696482_200025704644 [1,1,0,0,0,0|2,0,0]=4 7517 B10R1.10 [13CH3]NCc1cccc(c1)Br 2230a_100000174977_200025704644 [1,1,0,0,0,0|1,0,0]=3 7518 B10R1.10 [13CH3]NCc1cccc(c1)Br 34a_100000174977_200025704644 [1,1,0,0,0,0|1,0,0]=3 7519 B10R1.10 [13CH3]NCc1cccc(c1)Cl 2230a_100000174878_200025704644 [1,1,0,0,0,0|1,0,0]=3 7520 B10R1.10 [13CH3]NCc1cccc(c1)Cl 34a_100000174878_200025704644 [1,1,0,0,0,0|1,0,0]=3 7521 B10R1.10 [13CH3]NCc1cccc(c1)F 2230a_100000174948_200025704644 [1,1,0,0,0,0|1,0,0]=3 7522 B10R1.10 [13CH3]NCc1cccc(c1)F 34a_100000174948_200025704644 [1,1,0,0,0,0|1,0,0]=3 7523 B10R1.10 [13CH3]NCc1cccc(c1)I 2230a_100000106179_200025704644 [1,1,0,0,0,0|1,0,0]=3 7524 B10R1.10 [13CH3]NCc1cccc(c1)I 34a_100000106179_200025704644 [1,1,0,0,0,0|1,0,0]=3 7525 B10R1.10 [13CH3]NCc1cccc(c1)O 2230a_100000743036_200025704644 [1,1,0,0,0,0|1,0,0]=3 7526 B10R1.10 [13CH3]NCc1cccc(c1)O 34a_100000743036_200025704644 [1,1,0,0,0,0|1,0,0]=3 7527 B10R1.10 [13CH3]NCc1cccc(n1)Br 2230a_100016987751_200025704644 [1,1,0,0,0,0|2,0,0]=4 7528 B10R1.10 [13CH3]NCc1cccc(n1)Cl 2230a_100016990191_200025704644 [1,1,0,0,0,0|2,0,0]=4 7529 B10R1.10 [13CH3]NCc1cccc(n1)F 2230a_100015188798_200025704644 [1,1,0,0,0,0|2,0,0]=4 7530 B10R1.10 [13CH3]NCc1cccc(n1)F 34a_100015188798_200025704644 [1,1,0,0,0,0|2,0,0]=4 7531 B10R1.10 [13CH3]NCc1ccnc(c1)Br 2230a_100025757509_200025704644 [1,1,0,0,0,0|2,0,0]=4 7532 B10R1.10 [13CH3]NCc1ccnc(c1)Br 34a_100025757509_200025704644 [1,1,0,0,0,0|2,0,0]=4 7533 B10R1.10 [13CH3]NCc1ccnc(c1)Cl 2230a_100015205668_200025704644 [1,1,0,0,0,0|2,0,0]=4 7534 B10R1.10 [13CH3]NCc1ccnc(c1)Cl 34a_100015205668_200025704644 [1,1,0,0,0,0|2,0,0]=4 7535 B10R1.10 [13CH3]NCc1ccnc(c1)F 2230a_100015188774_200025704644 [1,1,0,0,0,0|2,0,0]=4 7536 B10R1.10 [13CH3]NCc1ccnc(c1)F 34a_100015188774_200025704644 [1,1,0,0,0,0|2,0,0]=4 7537 B10R1.10 [13CH3]NCc1cncc(c1)Cl 2230a_200020614424_200025704644 [1,1,0,0,0,0|2,0,0]=4 7538 B10R1.10 [13CH3]NCc1cncc(c1)F 2230a_100011962886_200025704644 [1,1,0,0,0,0|2,0,0]=4 7539 B10R1.10 [13CH3]NCc1cncc(c1)F 34a_100011962886_200025704644 [1,1,0,0,0,0|2,0,0]=4 7540 B10R1.10 [13CH3]OCc1cc(ccn1)Cl 34a_100000748867_200025704644 [1,1,0,0,0,0|2,0,0]=4 7541 B10R1.10 [13CH3]OCc1cc(ccn1)N 34a_100000692640_200025704644 [1,1,0,0,0,0|2,0,0]=4 7542 B10R1.10 [13CH3]OCc1ccc[n+](c1)[O-] 34a_100000037817_200025704644 [1,1,0,0,0,0|2,0,0]=4 7543 B10R1.10 [13CH3]OCc1ccc[n+](c1)[O-] 7a_100000037817_200025704644 [1,1,0,0,0,0|2,0,0]=4 7544 B10R1.10 [13CH3]OCc1cccc(c1)Br 34a_100000687537_200025704644 [1,1,0,0,0,0|1,0,0]=3 7545 B10R1.10 [13CH3]OCc1cccc(c1)Br 7a_100000687537_200025704644 [1,1,0,0,0,0|1,0,0]=3 7546 B10R1.10 [13CH3]OCc1cccc(c1)Cl 34a_100000241301_200025704644 [1,1,0,0,0,0|1,0,0]=3 7547 B10R1.10 [13CH3]OCc1cccc(c1)Cl 7a_100000241301_200025704644 [1,1,0,0,0,0|1,0,0]=3 7548 B10R1.10 [13CH3]OCc1cccc(c1)F 34a_100000210976_200025704644 [1,1,0,0,0,0|1,0,0]=3 7549 B10R1.10 [13CH3]OCc1cccc(c1)F 7a_100000210976_200025704644 [1,1,0,0,0,0|1,0,0]=3 7550 B10R1.10 [13CH3]OCc1cccc(c1)I 34a_100011215336_200025704644 [1,1,0,0,0,0|1,0,0]=3 7551 B10R1.10 [13CH3]OCc1cccc(c1)I 7a_100011215336_200025704644 [1,1,0,0,0,0|1,0,0]=3 7552 B10R1.10 [13CH3]OCc1cccc(c1)N 34a_100000211919_200025704644 [1,1,0,0,0,0|1,0,0]=3 7553 B10R1.10 [13CH3]OCc1cccc(n1)Br 34a_100000694195_200025704644 [1,1,0,0,0,0|2,0,0]=4 7554 B10R1.10 [13CH3]OCc1cccc(n1)Cl 34a_100011998359_200025704644 [1,1,0,0,0,0|2,0,0]=4 7555 B10R1.10 [13CH3]OCc1cccc(n1)F 34a_100000086748_200025704644 [1,1,0,0,0,0|2,0,0]=4 7556 B10R1.10 [13CH3]OCc1ccnc(c1)Br 34a_100009814636_200025704644 [1,1,0,0,0,0|2,0,0]=4 7557 B10R1.10 [13CH3]OCc1ccnc(c1)Br 7a_100009814636_200025704644 [1,1,0,0,0,0|2,0,0]=4 7558 B10R1.10 [13CH3]OCc1ccnc(c1)Cl 34a_100000748751_200025704644 [1,1,0,0,0,0|2,0,0]=4 7559 B10R1.10 [13CH3]OCc1ccnc(c1)F 34a_100000082451_200025704644 [1,1,0,0,0,0|2,0,0]=4 7560 B10R1.10 [13CH3]OCc1cncc(c1)Br 34a_100011259137_200025704644 [1,1,0,0,0,0|2,0,0]=4 7561 B10R1.10 [13CH3]OCc1cncc(c1)Br 7a_100011259137_200025704644 [1,1,0,0,0,0|2,0,0]=4 7562 B10R1.10 [13CH3]OCc1cncc(c1)Cl 34a_100000092867_200025704644 [1,1,0,0,0,0|2,0,0]=4 7563 B10R1.10 [13CH3]OCc1cncc(c1)Cl 7a_100000092867_200025704644 [1,1,0,0,0,0|2,0,0]=4 7564 B10R1.10 [13CH3]OCc1cncc(c1)F 34a_100011962875_200025704644 [1,1,0,0,0,0|2,0,0]=4 7565 B10R1.10 [13CH3]OCc1cncc(c1)F 7a_100011962875_200025704644 [1,1,0,0,0,0|2,0,0]=4 7566 B10R1.10 [13CH3]OCc1cncc(c1)N 34a_100000085308_200025704644 [1,1,0,0,0,0|2,0,0]=4 7567 B10R1.10 [13CH3]SCc1cc(ccn1)Br 62a_100010173614_200025704644 [1,1,0,0,0,0|2,0,0]=4 7568 B10R1.10 [13CH3]SCc1cc(ccn1)Br 62a_200025704644_100010173614 [1,1,0,0,0,0|2,0,0]=4 7569 B10R1.10 [13CH3]SCc1cc(ccn1)Cl 62a_100016988179_200025704644 [1,1,0,0,0,0|2,0,0]=4 7570 B10R1.10 [13CH3]SCc1cc(ccn1)Cl 62a_200025704644_100016988179 [1,1,0,0,0,0|2,0,0]=4 7571 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_100000211773_200025704644 [1,1,0,0,0,0|1,0,0]=3 7572 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_200025704644_100000211773 [1,1,0,0,0,0|1,0,0]=3 7573 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_100000187163_200025704644 [1,1,0,0,0,0|1,0,0]=3 7574 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_200025704644_100000187163 [1,1,0,0,0,0|1,0,0]=3 7575 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_100000230114_200025704644 [1,1,0,0,0,0|1,0,0]=3 7576 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_200025704644_100000230114 [1,1,0,0,0,0|1,0,0]=3 7577 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_100011218688_200025704644 [1,1,0,0,0,0|1,0,0]=3 7578 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_200025704644_100011218688 [1,1,0,0,0,0|1,0,0]=3 7579 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_100011660834_200025704644 [1,1,0,0,0,0|1,0,0]=3 7580 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_200025704644_100011660834 [1,1,0,0,0,0|1,0,0]=3 7581 B10R1.10 [13CH3]SCc1cccc(n1)Br 62a_100009889011_200025704644 [1,1,0,0,0,0|2,0,0]=4 7582 B10R1.10 [13CH3]SCc1cccc(n1)Br 62a_200025704644_100009889011 [1,1,0,0,0,0|2,0,0]=4 7583 B10R1.10 [13CH3]SCc1cccc(n1)Cl 62a_100000086093_200025704644 [1,1,0,0,0,0|2,0,0]=4 7584 B10R1.10 [13CH3]SCc1cccc(n1)Cl 62a_200025704644_100000086093 [1,1,0,0,0,0|2,0,0]=4 7585 B10R1.10 [13CH3]SCc1cccc(n1)F 62a_100009819644_200025704644 [1,1,0,0,0,0|2,0,0]=4 7586 B10R1.10 [13CH3]SCc1cccc(n1)F 62a_200025704644_100009819644 [1,1,0,0,0,0|2,0,0]=4 7587 B10R1.10 [13CH3]SCc1ccnc(c1)Br 62a_100010254460_200025704644 [1,1,0,0,0,0|2,0,0]=4 7588 B10R1.10 [13CH3]SCc1ccnc(c1)Br 62a_200025704644_100010243470 [1,1,0,0,0,0|2,0,0]=4 7589 B10R1.10 [13CH3]SCc1ccnc(c1)Cl 62a_100000764220_200025704644 [1,1,0,0,0,0|2,0,0]=4 7590 B10R1.10 [13CH3]SCc1ccnc(c1)Cl 62a_200025704644_100000764220 [1,1,0,0,0,0|2,0,0]=4 7591 B10R1.10 [13CH3]SCc1cncc(c1)Br 62a_100000738771_200025704644 [1,1,0,0,0,0|2,0,0]=4 7592 B10R1.10 [13CH3]SCc1cncc(c1)Br 62a_200025704644_100000738771 [1,1,0,0,0,0|2,0,0]=4 7593 B10R1.10 [13CH3]SCc1cncc(c1)Cl 62a_100016992070_200025704644 [1,1,0,0,0,0|2,0,0]=4 7594 B10R1.10 [13CH3]SCc1cncc(c1)Cl 62a_200025704644_100016992070 [1,1,0,0,0,0|2,0,0]=4 7595 B10R1.10 [13CH3]SCc1cncc(c1)F 62a_100000725299_200025704644 [1,1,0,0,0,0|2,0,0]=4 7596 B10R1.10 [13CH3]SCc1cncc(c1)F 62a_200025704644_100000725299 [1,1,0,0,0,0|2,0,0]=4 7597 B10R1.15 CC(N[13CH3])c1ccccn1 2230a_100000181244_200025704644 [1,1,0,0,0,0|2,0,0]=4 7598 B10R1.15 CC(N[13CH3])c1cccnc1 2230a_100000195435_200025704644 [1,1,0,0,0,0|2,0,0]=4 7599 B10R1.15 CC(N[13CH3])c1ccncc1 2230a_100000181269_200025704644 [1,1,0,0,0,0|2,0,0]=4 7600 B10R1.15 CC(S[13CH3])c1ccccc1 62a_100000230085_200025704644 [1,1,0,0,0,0|1,0,0]=3 7601 B10R1.15 CC(S[13CH3])c1ccccc1 62a_200025704644_100000230085 [1,1,0,0,0,0|1,0,0]=3 7602 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [1,1,0,0,0,0|0,0,1]=3 7603 B10R1.15 CCN(C)c1ccccc1 2230a_100000210012_100000210202 [1,1,0,0,0,0|1,0,0]=3 7604 B10R1.15 CCN(C)c1ccccc1 2230a_100000210013_200000210301 [1,1,0,0,0,0|1,0,0]=3 7605 B10R1.15 CCN(C)c1ccccc1 269982a_100000210012_100000204670 [1,1,0,0,0,0|1,0,0]=3 7606 B10R1.15 CCN(C)c1ccccc1 269982a_100000210013_200000210301 [1,1,0,0,0,0|1,0,0]=3 7607 B10R1.15 CCN(C)c1ccccc1 34a_100000210012_100000210202 [1,1,0,0,0,0|1,0,0]=3 7608 B10R1.15 CCN(C)c1ccccc1 34a_100000210013_200000210301 [1,1,0,0,0,0|1,0,0]=3 7609 B10R1.15 CCN([13CH3])c1ccccc1 2230a_100000210013_200025704644 [1,1,0,0,0,0|1,0,0]=3 7610 B10R1.15 CCN([13CH3])c1ccccc1 269982a_100000210013_200025704644 [1,1,0,0,0,0|1,0,0]=3 7611 B10R1.15 CCN([13CH3])c1ccccc1 34a_100000210013_200025704644 [1,1,0,0,0,0|1,0,0]=3 7612 B10R1.15 CN(CF)c1ccccc1 269982a_100000210012_100015361967 [1,1,0,0,0,0|2,0,0]=4 7613 B10R1.15 CN(CF)c1ccccc1 34a_100000210012_100015361967 [1,1,0,0,0,0|2,0,0]=4 7614 B10R1.15 CNC(=O)c1ccccc1 11a_106832991635_100000185807 [1,1,0,0,0,0|1,0,1]=4 7615 B10R1.15 CNC(=O)c1ccccc1 1626a_100102657272_100000185807 [1,1,0,0,0,0|1,0,1]=4 7616 B10R1.15 CNC(=O)c1ccccc1 240690a_100102657272_100000185807 [1,1,0,0,0,0|1,0,1]=4 7617 B10R1.15 CNC(=O)c1ccccc1 527a_100102657272_100000185807 [1,1,0,0,0,0|1,0,1]=4 7618 B10R1.15 CNC(C)c1ccccc1 2230a_106832991635_100000230085 [1,1,0,0,0,0|1,0,0]=3 7619 B10R1.15 CNC(C)c1ccccc1 269862a_106832991636_100000185851 [1,1,0,0,0,0|1,0,0]=3 7620 B10R1.15 CNC(C)c1ccccc1 34a_100102657272_100000211855 [1,1,0,0,0,0|1,0,0]=3 7621 B10R1.15 CNC(C)c1ccccc1 7a_106832991635_100000230085 [1,1,0,0,0,0|1,0,0]=3 7622 B10R1.15 CNC(C)c1ccccn1 2230a_100000181244_200000210301 [1,1,0,0,0,0|2,0,0]=4 7623 B10R1.15 CNC(C)c1ccccn1 269862a_106832991636_100000210467 [1,1,0,0,0,0|2,0,0]=4 7624 B10R1.15 CNC(C)c1cccnc1 2230a_100000195435_200000210301 [1,1,0,0,0,0|2,0,0]=4 7625 B10R1.15 CNC(C)c1cccnc1 269862a_106832991636_100000210468 [1,1,0,0,0,0|2,0,0]=4 7626 B10R1.15 CNC(C)c1ccncc1 2230a_100000181269_200000210301 [1,1,0,0,0,0|2,0,0]=4 7627 B10R1.15 CNC(C)c1ccncc1 269862a_106832991636_100000185792 [1,1,0,0,0,0|2,0,0]=4 7628 B10R1.15 CN[C@H](C)c1ccccc1 2230a_100000751104_200000210301 [1,1,0,0,0,0|1,0,0]=3 7629 B10R1.15 COC(C)c1ccccc1 34a_100138415774_100000211855 [1,1,0,0,0,0|1,0,0]=3 7630 B10R1.15 CO[C@H](C)c1ccccc1 34a_100000761318_200000210301 [1,1,0,0,0,0|1,0,0]=3 7631 B10R1.15 CO[C@H](C)c1ccccc1 7a_100000761318_200000210301 [1,1,0,0,0,0|1,0,0]=3 7632 B10R1.15 CSC(C)c1ccccc1 62a_100000230085_200000210301 [1,1,0,0,0,0|1,0,0]=3 7633 B10R1.15 CSC(C)c1ccccc1 62a_200000210301_100000230085 [1,1,0,0,0,0|1,0,0]=3 7634 B10R1.15 C[C@@H](N[13CH3])c1ccccc1 2230a_100000751104_200025704644 [1,1,0,0,0,0|1,0,0]=3 7635 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 34a_100000761318_200025704644 [1,1,0,0,0,0|1,0,0]=3 7636 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 7a_100000761318_200025704644 [1,1,0,0,0,0|1,0,0]=3 7637 B10R1.15 O=C(CF)c1ccccc1 1458a_100000185807_100015361967 [1,1,0,0,0,0|1,0,1]=4 7638 B10R1.17 C#CCNc1ccccc1 34a_100000106764_100000184674 [1,1,0,0,0,0|0,0,2]=4 7639 B10R1.17 C#CCOc1ccccc1 34a_100000210340_100000184674 [1,1,0,0,0,0|0,0,2]=4 7640 B10R1.17 C#CCOc1ccccc1 7a_100000210340_100000038162 [1,1,0,0,0,0|0,0,2]=4 7641 B10R1.17 C#CCSc1ccccc1 62a_100000038162_100000041952 [1,1,0,0,0,0|0,0,2]=4 7642 B10R1.17 C=CCNc1ccccc1 34a_100000106764_100015514636 [1,1,0,0,0,0|0,0,2]=4 7643 B10R1.17 C=CCOc1ccccc1 34a_100000210340_100015514636 [1,1,0,0,0,0|0,0,2]=4 7644 B10R1.17 C=CCOc1ccccc1 7a_100000210340_100015514636 [1,1,0,0,0,0|0,0,2]=4 7645 B10R1.17 C=CCSc1ccccc1 62a_100000210623_100000041952 [1,1,0,0,0,0|0,0,2]=4 7646 B10R1.17 C=CCSc1ccccc1 62a_100000719477_100000210623 [1,1,0,0,0,0|0,0,2]=4 7647 B10R1.17 CC=NNc1ccccc1 4a_100015195140_200000210099 [1,1,0,0,0,0|1,0,1]=4 7648 B10R1.17 CCCCc1ccccc1 271570a_100020621405_100000210277 [1,1,0,0,0,0|0,0,0]=2 7649 B10R1.17 CCCCc1ccccn1 271570a_100020621405_100011216584 [1,1,0,0,0,0|1,0,0]=3 7650 B10R1.17 CCCCc1cccnc1 271570a_100020621405_100000752921 [1,1,0,0,0,0|1,0,0]=3 7651 B10R1.17 CCCCc1cccnn1 271570a_100020621405_100016991348 [1,1,0,0,0,0|2,0,0]=4 7652 B10R1.17 CCCCc1ccncc1 271570a_100020621405_100000035832 [1,1,0,0,0,0|1,0,0]=3 7653 B10R1.17 CCCCc1ccncn1 271570a_100020621405_100000703185 [1,1,0,0,0,0|2,0,0]=4 7654 B10R1.17 CCCCc1ccnnc1 271570a_100020621405_100000732662 [1,1,0,0,0,0|2,0,0]=4 7655 B10R1.17 CCCCc1cnccn1 271570a_100020621405_100000758340 [1,1,0,0,0,0|2,0,0]=4 7656 B10R1.17 CCCCc1cncnc1 271570a_100020621405_100011206942 [1,1,0,0,0,0|2,0,0]=4 7657 B10R1.17 CCCCc1ncccn1 271570a_100020621405_100000211032 [1,1,0,0,0,0|2,0,0]=4 7658 B10R1.17 CCCNc1ccccc1 34a_100000106764_100000210303 [1,1,0,0,0,0|0,0,0]=2 7659 B10R1.17 CCCOc1ccccc1 34a_100000210340_100000210303 [1,1,0,0,0,0|0,0,0]=2 7660 B10R1.17 CCCOc1ccccc1 7a_100000210340_100000210303 [1,1,0,0,0,0|0,0,0]=2 7661 B10R1.17 CCCOc1cccnc1 34a_100000210849_100000210303 [1,1,0,0,0,0|1,0,0]=3 7662 B10R1.17 CCCOc1cccnc1 7a_100000210849_100000210303 [1,1,0,0,0,0|1,0,0]=3 7663 B10R1.17 CCCOc1ccncc1 34a_100000212176_100000210303 [1,1,0,0,0,0|1,0,0]=3 7664 B10R1.17 CCCOc1ccnnc1 34a_100015204005_100000210303 [1,1,0,0,0,0|2,0,0]=4 7665 B10R1.17 CCCOc1cncnc1 7a_100000754086_100000210303 [1,1,0,0,0,0|2,0,0]=4 7666 B10R1.17 CCCSc1ccccc1 62a_100000210303_100000041952 [1,1,0,0,0,0|0,0,0]=2 7667 B10R1.17 CCCSc1ccccc1 62a_100000719477_100000210303 [1,1,0,0,0,0|0,0,0]=2 7668 B10R1.17 CCCSc1ccccn1 62a_100000210303_100011216584 [1,1,0,0,0,0|1,0,0]=3 7669 B10R1.17 CCCSc1ccccn1 62a_100011216584_100000210303 [1,1,0,0,0,0|1,0,0]=3 7670 B10R1.17 CCCSc1cccnc1 62a_100000210063_100000210303 [1,1,0,0,0,0|1,0,0]=3 7671 B10R1.17 CCCSc1cccnc1 62a_100000210303_100000210063 [1,1,0,0,0,0|1,0,0]=3 7672 B10R1.17 CCCSc1cccnn1 62a_100000210303_100016991348 [1,1,0,0,0,0|2,0,0]=4 7673 B10R1.17 CCCSc1cccnn1 62a_100016991348_100000210303 [1,1,0,0,0,0|2,0,0]=4 7674 B10R1.17 CCCSc1ccncc1 62a_100000210303_100000728582 [1,1,0,0,0,0|1,0,0]=3 7675 B10R1.17 CCCSc1ccncc1 62a_100000728582_100000210303 [1,1,0,0,0,0|1,0,0]=3 7676 B10R1.17 CCCSc1ccncn1 62a_100000210303_100000703185 [1,1,0,0,0,0|2,0,0]=4 7677 B10R1.17 CCCSc1ccncn1 62a_100000703185_100000210303 [1,1,0,0,0,0|2,0,0]=4 7678 B10R1.17 CCCSc1ccnnc1 62a_100000210303_100000732662 [1,1,0,0,0,0|2,0,0]=4 7679 B10R1.17 CCCSc1ccnnc1 62a_100000732662_100000210303 [1,1,0,0,0,0|2,0,0]=4 7680 B10R1.17 CCCSc1cnccn1 62a_100000210303_100000211759 [1,1,0,0,0,0|2,0,0]=4 7681 B10R1.17 CCCSc1cnccn1 62a_100000211759_100000210303 [1,1,0,0,0,0|2,0,0]=4 7682 B10R1.17 CCCSc1cncnc1 62a_100000210303_100011206942 [1,1,0,0,0,0|2,0,0]=4 7683 B10R1.17 CCCSc1cncnc1 62a_100011206942_100000210303 [1,1,0,0,0,0|2,0,0]=4 7684 B10R1.17 CCCSc1ncccn1 62a_100000210303_100000211032 [1,1,0,0,0,0|2,0,0]=4 7685 B10R1.17 CCCSc1ncccn1 62a_100000211032_100000210303 [1,1,0,0,0,0|2,0,0]=4 7686 B10R1.17 CCNCc1ccccc1 207a_100015525214_100015611070 [1,1,0,0,0,0|0,0,0]=2 7687 B10R1.17 CCNCc1ccccc1 2230a_100015324214_100000210202 [1,1,0,0,0,0|0,0,0]=2 7688 B10R1.17 CCNCc1ccccc1 2230a_100015525214_100015291786 [1,1,0,0,0,0|0,0,0]=2 7689 B10R1.17 CCNCc1ccccc1 270004a_100015525214_100015611070 [1,1,0,0,0,0|0,0,0]=2 7690 B10R1.17 CCNCc1ccccc1 34a_100015324214_100000210202 [1,1,0,0,0,0|0,0,0]=2 7691 B10R1.17 CCNCc1ccccn1 207a_100015525214_100000209966 [1,1,0,0,0,0|1,0,0]=3 7692 B10R1.17 CCNCc1ccccn1 2230a_100015525214_100000721315 [1,1,0,0,0,0|1,0,0]=3 7693 B10R1.17 CCNCc1ccccn1 270004a_100015525214_100000209966 [1,1,0,0,0,0|1,0,0]=3 7694 B10R1.17 CCNCc1cccnc1 207a_100015525214_100000209961 [1,1,0,0,0,0|1,0,0]=3 7695 B10R1.17 CCNCc1cccnc1 2230a_100015525214_100000741622 [1,1,0,0,0,0|1,0,0]=3 7696 B10R1.17 CCNCc1cccnc1 270004a_100015525214_100000209961 [1,1,0,0,0,0|1,0,0]=3 7697 B10R1.17 CCNCc1cccnn1 2230a_100015525214_100016990269 [1,1,0,0,0,0|2,0,0]=4 7698 B10R1.17 CCNCc1cccnn1 2230a_100159270163_100000210202 [1,1,0,0,0,0|2,0,0]=4 7699 B10R1.17 CCNCc1ccncc1 207a_100015525214_100000186114 [1,1,0,0,0,0|1,0,0]=3 7700 B10R1.17 CCNCc1ccncc1 2230a_100015525214_100015193705 [1,1,0,0,0,0|1,0,0]=3 7701 B10R1.17 CCNCc1ccnnc1 270004a_100015525214_100011934578 [1,1,0,0,0,0|2,0,0]=4 7702 B10R1.17 CCNCc1cnccn1 2230a_100015525214_100016995436 [1,1,0,0,0,0|2,0,0]=4 7703 B10R1.17 CCNCc1cnccn1 270004a_100015525214_100000749867 [1,1,0,0,0,0|2,0,0]=4 7704 B10R1.17 CCNCc1cncnc1 2230a_100011243677_100000210202 [1,1,0,0,0,0|2,0,0]=4 7705 B10R1.17 CCNCc1cncnc1 2230a_100015525214_100015196519 [1,1,0,0,0,0|2,0,0]=4 7706 B10R1.17 CCNCc1cncnc1 270004a_100015525214_100000749868 [1,1,0,0,0,0|2,0,0]=4 7707 B10R1.17 CCNCc1ncccn1 2230a_100015525214_100000703007 [1,1,0,0,0,0|2,0,0]=4 7708 B10R1.17 CCNCc1ncccn1 270004a_100015525214_100011532527 [1,1,0,0,0,0|2,0,0]=4 7709 B10R1.17 CCOCc1ccccc1 34a_100000210790_100000210202 [1,1,0,0,0,0|0,0,0]=2 7710 B10R1.17 CCOCc1ccccc1 34a_100121572206_100015291786 [1,1,0,0,0,0|0,0,0]=2 7711 B10R1.17 CCOCc1ccccc1 7a_100000210790_100000210202 [1,1,0,0,0,0|0,0,0]=2 7712 B10R1.17 CCOCc1ccccn1 34a_100121572206_100000721315 [1,1,0,0,0,0|1,0,0]=3 7713 B10R1.17 CCOCc1cccnc1 34a_100121572206_100000733263 [1,1,0,0,0,0|1,0,0]=3 7714 B10R1.17 CCOCc1cccnn1 34a_100121572206_100016990269 [1,1,0,0,0,0|2,0,0]=4 7715 B10R1.17 CCOCc1cnccn1 34a_100121572206_100016995436 [1,1,0,0,0,0|2,0,0]=4 7716 B10R1.17 CCOCc1cncnc1 34a_100121572206_100015196519 [1,1,0,0,0,0|2,0,0]=4 7717 B10R1.17 CCOCc1ncccn1 34a_100121572206_100000703007 [1,1,0,0,0,0|2,0,0]=4 7718 B10R1.17 CCSCc1ccccc1 62a_100000210202_100015291786 [1,1,0,0,0,0|0,0,0]=2 7719 B10R1.17 CCSCc1ccccc1 62a_100000211182_100000210202 [1,1,0,0,0,0|0,0,0]=2 7720 B10R1.17 CCSCc1ccccn1 62a_100000210202_100000721315 [1,1,0,0,0,0|1,0,0]=3 7721 B10R1.17 CCSCc1ccccn1 62a_100000721315_100000210202 [1,1,0,0,0,0|1,0,0]=3 7722 B10R1.17 CCSCc1cccnc1 62a_100000210202_100000741622 [1,1,0,0,0,0|1,0,0]=3 7723 B10R1.17 CCSCc1cccnc1 62a_100000741622_100000210202 [1,1,0,0,0,0|1,0,0]=3 7724 B10R1.17 CCSCc1cccnn1 62a_100000210202_100016990269 [1,1,0,0,0,0|2,0,0]=4 7725 B10R1.17 CCSCc1cccnn1 62a_100016990269_100000210202 [1,1,0,0,0,0|2,0,0]=4 7726 B10R1.17 CCSCc1ccncc1 62a_100000210202_100015193705 [1,1,0,0,0,0|1,0,0]=3 7727 B10R1.17 CCSCc1ccncc1 62a_100015193705_100000210202 [1,1,0,0,0,0|1,0,0]=3 7728 B10R1.17 CCSCc1cnccn1 62a_100000210202_100016995436 [1,1,0,0,0,0|2,0,0]=4 7729 B10R1.17 CCSCc1cnccn1 62a_100016995436_100000210202 [1,1,0,0,0,0|2,0,0]=4 7730 B10R1.17 CCSCc1cncnc1 62a_100000210202_100015196519 [1,1,0,0,0,0|2,0,0]=4 7731 B10R1.17 CCSCc1cncnc1 62a_100015196519_100000210202 [1,1,0,0,0,0|2,0,0]=4 7732 B10R1.17 CCSCc1ncccn1 62a_100000210202_100000703007 [1,1,0,0,0,0|2,0,0]=4 7733 B10R1.17 CCSCc1ncccn1 62a_100000703007_100000210202 [1,1,0,0,0,0|2,0,0]=4 7734 B10R1.17 CNCCc1ccccc1 2230a_100000106460_200000210301 [1,1,0,0,0,0|0,0,0]=2 7735 B10R1.17 CNCCc1ccccc1 2230a_106832991635_100000765856 [1,1,0,0,0,0|0,0,0]=2 7736 B10R1.17 CNCCc1ccccc1 34a_100000106460_200000210301 [1,1,0,0,0,0|0,0,0]=2 7737 B10R1.17 CNCCc1ccccc1 34a_100102657272_100000765856 [1,1,0,0,0,0|0,0,0]=2 7738 B10R1.17 CNCCc1ccccc1 7a_106832991635_100000765856 [1,1,0,0,0,0|0,0,0]=2 7739 B10R1.17 CNCCc1ccccn1 2230a_106832991635_100015183660 [1,1,0,0,0,0|1,0,0]=3 7740 B10R1.17 CNCCc1ccccn1 7a_106832991635_100015183660 [1,1,0,0,0,0|1,0,0]=3 7741 B10R1.17 CNCCc1cccnc1 2230a_100000736294_200000210301 [1,1,0,0,0,0|1,0,0]=3 7742 B10R1.17 CNCCc1cccnc1 2230a_106832991635_200011713674 [1,1,0,0,0,0|1,0,0]=3 7743 B10R1.17 CNCCc1cccnc1 7a_106832991635_200011713674 [1,1,0,0,0,0|1,0,0]=3 7744 B10R1.17 CNCCc1ccncc1 2230a_106832991635_100000723409 [1,1,0,0,0,0|1,0,0]=3 7745 B10R1.17 CNCCc1ccncc1 7a_106832991635_100000723409 [1,1,0,0,0,0|1,0,0]=3 7746 B10R1.17 CNCSc1ccccc1 2230a_106832991635_100011218342 [1,1,0,0,0,0|1,0,0]=3 7747 B10R1.17 COCCc1ccccc1 34a_100000210268_200000210301 [1,1,0,0,0,0|0,0,0]=2 7748 B10R1.17 COCCc1ccccc1 34a_100138415774_100000765856 [1,1,0,0,0,0|0,0,0]=2 7749 B10R1.17 COCCc1ccccc1 7a_100000210268_200000210301 [1,1,0,0,0,0|0,0,0]=2 7750 B10R1.17 COCCc1ccccn1 34a_100000210271_200000210301 [1,1,0,0,0,0|1,0,0]=3 7751 B10R1.17 COCCc1cccnc1 34a_100011217484_200000210301 [1,1,0,0,0,0|1,0,0]=3 7752 B10R1.17 COCCc1ccncc1 34a_100011216225_200000210301 [1,1,0,0,0,0|1,0,0]=3 7753 B10R1.17 COCCc1cnccn1 34a_100011349526_200000210301 [1,1,0,0,0,0|2,0,0]=4 7754 B10R1.17 COCCc1cncnc1 34a_100011709255_200000210301 [1,1,0,0,0,0|2,0,0]=4 7755 B10R1.17 COCSc1ccccc1 62a_100000719477_100000766300 [1,1,0,0,0,0|1,0,0]=3 7756 B10R1.17 COCSc1ccccc1 62a_100000766300_100000041952 [1,1,0,0,0,0|1,0,0]=3 7757 B10R1.17 COCSc1ccccn1 62a_100000766300_100011216584 [1,1,0,0,0,0|2,0,0]=4 7758 B10R1.17 COCSc1ccccn1 62a_100011216584_100000766300 [1,1,0,0,0,0|2,0,0]=4 7759 B10R1.17 COCSc1cccnc1 62a_100000210063_100000766300 [1,1,0,0,0,0|2,0,0]=4 7760 B10R1.17 COCSc1cccnc1 62a_100000766300_100000210063 [1,1,0,0,0,0|2,0,0]=4 7761 B10R1.17 COCSc1ccncc1 62a_100000728582_100000766300 [1,1,0,0,0,0|2,0,0]=4 7762 B10R1.17 COCSc1ccncc1 62a_100000766300_100000728582 [1,1,0,0,0,0|2,0,0]=4 7763 B10R1.17 CSCCc1ccccc1 62a_100000765856_200000210301 [1,1,0,0,0,0|0,0,0]=2 7764 B10R1.17 CSCCc1ccccc1 62a_200000210301_100011218657 [1,1,0,0,0,0|0,0,0]=2 7765 B10R1.17 CSCCc1ccccn1 62a_100015183660_200000210301 [1,1,0,0,0,0|1,0,0]=3 7766 B10R1.17 CSCCc1ccccn1 62a_200000210301_100015183660 [1,1,0,0,0,0|1,0,0]=3 7767 B10R1.17 CSCCc1cccnc1 62a_200000210301_200011713674 [1,1,0,0,0,0|1,0,0]=3 7768 B10R1.17 CSCCc1cccnc1 62a_200011713674_200000210301 [1,1,0,0,0,0|1,0,0]=3 7769 B10R1.17 CSCCc1ccncc1 62a_100000723409_200000210301 [1,1,0,0,0,0|1,0,0]=3 7770 B10R1.17 CSCCc1ccncc1 62a_200000210301_100000723409 [1,1,0,0,0,0|1,0,0]=3 7771 B10R1.17 CSCNc1ccccc1 34a_100000106764_100011218213 [1,1,0,0,0,0|1,0,0]=3 7772 B10R1.17 CSCOc1ccccc1 34a_100000210340_100011218213 [1,1,0,0,0,0|1,0,0]=3 7773 B10R1.17 CSCOc1cccnc1 34a_100000210849_100011218213 [1,1,0,0,0,0|2,0,0]=4 7774 B10R1.17 CSCOc1ccncc1 34a_100000212176_100011218213 [1,1,0,0,0,0|2,0,0]=4 7775 B10R1.17 CSCSc1ccccc1 62a_100000719477_100011218213 [1,1,0,0,0,0|1,0,0]=3 7776 B10R1.17 CSCSc1ccccc1 62a_100011218213_100000041952 [1,1,0,0,0,0|1,0,0]=3 7777 B10R1.17 CSCSc1ccccc1 62a_100011218342_200000210301 [1,1,0,0,0,0|1,0,0]=3 7778 B10R1.17 CSCSc1ccccc1 62a_200000210301_100011218342 [1,1,0,0,0,0|1,0,0]=3 7779 B10R1.17 CSCSc1ccccn1 62a_100011216584_100011218213 [1,1,0,0,0,0|2,0,0]=4 7780 B10R1.17 CSCSc1ccccn1 62a_100011218213_100011216584 [1,1,0,0,0,0|2,0,0]=4 7781 B10R1.17 CSCSc1cccnc1 62a_100000210063_100011218213 [1,1,0,0,0,0|2,0,0]=4 7782 B10R1.17 CSCSc1cccnc1 62a_100011218213_100000210063 [1,1,0,0,0,0|2,0,0]=4 7783 B10R1.17 CSCSc1ccncc1 62a_100000728582_100011218213 [1,1,0,0,0,0|2,0,0]=4 7784 B10R1.17 CSCSc1ccncc1 62a_100011218213_100000728582 [1,1,0,0,0,0|2,0,0]=4 7785 B10R1.17 FCCNc1ccccc1 34a_100000106764_100011217306 [1,1,0,0,0,0|1,0,0]=3 7786 B10R1.17 FCCOc1ccccc1 34a_100000210340_100011217306 [1,1,0,0,0,0|1,0,0]=3 7787 B10R1.17 FCCOc1ccccc1 7a_100000210340_100011217306 [1,1,0,0,0,0|1,0,0]=3 7788 B10R1.17 FCCOc1cccnc1 34a_100000210849_100011217306 [1,1,0,0,0,0|2,0,0]=4 7789 B10R1.17 FCCOc1cccnc1 7a_100000210849_100011217306 [1,1,0,0,0,0|2,0,0]=4 7790 B10R1.17 FCCOc1ccncc1 34a_100000212176_100011217306 [1,1,0,0,0,0|2,0,0]=4 7791 B10R1.17 FCCSc1ccccc1 62a_100000719477_100011217306 [1,1,0,0,0,0|1,0,0]=3 7792 B10R1.17 FCCSc1ccccc1 62a_100011217306_100000041952 [1,1,0,0,0,0|1,0,0]=3 7793 B10R1.17 FCCSc1ccccn1 62a_100011216584_100011217306 [1,1,0,0,0,0|2,0,0]=4 7794 B10R1.17 FCCSc1ccccn1 62a_100011217306_100011216584 [1,1,0,0,0,0|2,0,0]=4 7795 B10R1.17 FCCSc1cccnc1 62a_100000210063_100011217306 [1,1,0,0,0,0|2,0,0]=4 7796 B10R1.17 FCCSc1cccnc1 62a_100011217306_100000210063 [1,1,0,0,0,0|2,0,0]=4 7797 B10R1.17 FCCSc1ccncc1 62a_100000728582_100011217306 [1,1,0,0,0,0|2,0,0]=4 7798 B10R1.17 FCCSc1ccncc1 62a_100011217306_100000728582 [1,1,0,0,0,0|2,0,0]=4 7799 B10R1.17 FCNCc1ccccc1 34a_100015324214_100015361967 [1,1,0,0,0,0|1,0,0]=3 7800 B10R1.17 FCOCc1ccccc1 34a_100000210790_100015361967 [1,1,0,0,0,0|1,0,0]=3 7801 B10R1.17 FCOCc1ccccc1 7a_100000210790_100015361967 [1,1,0,0,0,0|1,0,0]=3 7802 B10R1.17 FCSCc1ccccc1 62a_100000211182_100015361967 [1,1,0,0,0,0|1,0,0]=3 7803 B10R1.17 FCSCc1ccccc1 62a_100015361967_100015291786 [1,1,0,0,0,0|1,0,0]=3 7804 B10R1.17 FCSCc1ccccn1 62a_100000721315_100015361967 [1,1,0,0,0,0|2,0,0]=4 7805 B10R1.17 FCSCc1ccccn1 62a_100015361967_100000721315 [1,1,0,0,0,0|2,0,0]=4 7806 B10R1.17 FCSCc1cccnc1 62a_100000741622_100015361967 [1,1,0,0,0,0|2,0,0]=4 7807 B10R1.17 FCSCc1cccnc1 62a_100015361967_100000741622 [1,1,0,0,0,0|2,0,0]=4 7808 B10R1.17 FCSCc1ccncc1 62a_100015193705_100015361967 [1,1,0,0,0,0|2,0,0]=4 7809 B10R1.17 FCSCc1ccncc1 62a_100015361967_100015193705 [1,1,0,0,0,0|2,0,0]=4 7810 B10R1.17 N#CCOc1ccccc1 7a_100000210340_100011215382 [1,1,0,0,0,0|1,0,1]=4 7811 B10R1.17 N#CCSc1ccccc1 62a_100000719477_100011215382 [1,1,0,0,0,0|1,0,1]=4 7812 B10R1.17 N#CCSc1ccccc1 62a_100011215382_100000041952 [1,1,0,0,0,0|1,0,1]=4 7813 B10R1.17 O=CCNc1ccccc1 34a_100000106764_200009817547 [1,1,0,0,0,0|1,0,1]=4 7814 B10R1.17 O=CCOc1ccccc1 34a_100000210340_200009817547 [1,1,0,0,0,0|1,0,1]=4 7815 B10R1.17 O=CCOc1ccccc1 7a_100000210340_200015260668 [1,1,0,0,0,0|1,0,1]=4 7816 B10R1.17 O=CCSc1ccccc1 62a_100000719477_200015260668 [1,1,0,0,0,0|1,0,1]=4 7817 B10R1.17 O=CCSc1ccccc1 62a_200015260668_100000041952 [1,1,0,0,0,0|1,0,1]=4 7818 B10R1.17 OCCNc1ccccc1 34a_100000106764_100000211926 [1,1,0,0,0,0|1,0,0]=3 7819 B10R1.17 OCCOc1ccccc1 34a_100000210340_100000211926 [1,1,0,0,0,0|1,0,0]=3 7820 B10R1.17 OCCOc1ccccc1 7a_100000210340_100000211926 [1,1,0,0,0,0|1,0,0]=3 7821 B10R1.17 OCCOc1cccnc1 34a_100000210849_100000211926 [1,1,0,0,0,0|2,0,0]=4 7822 B10R1.17 OCCOc1cccnc1 7a_100000210849_100000211926 [1,1,0,0,0,0|2,0,0]=4 7823 B10R1.17 OCCOc1ccncc1 34a_100000212176_100000211926 [1,1,0,0,0,0|2,0,0]=4 7824 B10R1.17 OCCSc1ccccc1 62a_100000211926_100000041952 [1,1,0,0,0,0|1,0,0]=3 7825 B10R1.17 OCCSc1ccccc1 62a_100000719477_100000211926 [1,1,0,0,0,0|1,0,0]=3 7826 B10R1.17 OCCSc1ccccn1 62a_100000211926_100011216584 [1,1,0,0,0,0|2,0,0]=4 7827 B10R1.17 OCCSc1ccccn1 62a_100011216584_100000211926 [1,1,0,0,0,0|2,0,0]=4 7828 B10R1.17 OCCSc1cccnc1 62a_100000210063_100000211926 [1,1,0,0,0,0|2,0,0]=4 7829 B10R1.17 OCCSc1cccnc1 62a_100000211926_100000210063 [1,1,0,0,0,0|2,0,0]=4 7830 B10R1.17 OCCSc1ccncc1 62a_100000211926_100000728582 [1,1,0,0,0,0|2,0,0]=4 7831 B10R1.17 OCCSc1ccncc1 62a_100000728582_100000211926 [1,1,0,0,0,0|2,0,0]=4 7832 B10R1.17 [13CH3]NCCc1ccccc1 2230a_100000106460_200025704644 [1,1,0,0,0,0|0,0,0]=2 7833 B10R1.17 [13CH3]NCCc1ccccc1 34a_100000106460_200025704644 [1,1,0,0,0,0|0,0,0]=2 7834 B10R1.17 [13CH3]NCCc1cccnc1 2230a_100000736294_200025704644 [1,1,0,0,0,0|1,0,0]=3 7835 B10R1.17 [13CH3]OCCc1ccccc1 34a_100000210268_200025704644 [1,1,0,0,0,0|0,0,0]=2 7836 B10R1.17 [13CH3]OCCc1ccccc1 7a_100000210268_200025704644 [1,1,0,0,0,0|0,0,0]=2 7837 B10R1.17 [13CH3]OCCc1ccccn1 34a_100000210271_200025704644 [1,1,0,0,0,0|1,0,0]=3 7838 B10R1.17 [13CH3]OCCc1cccnc1 34a_100011217484_200025704644 [1,1,0,0,0,0|1,0,0]=3 7839 B10R1.17 [13CH3]OCCc1ccncc1 34a_100011216225_200025704644 [1,1,0,0,0,0|1,0,0]=3 7840 B10R1.17 [13CH3]OCCc1cnccn1 34a_100011349526_200025704644 [1,1,0,0,0,0|2,0,0]=4 7841 B10R1.17 [13CH3]OCCc1cncnc1 34a_100011709255_200025704644 [1,1,0,0,0,0|2,0,0]=4 7842 B10R1.17 [13CH3]SCCc1ccccc1 62a_100000765856_200025704644 [1,1,0,0,0,0|0,0,0]=2 7843 B10R1.17 [13CH3]SCCc1ccccc1 62a_200025704644_100011218657 [1,1,0,0,0,0|0,0,0]=2 7844 B10R1.17 [13CH3]SCCc1ccccn1 62a_100015183660_200025704644 [1,1,0,0,0,0|1,0,0]=3 7845 B10R1.17 [13CH3]SCCc1ccccn1 62a_200025704644_100015183660 [1,1,0,0,0,0|1,0,0]=3 7846 B10R1.17 [13CH3]SCCc1cccnc1 62a_200011713674_200025704644 [1,1,0,0,0,0|1,0,0]=3 7847 B10R1.17 [13CH3]SCCc1cccnc1 62a_200025704644_200011713674 [1,1,0,0,0,0|1,0,0]=3 7848 B10R1.17 [13CH3]SCCc1ccncc1 62a_100000723409_200025704644 [1,1,0,0,0,0|1,0,0]=3 7849 B10R1.17 [13CH3]SCCc1ccncc1 62a_200025704644_100000723409 [1,1,0,0,0,0|1,0,0]=3 7850 B10R1.17 [13CH3]SCSc1ccccc1 62a_100011218342_200025704644 [1,1,0,0,0,0|1,0,0]=3 7851 B10R1.17 [13CH3]SCSc1ccccc1 62a_200025704644_100011218342 [1,1,0,0,0,0|1,0,0]=3 7852 B10R1.18 CC(=Cc1ccccc1)C 271570a_100102525489_100000210277 [1,1,0,0,0,0|0,0,2]=4 7853 B10R1.18 CC(=O)C[n+]1ccccc1 1458a_200000086051_200000210301 [1,1,0,0,0,0|1,0,1]=4 7854 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [1,1,0,0,0,0|0,0,1]=3 7855 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000070787_100000721315 [1,1,0,0,0,0|1,0,1]=4 7856 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000233486_200000210301 [1,1,0,0,0,0|1,0,1]=4 7857 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000070787_100000733263 [1,1,0,0,0,0|1,0,1]=4 7858 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000737805_200000210301 [1,1,0,0,0,0|1,0,1]=4 7859 B10R1.18 CC(=O)Cc1ccncc1 1458a_100000070787_100000705612 [1,1,0,0,0,0|1,0,1]=4 7860 B10R1.18 CC(=O)Nc1ccccc1 11a_100000106764_100015343762 [1,1,0,0,0,0|1,0,1]=4 7861 B10R1.18 CC(=O)Nc1ccccc1 1626a_100000106764_100015343762 [1,1,0,0,0,0|1,0,1]=4 7862 B10R1.18 CC(=O)Nc1ccccc1 22a_100000106764_100000070787 [1,1,0,0,0,0|1,0,1]=4 7863 B10R1.18 CC(=O)Nc1ccccc1 527a_100000106764_100103153847 [1,1,0,0,0,0|1,0,1]=4 7864 B10R1.18 CC(C)Nc1ccccc1 34a_100000106764_100000210206 [1,1,0,0,0,0|1,0,0]=3 7865 B10R1.18 CC(C)Oc1ccccc1 34a_100000210340_100000210206 [1,1,0,0,0,0|1,0,0]=3 7866 B10R1.18 CC(C)Oc1ccccc1 7a_100000210340_100000210206 [1,1,0,0,0,0|1,0,0]=3 7867 B10R1.18 CC(C)Oc1cccnc1 34a_100000210849_100000210206 [1,1,0,0,0,0|2,0,0]=4 7868 B10R1.18 CC(C)Oc1cccnc1 7a_100000210849_100000210206 [1,1,0,0,0,0|2,0,0]=4 7869 B10R1.18 CC(C)Oc1ccncc1 34a_100000212176_100000210206 [1,1,0,0,0,0|2,0,0]=4 7870 B10R1.18 CC(C)Sc1ccccc1 62a_100000210206_100000041952 [1,1,0,0,0,0|1,0,0]=3 7871 B10R1.18 CC(C)Sc1ccccc1 62a_100000719477_100000210206 [1,1,0,0,0,0|1,0,0]=3 7872 B10R1.18 CC(C)Sc1ccccn1 62a_100000210206_100011216584 [1,1,0,0,0,0|2,0,0]=4 7873 B10R1.18 CC(C)Sc1ccccn1 62a_100011216584_100000210206 [1,1,0,0,0,0|2,0,0]=4 7874 B10R1.18 CC(C)Sc1cccnc1 62a_100000210063_100000210206 [1,1,0,0,0,0|2,0,0]=4 7875 B10R1.18 CC(C)Sc1cccnc1 62a_100000210206_100000210063 [1,1,0,0,0,0|2,0,0]=4 7876 B10R1.18 CC(C)Sc1ccncc1 62a_100000210206_100000728582 [1,1,0,0,0,0|2,0,0]=4 7877 B10R1.18 CC(C)Sc1ccncc1 62a_100000728582_100000210206 [1,1,0,0,0,0|2,0,0]=4 7878 B10R1.18 CN(C)Cc1ccccc1 2230a_100000186898_200000210301 [1,1,0,0,0,0|1,0,0]=3 7879 B10R1.18 CN(C)Cc1ccccc1 2230a_100102631434_100015291786 [1,1,0,0,0,0|1,0,0]=3 7880 B10R1.18 CN(C)Cc1ccccc1 269982a_100000186898_200000210301 [1,1,0,0,0,0|1,0,0]=3 7881 B10R1.18 CN(C)Cc1ccccc1 269982a_100102631434_100000211182 [1,1,0,0,0,0|1,0,0]=3 7882 B10R1.18 CN(C)Cc1ccccc1 270004a_100102631434_100015611070 [1,1,0,0,0,0|1,0,0]=3 7883 B10R1.18 CN(C)Cc1ccccn1 2230a_100000207498_200000210301 [1,1,0,0,0,0|2,0,0]=4 7884 B10R1.18 CN(C)Cc1ccccn1 2230a_100102631434_100000721315 [1,1,0,0,0,0|2,0,0]=4 7885 B10R1.18 CN(C)Cc1ccccn1 269982a_100000207498_200000210301 [1,1,0,0,0,0|2,0,0]=4 7886 B10R1.18 CN(C)Cc1ccccn1 269982a_100102631434_100000721315 [1,1,0,0,0,0|2,0,0]=4 7887 B10R1.18 CN(C)Cc1ccccn1 270004a_100102631434_100000209966 [1,1,0,0,0,0|2,0,0]=4 7888 B10R1.18 CN(C)Cc1cccnc1 2230a_100000184577_200000210301 [1,1,0,0,0,0|2,0,0]=4 7889 B10R1.18 CN(C)Cc1cccnc1 2230a_100102631434_100000741622 [1,1,0,0,0,0|2,0,0]=4 7890 B10R1.18 CN(C)Cc1cccnc1 269982a_100000184577_200000210301 [1,1,0,0,0,0|2,0,0]=4 7891 B10R1.18 CN(C)Cc1cccnc1 269982a_100102631434_100000733263 [1,1,0,0,0,0|2,0,0]=4 7892 B10R1.18 CN(C)Cc1cccnc1 270004a_100102631434_100000209961 [1,1,0,0,0,0|2,0,0]=4 7893 B10R1.18 CN(C)Cc1ccncc1 2230a_100000187231_200000210301 [1,1,0,0,0,0|2,0,0]=4 7894 B10R1.18 CN(C)Cc1ccncc1 2230a_100102631434_100015193705 [1,1,0,0,0,0|2,0,0]=4 7895 B10R1.18 CN(C)Cc1ccncc1 269982a_100000187231_200000210301 [1,1,0,0,0,0|2,0,0]=4 7896 B10R1.18 CN(C)Cc1ccncc1 269982a_100102631434_100015193705 [1,1,0,0,0,0|2,0,0]=4 7897 B10R1.18 CN([13CH3])Cc1ccccc1 2230a_100000186898_200025704644 [1,1,0,0,0,0|1,0,0]=3 7898 B10R1.18 CN([13CH3])Cc1ccccc1 269982a_100000186898_200025704644 [1,1,0,0,0,0|1,0,0]=3 7899 B10R1.18 CN([13CH3])Cc1ccccn1 2230a_100000207498_200025704644 [1,1,0,0,0,0|2,0,0]=4 7900 B10R1.18 CN([13CH3])Cc1ccccn1 269982a_100000207498_200025704644 [1,1,0,0,0,0|2,0,0]=4 7901 B10R1.18 CN([13CH3])Cc1cccnc1 2230a_100000184577_200025704644 [1,1,0,0,0,0|2,0,0]=4 7902 B10R1.18 CN([13CH3])Cc1cccnc1 269982a_100000184577_200025704644 [1,1,0,0,0,0|2,0,0]=4 7903 B10R1.18 CN([13CH3])Cc1ccncc1 2230a_100000187231_200025704644 [1,1,0,0,0,0|2,0,0]=4 7904 B10R1.18 CN([13CH3])Cc1ccncc1 269982a_100000187231_200025704644 [1,1,0,0,0,0|2,0,0]=4 7905 B10R1.18 [13CH3]C(=O)C[n+]1ccccc1 1458a_200000086051_200025704644 [1,1,0,0,0,0|1,0,1]=4 7906 B10R1.18 [13CH3]C(=O)Cc1ccccn1 1458a_100000233486_200025704644 [1,1,0,0,0,0|1,0,1]=4 7907 B10R1.18 [13CH3]C(=O)Cc1cccnc1 1458a_100000737805_200025704644 [1,1,0,0,0,0|1,0,1]=4 7908 B10R1.2 C=Cc1cccc(c1O)Br 271570a_100011290941_100010084509 [1,1,0,0,0,0|0,0,2]=4 7909 B10R1.2 C=Cc1cccc(c1O)C 271570a_100011290941_100009817157 [1,1,0,0,0,0|0,0,2]=4 7910 B10R1.2 C=Cc1cccc(c1O)Cl 271570a_100011290941_100010202889 [1,1,0,0,0,0|0,0,2]=4 7911 B10R1.2 C=Cc1cccc(c1O)F 271570a_100011290941_100009813666 [1,1,0,0,0,0|0,0,2]=4 7912 B10R1.2 C=Cc1cccc(c1O)N 271570a_100011290941_100011934915 [1,1,0,0,0,0|0,0,2]=4 7913 B10R1.2 C=Cc1cccc(c1O)O 271570a_100011290941_100009815950 [1,1,0,0,0,0|0,0,2]=4 7914 B10R1.2 CCc1cccc(c1O)C 271570a_203496583355_100000036235 [1,1,0,0,0,0|0,0,0]=2 7915 B10R1.2 CCc1cccc(c1O)O 271570a_203496583355_200010001580 [1,1,0,0,0,0|0,0,0]=2 7916 B10R1.2 CNc1cccc(c1Br)C 34a_100000684715_200000210301 [1,1,0,0,0,0|2,0,0]=4 7917 B10R1.2 CNc1cccc(c1Br)Cl 34a_100000687072_200000210301 [1,1,0,0,0,0|2,0,0]=4 7918 B10R1.2 CNc1cccc(c1Br)F 34a_100011934729_200000210301 [1,1,0,0,0,0|2,0,0]=4 7919 B10R1.2 CNc1cccc(c1Br)O 34a_100012183704_200000210301 [1,1,0,0,0,0|2,0,0]=4 7920 B10R1.2 CNc1cccc(c1Br)O 7a_100012183704_200000210301 [1,1,0,0,0,0|2,0,0]=4 7921 B10R1.2 CNc1cccc(c1C)Br 34a_100000750434_200000210301 [1,1,0,0,0,0|2,0,0]=4 7922 B10R1.2 CNc1cccc(c1C)C 2230a_100000210026_200000210301 [1,1,0,0,0,0|2,0,0]=4 7923 B10R1.2 CNc1cccc(c1C)C 34a_100000210026_200000210301 [1,1,0,0,0,0|2,0,0]=4 7924 B10R1.2 CNc1cccc(c1C)C 7a_100000210026_200000210301 [1,1,0,0,0,0|2,0,0]=4 7925 B10R1.2 CNc1cccc(c1C)Cl 2230a_100000210441_200000210301 [1,1,0,0,0,0|2,0,0]=4 7926 B10R1.2 CNc1cccc(c1C)Cl 34a_100000210441_200000210301 [1,1,0,0,0,0|2,0,0]=4 7927 B10R1.2 CNc1cccc(c1C)Cl 7a_100000210441_200000210301 [1,1,0,0,0,0|2,0,0]=4 7928 B10R1.2 CNc1cccc(c1C)F 34a_100000745574_200000210301 [1,1,0,0,0,0|2,0,0]=4 7929 B10R1.2 CNc1cccc(c1C)F 7a_100000745574_200000210301 [1,1,0,0,0,0|2,0,0]=4 7930 B10R1.2 CNc1cccc(c1C)I 34a_100000761887_200000210301 [1,1,0,0,0,0|2,0,0]=4 7931 B10R1.2 CNc1cccc(c1C)O 34a_100011216573_200000210301 [1,1,0,0,0,0|2,0,0]=4 7932 B10R1.2 CNc1cccc(c1C)O 7a_100011216573_200000210301 [1,1,0,0,0,0|2,0,0]=4 7933 B10R1.2 CNc1cccc(c1Cl)Br 34a_100000687075_200000210301 [1,1,0,0,0,0|2,0,0]=4 7934 B10R1.2 CNc1cccc(c1Cl)C 34a_100000765562_200000210301 [1,1,0,0,0,0|2,0,0]=4 7935 B10R1.2 CNc1cccc(c1Cl)C 7a_100000765562_200000210301 [1,1,0,0,0,0|2,0,0]=4 7936 B10R1.2 CNc1cccc(c1Cl)Cl 34a_100000185733_200000210301 [1,1,0,0,0,0|2,0,0]=4 7937 B10R1.2 CNc1cccc(c1Cl)F 34a_100000692321_200000210301 [1,1,0,0,0,0|2,0,0]=4 7938 B10R1.2 CNc1cccc(c1Cl)O 34a_100012002038_200000210301 [1,1,0,0,0,0|2,0,0]=4 7939 B10R1.2 CNc1cccc(c1Cl)O 7a_100012002038_200000210301 [1,1,0,0,0,0|2,0,0]=4 7940 B10R1.2 CNc1cccc(c1F)Br 2230a_100011935091_200000210301 [1,1,0,0,0,0|2,0,0]=4 7941 B10R1.2 CNc1cccc(c1F)Br 34a_100011935091_200000210301 [1,1,0,0,0,0|2,0,0]=4 7942 B10R1.2 CNc1cccc(c1F)C 2230a_100000697159_200000210301 [1,1,0,0,0,0|2,0,0]=4 7943 B10R1.2 CNc1cccc(c1F)C 34a_100000697159_200000210301 [1,1,0,0,0,0|2,0,0]=4 7944 B10R1.2 CNc1cccc(c1F)C 7a_100000697159_200000210301 [1,1,0,0,0,0|2,0,0]=4 7945 B10R1.2 CNc1cccc(c1F)Cl 2230a_100000199060_200000210301 [1,1,0,0,0,0|2,0,0]=4 7946 B10R1.2 CNc1cccc(c1F)Cl 34a_100000199060_200000210301 [1,1,0,0,0,0|2,0,0]=4 7947 B10R1.2 CNc1cccc(c1F)F 34a_100000743855_200000210301 [1,1,0,0,0,0|2,0,0]=4 7948 B10R1.2 CNc1cccc(c1I)Br 34a_100020590159_200000210301 [1,1,0,0,0,0|2,0,0]=4 7949 B10R1.2 CNc1cccc(c1I)C 34a_100000761888_200000210301 [1,1,0,0,0,0|2,0,0]=4 7950 B10R1.2 CNc1cccc(c1I)Cl 34a_100000049713_200000210301 [1,1,0,0,0,0|2,0,0]=4 7951 B10R1.2 CNc1cccc(c1I)F 34a_100000690935_200000210301 [1,1,0,0,0,0|2,0,0]=4 7952 B10R1.2 CNc1cccc(c1N)O 271570a_203496583355_100000695761 [1,1,0,0,0,0|2,0,0]=4 7953 B10R1.2 CNc1cccc(c1O)Br 34a_100011934915_200000210301 [1,1,0,0,0,0|1,0,0]=3 7954 B10R1.2 CNc1cccc(c1O)C 34a_100000756359_200000210301 [1,1,0,0,0,0|1,0,0]=3 7955 B10R1.2 CNc1cccc(c1O)Cl 34a_100000754742_200000210301 [1,1,0,0,0,0|1,0,0]=3 7956 B10R1.2 CNc1cccc(c1O)F 34a_100011934987_200000210301 [1,1,0,0,0,0|1,0,0]=3 7957 B10R1.2 COc1cccc(c1Br)Br 34a_100010187966_200000210301 [1,1,0,0,0,0|2,0,0]=4 7958 B10R1.2 COc1cccc(c1Br)Br 7a_100010187966_200000210301 [1,1,0,0,0,0|2,0,0]=4 7959 B10R1.2 COc1cccc(c1Br)C 34a_100000686692_200000210301 [1,1,0,0,0,0|2,0,0]=4 7960 B10R1.2 COc1cccc(c1Br)C 7a_100000686692_200000210301 [1,1,0,0,0,0|2,0,0]=4 7961 B10R1.2 COc1cccc(c1Br)Cl 34a_100012348804_200000210301 [1,1,0,0,0,0|2,0,0]=4 7962 B10R1.2 COc1cccc(c1Br)Cl 7a_100012348804_200000210301 [1,1,0,0,0,0|2,0,0]=4 7963 B10R1.2 COc1cccc(c1Br)F 34a_100009820682_200000210301 [1,1,0,0,0,0|2,0,0]=4 7964 B10R1.2 COc1cccc(c1Br)F 7a_100009820682_200000210301 [1,1,0,0,0,0|2,0,0]=4 7965 B10R1.2 COc1cccc(c1Br)I 34a_100010187914_200000210301 [1,1,0,0,0,0|2,0,0]=4 7966 B10R1.2 COc1cccc(c1Br)I 7a_100010187914_200000210301 [1,1,0,0,0,0|2,0,0]=4 7967 B10R1.2 COc1cccc(c1Br)N 34a_100012183704_200000210301 [1,1,0,0,0,0|2,0,0]=4 7968 B10R1.2 COc1cccc(c1Br)N 7a_100012183704_200000210301 [1,1,0,0,0,0|2,0,0]=4 7969 B10R1.2 COc1cccc(c1C)Br 34a_100012002258_200000210301 [1,1,0,0,0,0|2,0,0]=4 7970 B10R1.2 COc1cccc(c1C)Br 7a_100012002258_200000210301 [1,1,0,0,0,0|2,0,0]=4 7971 B10R1.2 COc1cccc(c1C)C 34a_100000185855_200000210301 [1,1,0,0,0,0|2,0,0]=4 7972 B10R1.2 COc1cccc(c1C)C 7a_100000185855_200000210301 [1,1,0,0,0,0|2,0,0]=4 7973 B10R1.2 COc1cccc(c1C)Cl 34a_100011265684_200000210301 [1,1,0,0,0,0|2,0,0]=4 7974 B10R1.2 COc1cccc(c1C)Cl 7a_100011265684_200000210301 [1,1,0,0,0,0|2,0,0]=4 7975 B10R1.2 COc1cccc(c1C)F 34a_100011217231_200000210301 [1,1,0,0,0,0|2,0,0]=4 7976 B10R1.2 COc1cccc(c1C)F 7a_100011217231_200000210301 [1,1,0,0,0,0|2,0,0]=4 7977 B10R1.2 COc1cccc(c1C)N 34a_100011216573_200000210301 [1,1,0,0,0,0|2,0,0]=4 7978 B10R1.2 COc1cccc(c1C)N 7a_100011216573_200000210301 [1,1,0,0,0,0|2,0,0]=4 7979 B10R1.2 COc1cccc(c1C)O 271570a_203496583355_100010002647 [1,1,0,0,0,0|2,0,0]=4 7980 B10R1.2 COc1cccc(c1Cl)Br 34a_100010187913_200000210301 [1,1,0,0,0,0|2,0,0]=4 7981 B10R1.2 COc1cccc(c1Cl)Br 7a_100010187913_200000210301 [1,1,0,0,0,0|2,0,0]=4 7982 B10R1.2 COc1cccc(c1Cl)C 34a_100000695629_200000210301 [1,1,0,0,0,0|2,0,0]=4 7983 B10R1.2 COc1cccc(c1Cl)C 7a_100000695629_200000210301 [1,1,0,0,0,0|2,0,0]=4 7984 B10R1.2 COc1cccc(c1Cl)Cl 34a_100000211076_200000210301 [1,1,0,0,0,0|2,0,0]=4 7985 B10R1.2 COc1cccc(c1Cl)Cl 7a_100000211076_200000210301 [1,1,0,0,0,0|2,0,0]=4 7986 B10R1.2 COc1cccc(c1Cl)F 34a_100000087408_200000210301 [1,1,0,0,0,0|2,0,0]=4 7987 B10R1.2 COc1cccc(c1Cl)F 7a_100000087408_200000210301 [1,1,0,0,0,0|2,0,0]=4 7988 B10R1.2 COc1cccc(c1Cl)I 34a_100000049636_200000210301 [1,1,0,0,0,0|2,0,0]=4 7989 B10R1.2 COc1cccc(c1Cl)I 7a_100000049636_200000210301 [1,1,0,0,0,0|2,0,0]=4 7990 B10R1.2 COc1cccc(c1Cl)N 34a_100012002038_200000210301 [1,1,0,0,0,0|2,0,0]=4 7991 B10R1.2 COc1cccc(c1Cl)N 7a_100012002038_200000210301 [1,1,0,0,0,0|2,0,0]=4 7992 B10R1.2 COc1cccc(c1Cl)O 271570a_203496583355_100010147677 [1,1,0,0,0,0|2,0,0]=4 7993 B10R1.2 COc1cccc(c1F)Br 34a_100009817021_200000210301 [1,1,0,0,0,0|2,0,0]=4 7994 B10R1.2 COc1cccc(c1F)Br 7a_100009817021_200000210301 [1,1,0,0,0,0|2,0,0]=4 7995 B10R1.2 COc1cccc(c1F)C 34a_100000751311_200000210301 [1,1,0,0,0,0|2,0,0]=4 7996 B10R1.2 COc1cccc(c1F)C 7a_100000751311_200000210301 [1,1,0,0,0,0|2,0,0]=4 7997 B10R1.2 COc1cccc(c1F)Cl 34a_100000687438_200000210301 [1,1,0,0,0,0|2,0,0]=4 7998 B10R1.2 COc1cccc(c1F)Cl 7a_100000687438_200000210301 [1,1,0,0,0,0|2,0,0]=4 7999 B10R1.2 COc1cccc(c1F)F 34a_100000751161_200000210301 [1,1,0,0,0,0|2,0,0]=4 8000 B10R1.2 COc1cccc(c1F)F 7a_100000751161_200000210301 [1,1,0,0,0,0|2,0,0]=4 8001 B10R1.2 COc1cccc(c1F)O 271570a_203496583355_100010185846 [1,1,0,0,0,0|2,0,0]=4 8002 B10R1.2 COc1cccc(c1I)Br 34a_100010187912_200000210301 [1,1,0,0,0,0|2,0,0]=4 8003 B10R1.2 COc1cccc(c1I)Br 7a_100010187912_200000210301 [1,1,0,0,0,0|2,0,0]=4 8004 B10R1.2 COc1cccc(c1I)C 34a_100010083724_200000210301 [1,1,0,0,0,0|2,0,0]=4 8005 B10R1.2 COc1cccc(c1I)C 7a_100010083724_200000210301 [1,1,0,0,0,0|2,0,0]=4 8006 B10R1.2 COc1cccc(c1I)Cl 34a_100000050174_200000210301 [1,1,0,0,0,0|2,0,0]=4 8007 B10R1.2 COc1cccc(c1I)Cl 7a_100000050174_200000210301 [1,1,0,0,0,0|2,0,0]=4 8008 B10R1.2 COc1cccc(c1I)F 34a_100000690913_200000210301 [1,1,0,0,0,0|2,0,0]=4 8009 B10R1.2 COc1cccc(c1I)F 7a_100000690913_200000210301 [1,1,0,0,0,0|2,0,0]=4 8010 B10R1.2 COc1cccc(c1N)Br 34a_100011934926_200000210301 [1,1,0,0,0,0|2,0,0]=4 8011 B10R1.2 COc1cccc(c1N)Br 7a_100011934926_200000210301 [1,1,0,0,0,0|2,0,0]=4 8012 B10R1.2 COc1cccc(c1N)C 34a_100000743429_200000210301 [1,1,0,0,0,0|2,0,0]=4 8013 B10R1.2 COc1cccc(c1N)C 7a_100000743429_200000210301 [1,1,0,0,0,0|2,0,0]=4 8014 B10R1.2 COc1cccc(c1N)Cl 34a_100012022510_200000210301 [1,1,0,0,0,0|2,0,0]=4 8015 B10R1.2 COc1cccc(c1N)Cl 7a_100012022510_200000210301 [1,1,0,0,0,0|2,0,0]=4 8016 B10R1.2 COc1cccc(c1N)F 34a_100020591140_200000210301 [1,1,0,0,0,0|2,0,0]=4 8017 B10R1.2 COc1cccc(c1N)F 7a_100020591140_200000210301 [1,1,0,0,0,0|2,0,0]=4 8018 B10R1.2 COc1cccc(c1N)I 34a_200000049512_200000210301 [1,1,0,0,0,0|2,0,0]=4 8019 B10R1.2 COc1cccc(c1N)I 7a_200000049512_200000210301 [1,1,0,0,0,0|2,0,0]=4 8020 B10R1.2 COc1cccc(c1N)N 34a_100000033209_200000210301 [1,1,0,0,0,0|2,0,0]=4 8021 B10R1.2 COc1cccc(c1N)O 271570a_203496583355_100000708083 [1,1,0,0,0,0|2,0,0]=4 8022 B10R1.2 COc1cccc(c1O)Br 271570a_203496583355_100010131421 [1,1,0,0,0,0|1,0,0]=3 8023 B10R1.2 COc1cccc(c1O)F 271570a_203496583355_100000041735 [1,1,0,0,0,0|1,0,0]=3 8024 B10R1.2 COc1cccc(c1O)N 271570a_203496583355_100000703447 [1,1,0,0,0,0|1,0,0]=3 8025 B10R1.2 COc1cccc(c1O)O 271570a_203496583355_100000686866 [1,1,0,0,0,0|1,0,0]=3 8026 B10R1.2 COc1cccc(c1O)O 271570a_203496583355_100010202623 [1,1,0,0,0,0|1,0,0]=3 8027 B10R1.2 COc1nccc(c1O)C 271570a_203496583355_100012353928 [1,1,0,0,0,0|2,0,0]=4 8028 B10R1.2 COc1nccc(c1O)N 271570a_203496583355_100010243811 [1,1,0,0,0,0|2,0,0]=4 8029 B10R1.2 CSc1cccc(c1Br)Br 62a_100010175083_200000210301 [1,1,0,0,0,0|2,0,0]=4 8030 B10R1.2 CSc1cccc(c1Br)Br 62a_200000210301_100010175083 [1,1,0,0,0,0|2,0,0]=4 8031 B10R1.2 CSc1cccc(c1Br)C 62a_100012362457_200000210301 [1,1,0,0,0,0|2,0,0]=4 8032 B10R1.2 CSc1cccc(c1Br)C 62a_200000210301_100012362457 [1,1,0,0,0,0|2,0,0]=4 8033 B10R1.2 CSc1cccc(c1Br)Cl 62a_100014021842_200000210301 [1,1,0,0,0,0|2,0,0]=4 8034 B10R1.2 CSc1cccc(c1Br)Cl 62a_200000210301_100014021842 [1,1,0,0,0,0|2,0,0]=4 8035 B10R1.2 CSc1cccc(c1Br)F 62a_100010202630_200000210301 [1,1,0,0,0,0|2,0,0]=4 8036 B10R1.2 CSc1cccc(c1Br)F 62a_200000210301_100010202630 [1,1,0,0,0,0|2,0,0]=4 8037 B10R1.2 CSc1cccc(c1Br)O 62a_100010187914_200000210301 [1,1,0,0,0,0|2,0,0]=4 8038 B10R1.2 CSc1cccc(c1Br)O 62a_200000210301_100010187914 [1,1,0,0,0,0|2,0,0]=4 8039 B10R1.2 CSc1cccc(c1C)Br 62a_100012353703_200000210301 [1,1,0,0,0,0|2,0,0]=4 8040 B10R1.2 CSc1cccc(c1C)Br 62a_200000210301_100012353703 [1,1,0,0,0,0|2,0,0]=4 8041 B10R1.2 CSc1cccc(c1C)C 62a_100011214922_200000210301 [1,1,0,0,0,0|2,0,0]=4 8042 B10R1.2 CSc1cccc(c1C)C 62a_200000210301_100011214922 [1,1,0,0,0,0|2,0,0]=4 8043 B10R1.2 CSc1cccc(c1C)Cl 62a_100000726075_200000210301 [1,1,0,0,0,0|2,0,0]=4 8044 B10R1.2 CSc1cccc(c1C)Cl 62a_200000210301_100000726075 [1,1,0,0,0,0|2,0,0]=4 8045 B10R1.2 CSc1cccc(c1C)F 62a_100011216893_200000210301 [1,1,0,0,0,0|2,0,0]=4 8046 B10R1.2 CSc1cccc(c1C)F 62a_200000210301_100011216893 [1,1,0,0,0,0|2,0,0]=4 8047 B10R1.2 CSc1cccc(c1C)N 62a_100000761887_200000210301 [1,1,0,0,0,0|2,0,0]=4 8048 B10R1.2 CSc1cccc(c1C)N 62a_200000210301_100000761887 [1,1,0,0,0,0|2,0,0]=4 8049 B10R1.2 CSc1cccc(c1C)O 62a_100012002258_200000210301 [1,1,0,0,0,0|2,0,0]=4 8050 B10R1.2 CSc1cccc(c1C)O 62a_200000210301_100012002258 [1,1,0,0,0,0|2,0,0]=4 8051 B10R1.2 CSc1cccc(c1Cl)Br 62a_100010142854_200000210301 [1,1,0,0,0,0|2,0,0]=4 8052 B10R1.2 CSc1cccc(c1Cl)Br 62a_200000210301_100010142854 [1,1,0,0,0,0|2,0,0]=4 8053 B10R1.2 CSc1cccc(c1Cl)C 62a_200000210301_200012352035 [1,1,0,0,0,0|2,0,0]=4 8054 B10R1.2 CSc1cccc(c1Cl)C 62a_200012352035_200000210301 [1,1,0,0,0,0|2,0,0]=4 8055 B10R1.2 CSc1cccc(c1Cl)Cl 62a_100011215384_200000210301 [1,1,0,0,0,0|2,0,0]=4 8056 B10R1.2 CSc1cccc(c1Cl)Cl 62a_200000210301_100011215384 [1,1,0,0,0,0|2,0,0]=4 8057 B10R1.2 CSc1cccc(c1Cl)F 62a_200000210301_200010234923 [1,1,0,0,0,0|2,0,0]=4 8058 B10R1.2 CSc1cccc(c1Cl)F 62a_200010234923_200000210301 [1,1,0,0,0,0|2,0,0]=4 8059 B10R1.2 CSc1cccc(c1Cl)O 62a_200000210301_100000049636 [1,1,0,0,0,0|2,0,0]=4 8060 B10R1.2 CSc1cccc(c1F)Br 62a_100000702267_200000210301 [1,1,0,0,0,0|2,0,0]=4 8061 B10R1.2 CSc1cccc(c1F)Br 62a_200000210301_100000702267 [1,1,0,0,0,0|2,0,0]=4 8062 B10R1.2 CSc1cccc(c1F)C 62a_100000717567_200000210301 [1,1,0,0,0,0|2,0,0]=4 8063 B10R1.2 CSc1cccc(c1F)C 62a_200000210301_100000717567 [1,1,0,0,0,0|2,0,0]=4 8064 B10R1.2 CSc1cccc(c1F)Cl 62a_100011217346_200000210301 [1,1,0,0,0,0|2,0,0]=4 8065 B10R1.2 CSc1cccc(c1F)Cl 62a_200000210301_100011217346 [1,1,0,0,0,0|2,0,0]=4 8066 B10R1.2 CSc1cccc(c1F)F 62a_100000694657_200000210301 [1,1,0,0,0,0|2,0,0]=4 8067 B10R1.2 CSc1cccc(c1F)F 62a_200000210301_100000694657 [1,1,0,0,0,0|2,0,0]=4 8068 B10R1.2 CSc1cccc(c1F)N 62a_100011935091_200000210301 [1,1,0,0,0,0|2,0,0]=4 8069 B10R1.2 CSc1cccc(c1F)N 62a_200000210301_100011935091 [1,1,0,0,0,0|2,0,0]=4 8070 B10R1.2 CSc1cccc(c1F)O 62a_100009817021_200000210301 [1,1,0,0,0,0|2,0,0]=4 8071 B10R1.2 CSc1cccc(c1F)O 62a_200000210301_100009817021 [1,1,0,0,0,0|2,0,0]=4 8072 B10R1.2 CSc1cccc(c1N)Br 62a_100010146558_200000210301 [1,1,0,0,0,0|2,0,0]=4 8073 B10R1.2 CSc1cccc(c1N)Br 62a_200000210301_100010146558 [1,1,0,0,0,0|2,0,0]=4 8074 B10R1.2 CSc1cccc(c1N)C 62a_100011834072_200000210301 [1,1,0,0,0,0|2,0,0]=4 8075 B10R1.2 CSc1cccc(c1N)C 62a_200000210301_100011834072 [1,1,0,0,0,0|2,0,0]=4 8076 B10R1.2 CSc1cccc(c1N)Cl 62a_100010190421_200000210301 [1,1,0,0,0,0|2,0,0]=4 8077 B10R1.2 CSc1cccc(c1N)Cl 62a_200000210301_100010190421 [1,1,0,0,0,0|2,0,0]=4 8078 B10R1.2 CSc1cccc(c1N)F 62a_100000042321_200000210301 [1,1,0,0,0,0|2,0,0]=4 8079 B10R1.2 CSc1cccc(c1N)F 62a_200000210301_100000042321 [1,1,0,0,0,0|2,0,0]=4 8080 B10R1.2 CSc1cccc(c1N)N 62a_100015191791_200000210301 [1,1,0,0,0,0|2,0,0]=4 8081 B10R1.2 CSc1cccc(c1N)O 62a_200000210301_100011934926 [1,1,0,0,0,0|2,0,0]=4 8082 B10R1.2 CSc1cccc(c1O)Br 62a_100010084509_200000210301 [1,1,0,0,0,0|1,0,0]=3 8083 B10R1.2 CSc1cccc(c1O)Br 62a_200000210301_100010084509 [1,1,0,0,0,0|1,0,0]=3 8084 B10R1.2 CSc1cccc(c1O)C 62a_100009817157_200000210301 [1,1,0,0,0,0|1,0,0]=3 8085 B10R1.2 CSc1cccc(c1O)C 62a_200000210301_100009817157 [1,1,0,0,0,0|1,0,0]=3 8086 B10R1.2 CSc1cccc(c1O)Cl 62a_100010202889_200000210301 [1,1,0,0,0,0|1,0,0]=3 8087 B10R1.2 CSc1cccc(c1O)Cl 62a_200000210301_100010202889 [1,1,0,0,0,0|1,0,0]=3 8088 B10R1.2 CSc1cccc(c1O)F 62a_100009813666_200000210301 [1,1,0,0,0,0|1,0,0]=3 8089 B10R1.2 CSc1cccc(c1O)F 62a_200000210301_100009813666 [1,1,0,0,0,0|1,0,0]=3 8090 B10R1.2 CSc1cccc(c1O)N 62a_100011934915_200000210301 [1,1,0,0,0,0|1,0,0]=3 8091 B10R1.2 CSc1cccc(c1O)N 62a_200000210301_100010084371 [1,1,0,0,0,0|1,0,0]=3 8092 B10R1.2 CSc1cccc(c1O)O 62a_200000210301_100009815950 [1,1,0,0,0,0|1,0,0]=3 8093 B10R1.2 CSc1ccnc(c1O)Cl 62a_200000210301_100010067911 [1,1,0,0,0,0|2,0,0]=4 8094 B10R1.2 CSc1cncc(c1O)N 62a_100000694263_200000210301 [1,1,0,0,0,0|2,0,0]=4 8095 B10R1.2 CSc1cncc(c1O)N 62a_200000210301_100000694263 [1,1,0,0,0,0|2,0,0]=4 8096 B10R1.2 CSc1nccc(c1O)C 62a_200000210301_100000696282 [1,1,0,0,0,0|2,0,0]=4 8097 B10R1.2 CSc1nccc(c1O)F 62a_200000210301_100009867227 [1,1,0,0,0,0|2,0,0]=4 8098 B10R1.2 CSc1nccc(c1O)N 62a_200000210301_100009844647 [1,1,0,0,0,0|2,0,0]=4 8099 B10R1.2 Cc1c(cccc1CN)O 271570a_203496583355_100000724210 [1,1,0,0,0,0|2,0,0]=4 8100 B10R1.2 Cc1c(cccc1CO)O 271570a_203496583355_100000694458 [1,1,0,0,0,0|2,0,0]=4 8101 B10R1.2 Cc1c(cccc1N[13CH3])Br 34a_100000750434_200025704644 [1,1,0,0,0,0|2,0,0]=4 8102 B10R1.2 Cc1c(cccc1N[13CH3])Cl 2230a_100000210441_200025704644 [1,1,0,0,0,0|2,0,0]=4 8103 B10R1.2 Cc1c(cccc1N[13CH3])Cl 34a_100000210441_200025704644 [1,1,0,0,0,0|2,0,0]=4 8104 B10R1.2 Cc1c(cccc1N[13CH3])Cl 7a_100000210441_200025704644 [1,1,0,0,0,0|2,0,0]=4 8105 B10R1.2 Cc1c(cccc1N[13CH3])F 34a_100000745574_200025704644 [1,1,0,0,0,0|2,0,0]=4 8106 B10R1.2 Cc1c(cccc1N[13CH3])F 7a_100000745574_200025704644 [1,1,0,0,0,0|2,0,0]=4 8107 B10R1.2 Cc1c(cccc1N[13CH3])I 34a_100000761887_200025704644 [1,1,0,0,0,0|2,0,0]=4 8108 B10R1.2 Cc1c(cccc1N[13CH3])O 34a_100011216573_200025704644 [1,1,0,0,0,0|2,0,0]=4 8109 B10R1.2 Cc1c(cccc1N[13CH3])O 7a_100011216573_200025704644 [1,1,0,0,0,0|2,0,0]=4 8110 B10R1.2 Cc1c(cccc1O[13CH3])Br 34a_100012002258_200025704644 [1,1,0,0,0,0|2,0,0]=4 8111 B10R1.2 Cc1c(cccc1O[13CH3])Br 7a_100012002258_200025704644 [1,1,0,0,0,0|2,0,0]=4 8112 B10R1.2 Cc1c(cccc1O[13CH3])Cl 34a_100011265684_200025704644 [1,1,0,0,0,0|2,0,0]=4 8113 B10R1.2 Cc1c(cccc1O[13CH3])Cl 7a_100011265684_200025704644 [1,1,0,0,0,0|2,0,0]=4 8114 B10R1.2 Cc1c(cccc1O[13CH3])F 34a_100011217231_200025704644 [1,1,0,0,0,0|2,0,0]=4 8115 B10R1.2 Cc1c(cccc1O[13CH3])F 7a_100011217231_200025704644 [1,1,0,0,0,0|2,0,0]=4 8116 B10R1.2 Cc1c(cccc1O[13CH3])N 34a_100011216573_200025704644 [1,1,0,0,0,0|2,0,0]=4 8117 B10R1.2 Cc1c(cccc1O[13CH3])N 7a_100011216573_200025704644 [1,1,0,0,0,0|2,0,0]=4 8118 B10R1.2 Cc1c(cccc1S[13CH3])Br 62a_100012353703_200025704644 [1,1,0,0,0,0|2,0,0]=4 8119 B10R1.2 Cc1c(cccc1S[13CH3])Br 62a_200025704644_100012353703 [1,1,0,0,0,0|2,0,0]=4 8120 B10R1.2 Cc1c(cccc1S[13CH3])Cl 62a_100000726075_200025704644 [1,1,0,0,0,0|2,0,0]=4 8121 B10R1.2 Cc1c(cccc1S[13CH3])Cl 62a_200025704644_100000726075 [1,1,0,0,0,0|2,0,0]=4 8122 B10R1.2 Cc1c(cccc1S[13CH3])F 62a_100011216893_200025704644 [1,1,0,0,0,0|2,0,0]=4 8123 B10R1.2 Cc1c(cccc1S[13CH3])F 62a_200025704644_100011216893 [1,1,0,0,0,0|2,0,0]=4 8124 B10R1.2 Cc1c(cccc1S[13CH3])N 62a_100000761887_200025704644 [1,1,0,0,0,0|2,0,0]=4 8125 B10R1.2 Cc1c(cccc1S[13CH3])N 62a_200025704644_100000761887 [1,1,0,0,0,0|2,0,0]=4 8126 B10R1.2 Cc1c(cccc1S[13CH3])O 62a_100012002258_200025704644 [1,1,0,0,0,0|2,0,0]=4 8127 B10R1.2 Cc1c(cccc1S[13CH3])O 62a_200025704644_100012002258 [1,1,0,0,0,0|2,0,0]=4 8128 B10R1.2 Cc1cccc(c1Br)N[13CH3] 34a_100000684715_200025704644 [1,1,0,0,0,0|2,0,0]=4 8129 B10R1.2 Cc1cccc(c1Br)O[13CH3] 34a_100000686692_200025704644 [1,1,0,0,0,0|2,0,0]=4 8130 B10R1.2 Cc1cccc(c1Br)O[13CH3] 7a_100000686692_200025704644 [1,1,0,0,0,0|2,0,0]=4 8131 B10R1.2 Cc1cccc(c1Br)S[13CH3] 62a_100012362457_200025704644 [1,1,0,0,0,0|2,0,0]=4 8132 B10R1.2 Cc1cccc(c1Br)S[13CH3] 62a_200025704644_100012362457 [1,1,0,0,0,0|2,0,0]=4 8133 B10R1.2 Cc1cccc(c1C)N[13CH3] 2230a_100000210026_200025704644 [1,1,0,0,0,0|2,0,0]=4 8134 B10R1.2 Cc1cccc(c1C)N[13CH3] 34a_100000210026_200025704644 [1,1,0,0,0,0|2,0,0]=4 8135 B10R1.2 Cc1cccc(c1C)N[13CH3] 7a_100000210026_200025704644 [1,1,0,0,0,0|2,0,0]=4 8136 B10R1.2 Cc1cccc(c1C)O[13CH3] 34a_100000185855_200025704644 [1,1,0,0,0,0|2,0,0]=4 8137 B10R1.2 Cc1cccc(c1C)O[13CH3] 7a_100000185855_200025704644 [1,1,0,0,0,0|2,0,0]=4 8138 B10R1.2 Cc1cccc(c1C)S[13CH3] 62a_100011214922_200025704644 [1,1,0,0,0,0|2,0,0]=4 8139 B10R1.2 Cc1cccc(c1C)S[13CH3] 62a_200025704644_100011214922 [1,1,0,0,0,0|2,0,0]=4 8140 B10R1.2 Cc1cccc(c1Cl)N[13CH3] 34a_100000765562_200025704644 [1,1,0,0,0,0|2,0,0]=4 8141 B10R1.2 Cc1cccc(c1Cl)N[13CH3] 7a_100000765562_200025704644 [1,1,0,0,0,0|2,0,0]=4 8142 B10R1.2 Cc1cccc(c1Cl)O[13CH3] 34a_100000695629_200025704644 [1,1,0,0,0,0|2,0,0]=4 8143 B10R1.2 Cc1cccc(c1Cl)O[13CH3] 7a_100000695629_200025704644 [1,1,0,0,0,0|2,0,0]=4 8144 B10R1.2 Cc1cccc(c1Cl)S[13CH3] 62a_200012352035_200025704644 [1,1,0,0,0,0|2,0,0]=4 8145 B10R1.2 Cc1cccc(c1Cl)S[13CH3] 62a_200025704644_200012352035 [1,1,0,0,0,0|2,0,0]=4 8146 B10R1.2 Cc1cccc(c1F)N[13CH3] 2230a_100000697159_200025704644 [1,1,0,0,0,0|2,0,0]=4 8147 B10R1.2 Cc1cccc(c1F)N[13CH3] 34a_100000697159_200025704644 [1,1,0,0,0,0|2,0,0]=4 8148 B10R1.2 Cc1cccc(c1F)N[13CH3] 7a_100000697159_200025704644 [1,1,0,0,0,0|2,0,0]=4 8149 B10R1.2 Cc1cccc(c1F)O[13CH3] 34a_100000751311_200025704644 [1,1,0,0,0,0|2,0,0]=4 8150 B10R1.2 Cc1cccc(c1F)O[13CH3] 7a_100000751311_200025704644 [1,1,0,0,0,0|2,0,0]=4 8151 B10R1.2 Cc1cccc(c1F)S[13CH3] 62a_100000717567_200025704644 [1,1,0,0,0,0|2,0,0]=4 8152 B10R1.2 Cc1cccc(c1F)S[13CH3] 62a_200025704644_100000717567 [1,1,0,0,0,0|2,0,0]=4 8153 B10R1.2 Cc1cccc(c1I)N[13CH3] 34a_100000761888_200025704644 [1,1,0,0,0,0|2,0,0]=4 8154 B10R1.2 Cc1cccc(c1I)O[13CH3] 34a_100010083724_200025704644 [1,1,0,0,0,0|2,0,0]=4 8155 B10R1.2 Cc1cccc(c1I)O[13CH3] 7a_100010083724_200025704644 [1,1,0,0,0,0|2,0,0]=4 8156 B10R1.2 Cc1cccc(c1N)O[13CH3] 34a_100000743429_200025704644 [1,1,0,0,0,0|2,0,0]=4 8157 B10R1.2 Cc1cccc(c1N)O[13CH3] 7a_100000743429_200025704644 [1,1,0,0,0,0|2,0,0]=4 8158 B10R1.2 Cc1cccc(c1N)S[13CH3] 62a_100011834072_200025704644 [1,1,0,0,0,0|2,0,0]=4 8159 B10R1.2 Cc1cccc(c1N)S[13CH3] 62a_200025704644_100011834072 [1,1,0,0,0,0|2,0,0]=4 8160 B10R1.2 Cc1cccc(c1O)C#N 271570a_203496583355_100011934862 [1,1,0,0,0,0|1,0,1]=4 8161 B10R1.2 Cc1cccc(c1O)CO 271570a_203496583355_100011659289 [1,1,0,0,0,0|1,0,0]=3 8162 B10R1.2 Cc1cccc(c1O)N[13CH3] 34a_100000756359_200025704644 [1,1,0,0,0,0|1,0,0]=3 8163 B10R1.2 Cc1cccc(c1O)S[13CH3] 62a_100009817157_200025704644 [1,1,0,0,0,0|1,0,0]=3 8164 B10R1.2 Cc1cccc(c1O)S[13CH3] 62a_200025704644_100009817157 [1,1,0,0,0,0|1,0,0]=3 8165 B10R1.2 Cc1ccnc(c1O)S[13CH3] 62a_200025704644_100000696282 [1,1,0,0,0,0|2,0,0]=4 8166 B10R1.2 N#Cc1cccc(c1O)Br 271570a_203496583355_100000703783 [1,1,0,0,0,0|1,0,1]=4 8167 B10R1.2 N#Cc1cccc(c1O)Cl 271570a_203496583355_100010134094 [1,1,0,0,0,0|1,0,1]=4 8168 B10R1.2 N#Cc1cccc(c1O)F 271570a_203496583355_100011219237 [1,1,0,0,0,0|1,0,1]=4 8169 B10R1.2 N#Cc1cccc(c1O)N 271570a_203496583355_100009877206 [1,1,0,0,0,0|1,0,1]=4 8170 B10R1.2 N#Cc1cccc(c1O)O 271570a_203496583355_100009817103 [1,1,0,0,0,0|1,0,1]=4 8171 B10R1.2 N#Cc1cccc(c1O)O 271570a_203496583355_100009818990 [1,1,0,0,0,0|1,0,1]=4 8172 B10R1.2 NCc1cccc(c1F)O 271570a_203496583355_100015189953 [1,1,0,0,0,0|2,0,0]=4 8173 B10R1.2 Nc1c(cccc1CO)O 271570a_203496583355_100012349457 [1,1,0,0,0,0|2,0,0]=4 8174 B10R1.2 O=Cc1cccc(c1O)F 271570a_203496583355_100011998484 [1,1,0,0,0,0|1,0,1]=4 8175 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100000737635 [1,1,0,0,0,0|1,0,1]=4 8176 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100009816417 [1,1,0,0,0,0|1,0,1]=4 8177 B10R1.2 OCc1cccc(c1Br)O 271570a_203496583355_100010240205 [1,1,0,0,0,0|2,0,0]=4 8178 B10R1.2 OCc1cccc(c1F)O 271570a_203496583355_100011935076 [1,1,0,0,0,0|2,0,0]=4 8179 B10R1.2 OCc1cccc(c1O)Br 271570a_203496583355_100010146604 [1,1,0,0,0,0|1,0,0]=3 8180 B10R1.2 OCc1cccc(c1O)F 271570a_203496583355_100000692438 [1,1,0,0,0,0|1,0,0]=3 8181 B10R1.2 [13CH3]Nc1cccc(c1Br)Cl 34a_100000687072_200025704644 [1,1,0,0,0,0|2,0,0]=4 8182 B10R1.2 [13CH3]Nc1cccc(c1Br)F 34a_100011934729_200025704644 [1,1,0,0,0,0|2,0,0]=4 8183 B10R1.2 [13CH3]Nc1cccc(c1Br)O 34a_100012183704_200025704644 [1,1,0,0,0,0|2,0,0]=4 8184 B10R1.2 [13CH3]Nc1cccc(c1Br)O 7a_100012183704_200025704644 [1,1,0,0,0,0|2,0,0]=4 8185 B10R1.2 [13CH3]Nc1cccc(c1Cl)Br 34a_100000687075_200025704644 [1,1,0,0,0,0|2,0,0]=4 8186 B10R1.2 [13CH3]Nc1cccc(c1Cl)Cl 34a_100000185733_200025704644 [1,1,0,0,0,0|2,0,0]=4 8187 B10R1.2 [13CH3]Nc1cccc(c1Cl)F 34a_100000692321_200025704644 [1,1,0,0,0,0|2,0,0]=4 8188 B10R1.2 [13CH3]Nc1cccc(c1Cl)O 34a_100012002038_200025704644 [1,1,0,0,0,0|2,0,0]=4 8189 B10R1.2 [13CH3]Nc1cccc(c1Cl)O 7a_100012002038_200025704644 [1,1,0,0,0,0|2,0,0]=4 8190 B10R1.2 [13CH3]Nc1cccc(c1F)Br 2230a_100011935091_200025704644 [1,1,0,0,0,0|2,0,0]=4 8191 B10R1.2 [13CH3]Nc1cccc(c1F)Br 34a_100011935091_200025704644 [1,1,0,0,0,0|2,0,0]=4 8192 B10R1.2 [13CH3]Nc1cccc(c1F)Cl 2230a_100000199060_200025704644 [1,1,0,0,0,0|2,0,0]=4 8193 B10R1.2 [13CH3]Nc1cccc(c1F)Cl 34a_100000199060_200025704644 [1,1,0,0,0,0|2,0,0]=4 8194 B10R1.2 [13CH3]Nc1cccc(c1F)F 34a_100000743855_200025704644 [1,1,0,0,0,0|2,0,0]=4 8195 B10R1.2 [13CH3]Nc1cccc(c1I)Br 34a_100020590159_200025704644 [1,1,0,0,0,0|2,0,0]=4 8196 B10R1.2 [13CH3]Nc1cccc(c1I)Cl 34a_100000049713_200025704644 [1,1,0,0,0,0|2,0,0]=4 8197 B10R1.2 [13CH3]Nc1cccc(c1I)F 34a_100000690935_200025704644 [1,1,0,0,0,0|2,0,0]=4 8198 B10R1.2 [13CH3]Nc1cccc(c1O)Br 34a_100011934915_200025704644 [1,1,0,0,0,0|1,0,0]=3 8199 B10R1.2 [13CH3]Nc1cccc(c1O)Cl 34a_100000754742_200025704644 [1,1,0,0,0,0|1,0,0]=3 8200 B10R1.2 [13CH3]Nc1cccc(c1O)F 34a_100011934987_200025704644 [1,1,0,0,0,0|1,0,0]=3 8201 B10R1.2 [13CH3]Oc1cccc(c1Br)Br 34a_100010187966_200025704644 [1,1,0,0,0,0|2,0,0]=4 8202 B10R1.2 [13CH3]Oc1cccc(c1Br)Br 7a_100010187966_200025704644 [1,1,0,0,0,0|2,0,0]=4 8203 B10R1.2 [13CH3]Oc1cccc(c1Br)Cl 34a_100012348804_200025704644 [1,1,0,0,0,0|2,0,0]=4 8204 B10R1.2 [13CH3]Oc1cccc(c1Br)Cl 7a_100012348804_200025704644 [1,1,0,0,0,0|2,0,0]=4 8205 B10R1.2 [13CH3]Oc1cccc(c1Br)F 34a_100009820682_200025704644 [1,1,0,0,0,0|2,0,0]=4 8206 B10R1.2 [13CH3]Oc1cccc(c1Br)F 7a_100009820682_200025704644 [1,1,0,0,0,0|2,0,0]=4 8207 B10R1.2 [13CH3]Oc1cccc(c1Br)I 34a_100010187914_200025704644 [1,1,0,0,0,0|2,0,0]=4 8208 B10R1.2 [13CH3]Oc1cccc(c1Br)I 7a_100010187914_200025704644 [1,1,0,0,0,0|2,0,0]=4 8209 B10R1.2 [13CH3]Oc1cccc(c1Br)N 34a_100012183704_200025704644 [1,1,0,0,0,0|2,0,0]=4 8210 B10R1.2 [13CH3]Oc1cccc(c1Br)N 7a_100012183704_200025704644 [1,1,0,0,0,0|2,0,0]=4 8211 B10R1.2 [13CH3]Oc1cccc(c1Cl)Br 34a_100010187913_200025704644 [1,1,0,0,0,0|2,0,0]=4 8212 B10R1.2 [13CH3]Oc1cccc(c1Cl)Br 7a_100010187913_200025704644 [1,1,0,0,0,0|2,0,0]=4 8213 B10R1.2 [13CH3]Oc1cccc(c1Cl)Cl 34a_100000211076_200025704644 [1,1,0,0,0,0|2,0,0]=4 8214 B10R1.2 [13CH3]Oc1cccc(c1Cl)Cl 7a_100000211076_200025704644 [1,1,0,0,0,0|2,0,0]=4 8215 B10R1.2 [13CH3]Oc1cccc(c1Cl)F 34a_100000087408_200025704644 [1,1,0,0,0,0|2,0,0]=4 8216 B10R1.2 [13CH3]Oc1cccc(c1Cl)F 7a_100000087408_200025704644 [1,1,0,0,0,0|2,0,0]=4 8217 B10R1.2 [13CH3]Oc1cccc(c1Cl)I 34a_100000049636_200025704644 [1,1,0,0,0,0|2,0,0]=4 8218 B10R1.2 [13CH3]Oc1cccc(c1Cl)I 7a_100000049636_200025704644 [1,1,0,0,0,0|2,0,0]=4 8219 B10R1.2 [13CH3]Oc1cccc(c1Cl)N 34a_100012002038_200025704644 [1,1,0,0,0,0|2,0,0]=4 8220 B10R1.2 [13CH3]Oc1cccc(c1Cl)N 7a_100012002038_200025704644 [1,1,0,0,0,0|2,0,0]=4 8221 B10R1.2 [13CH3]Oc1cccc(c1F)Br 34a_100009817021_200025704644 [1,1,0,0,0,0|2,0,0]=4 8222 B10R1.2 [13CH3]Oc1cccc(c1F)Br 7a_100009817021_200025704644 [1,1,0,0,0,0|2,0,0]=4 8223 B10R1.2 [13CH3]Oc1cccc(c1F)Cl 34a_100000687438_200025704644 [1,1,0,0,0,0|2,0,0]=4 8224 B10R1.2 [13CH3]Oc1cccc(c1F)Cl 7a_100000687438_200025704644 [1,1,0,0,0,0|2,0,0]=4 8225 B10R1.2 [13CH3]Oc1cccc(c1F)F 34a_100000751161_200025704644 [1,1,0,0,0,0|2,0,0]=4 8226 B10R1.2 [13CH3]Oc1cccc(c1F)F 7a_100000751161_200025704644 [1,1,0,0,0,0|2,0,0]=4 8227 B10R1.2 [13CH3]Oc1cccc(c1I)Br 34a_100010187912_200025704644 [1,1,0,0,0,0|2,0,0]=4 8228 B10R1.2 [13CH3]Oc1cccc(c1I)Br 7a_100010187912_200025704644 [1,1,0,0,0,0|2,0,0]=4 8229 B10R1.2 [13CH3]Oc1cccc(c1I)Cl 34a_100000050174_200025704644 [1,1,0,0,0,0|2,0,0]=4 8230 B10R1.2 [13CH3]Oc1cccc(c1I)Cl 7a_100000050174_200025704644 [1,1,0,0,0,0|2,0,0]=4 8231 B10R1.2 [13CH3]Oc1cccc(c1I)F 34a_100000690913_200025704644 [1,1,0,0,0,0|2,0,0]=4 8232 B10R1.2 [13CH3]Oc1cccc(c1I)F 7a_100000690913_200025704644 [1,1,0,0,0,0|2,0,0]=4 8233 B10R1.2 [13CH3]Oc1cccc(c1N)Br 34a_100011934926_200025704644 [1,1,0,0,0,0|2,0,0]=4 8234 B10R1.2 [13CH3]Oc1cccc(c1N)Br 7a_100011934926_200025704644 [1,1,0,0,0,0|2,0,0]=4 8235 B10R1.2 [13CH3]Oc1cccc(c1N)Cl 34a_100012022510_200025704644 [1,1,0,0,0,0|2,0,0]=4 8236 B10R1.2 [13CH3]Oc1cccc(c1N)Cl 7a_100012022510_200025704644 [1,1,0,0,0,0|2,0,0]=4 8237 B10R1.2 [13CH3]Oc1cccc(c1N)F 34a_100020591140_200025704644 [1,1,0,0,0,0|2,0,0]=4 8238 B10R1.2 [13CH3]Oc1cccc(c1N)F 7a_100020591140_200025704644 [1,1,0,0,0,0|2,0,0]=4 8239 B10R1.2 [13CH3]Oc1cccc(c1N)I 34a_200000049512_200025704644 [1,1,0,0,0,0|2,0,0]=4 8240 B10R1.2 [13CH3]Oc1cccc(c1N)I 7a_200000049512_200025704644 [1,1,0,0,0,0|2,0,0]=4 8241 B10R1.2 [13CH3]Oc1cccc(c1N)N 34a_100000033209_200025704644 [1,1,0,0,0,0|2,0,0]=4 8242 B10R1.2 [13CH3]Sc1cccc(c1Br)Br 62a_100010175083_200025704644 [1,1,0,0,0,0|2,0,0]=4 8243 B10R1.2 [13CH3]Sc1cccc(c1Br)Br 62a_200025704644_100010175083 [1,1,0,0,0,0|2,0,0]=4 8244 B10R1.2 [13CH3]Sc1cccc(c1Br)Cl 62a_100014021842_200025704644 [1,1,0,0,0,0|2,0,0]=4 8245 B10R1.2 [13CH3]Sc1cccc(c1Br)Cl 62a_200025704644_100014021842 [1,1,0,0,0,0|2,0,0]=4 8246 B10R1.2 [13CH3]Sc1cccc(c1Br)F 62a_100010202630_200025704644 [1,1,0,0,0,0|2,0,0]=4 8247 B10R1.2 [13CH3]Sc1cccc(c1Br)F 62a_200025704644_100010202630 [1,1,0,0,0,0|2,0,0]=4 8248 B10R1.2 [13CH3]Sc1cccc(c1Br)O 62a_100010187914_200025704644 [1,1,0,0,0,0|2,0,0]=4 8249 B10R1.2 [13CH3]Sc1cccc(c1Br)O 62a_200025704644_100010187914 [1,1,0,0,0,0|2,0,0]=4 8250 B10R1.2 [13CH3]Sc1cccc(c1Cl)Br 62a_100010142854_200025704644 [1,1,0,0,0,0|2,0,0]=4 8251 B10R1.2 [13CH3]Sc1cccc(c1Cl)Br 62a_200025704644_100010142854 [1,1,0,0,0,0|2,0,0]=4 8252 B10R1.2 [13CH3]Sc1cccc(c1Cl)Cl 62a_100011215384_200025704644 [1,1,0,0,0,0|2,0,0]=4 8253 B10R1.2 [13CH3]Sc1cccc(c1Cl)Cl 62a_200025704644_100011215384 [1,1,0,0,0,0|2,0,0]=4 8254 B10R1.2 [13CH3]Sc1cccc(c1Cl)F 62a_200010234923_200025704644 [1,1,0,0,0,0|2,0,0]=4 8255 B10R1.2 [13CH3]Sc1cccc(c1Cl)F 62a_200025704644_200010234923 [1,1,0,0,0,0|2,0,0]=4 8256 B10R1.2 [13CH3]Sc1cccc(c1Cl)O 62a_200025704644_100000049636 [1,1,0,0,0,0|2,0,0]=4 8257 B10R1.2 [13CH3]Sc1cccc(c1F)Br 62a_100000702267_200025704644 [1,1,0,0,0,0|2,0,0]=4 8258 B10R1.2 [13CH3]Sc1cccc(c1F)Br 62a_200025704644_100000702267 [1,1,0,0,0,0|2,0,0]=4 8259 B10R1.2 [13CH3]Sc1cccc(c1F)Cl 62a_100011217346_200025704644 [1,1,0,0,0,0|2,0,0]=4 8260 B10R1.2 [13CH3]Sc1cccc(c1F)Cl 62a_200025704644_100011217346 [1,1,0,0,0,0|2,0,0]=4 8261 B10R1.2 [13CH3]Sc1cccc(c1F)F 62a_100000694657_200025704644 [1,1,0,0,0,0|2,0,0]=4 8262 B10R1.2 [13CH3]Sc1cccc(c1F)F 62a_200025704644_100000694657 [1,1,0,0,0,0|2,0,0]=4 8263 B10R1.2 [13CH3]Sc1cccc(c1F)N 62a_100011935091_200025704644 [1,1,0,0,0,0|2,0,0]=4 8264 B10R1.2 [13CH3]Sc1cccc(c1F)N 62a_200025704644_100011935091 [1,1,0,0,0,0|2,0,0]=4 8265 B10R1.2 [13CH3]Sc1cccc(c1F)O 62a_100009817021_200025704644 [1,1,0,0,0,0|2,0,0]=4 8266 B10R1.2 [13CH3]Sc1cccc(c1F)O 62a_200025704644_100009817021 [1,1,0,0,0,0|2,0,0]=4 8267 B10R1.2 [13CH3]Sc1cccc(c1N)Br 62a_100010146558_200025704644 [1,1,0,0,0,0|2,0,0]=4 8268 B10R1.2 [13CH3]Sc1cccc(c1N)Br 62a_200025704644_100010146558 [1,1,0,0,0,0|2,0,0]=4 8269 B10R1.2 [13CH3]Sc1cccc(c1N)Cl 62a_100010190421_200025704644 [1,1,0,0,0,0|2,0,0]=4 8270 B10R1.2 [13CH3]Sc1cccc(c1N)Cl 62a_200025704644_100010190421 [1,1,0,0,0,0|2,0,0]=4 8271 B10R1.2 [13CH3]Sc1cccc(c1N)F 62a_100000042321_200025704644 [1,1,0,0,0,0|2,0,0]=4 8272 B10R1.2 [13CH3]Sc1cccc(c1N)F 62a_200025704644_100000042321 [1,1,0,0,0,0|2,0,0]=4 8273 B10R1.2 [13CH3]Sc1cccc(c1N)N 62a_100015191791_200025704644 [1,1,0,0,0,0|2,0,0]=4 8274 B10R1.2 [13CH3]Sc1cccc(c1N)O 62a_200025704644_100011934926 [1,1,0,0,0,0|2,0,0]=4 8275 B10R1.2 [13CH3]Sc1cccc(c1O)Br 62a_100010084509_200025704644 [1,1,0,0,0,0|1,0,0]=3 8276 B10R1.2 [13CH3]Sc1cccc(c1O)Br 62a_200025704644_100010084509 [1,1,0,0,0,0|1,0,0]=3 8277 B10R1.2 [13CH3]Sc1cccc(c1O)Cl 62a_100010202889_200025704644 [1,1,0,0,0,0|1,0,0]=3 8278 B10R1.2 [13CH3]Sc1cccc(c1O)Cl 62a_200025704644_100010202889 [1,1,0,0,0,0|1,0,0]=3 8279 B10R1.2 [13CH3]Sc1cccc(c1O)F 62a_100009813666_200025704644 [1,1,0,0,0,0|1,0,0]=3 8280 B10R1.2 [13CH3]Sc1cccc(c1O)F 62a_200025704644_100009813666 [1,1,0,0,0,0|1,0,0]=3 8281 B10R1.2 [13CH3]Sc1cccc(c1O)N 62a_100011934915_200025704644 [1,1,0,0,0,0|1,0,0]=3 8282 B10R1.2 [13CH3]Sc1cccc(c1O)N 62a_200025704644_100010084371 [1,1,0,0,0,0|1,0,0]=3 8283 B10R1.2 [13CH3]Sc1cccc(c1O)O 62a_200025704644_100009815950 [1,1,0,0,0,0|1,0,0]=3 8284 B10R1.2 [13CH3]Sc1ccnc(c1O)Cl 62a_200025704644_100010067911 [1,1,0,0,0,0|2,0,0]=4 8285 B10R1.2 [13CH3]Sc1cncc(c1O)N 62a_100000694263_200025704644 [1,1,0,0,0,0|2,0,0]=4 8286 B10R1.2 [13CH3]Sc1cncc(c1O)N 62a_200025704644_100000694263 [1,1,0,0,0,0|2,0,0]=4 8287 B10R1.2 [13CH3]Sc1nccc(c1O)F 62a_200025704644_100009867227 [1,1,0,0,0,0|2,0,0]=4 8288 B10R1.2 [13CH3]Sc1nccc(c1O)N 62a_200025704644_100009844647 [1,1,0,0,0,0|2,0,0]=4 8289 B10R1.20 C#Cc1ccccc1NC 34a_100011470550_200000210301 [1,1,0,0,0,0|2,0,0]=4 8290 B10R1.20 C#Cc1ccccc1N[13CH3] 34a_100011470550_200025704644 [1,1,0,0,0,0|2,0,0]=4 8291 B10R1.20 C#Cc1ccccc1OC 34a_200011470546_200000210301 [1,1,0,0,0,0|0,0,2]=4 8292 B10R1.20 C#Cc1ccccc1OC 7a_200011470546_200000210301 [1,1,0,0,0,0|0,0,2]=4 8293 B10R1.20 C#Cc1ccccc1O[13CH3] 34a_200011470546_200025704644 [1,1,0,0,0,0|0,0,2]=4 8294 B10R1.20 C#Cc1ccccc1O[13CH3] 7a_200011470546_200025704644 [1,1,0,0,0,0|0,0,2]=4 8295 B10R1.20 C=Cc1ccccc1CC 271570a_100011290941_100011215823 [1,1,0,0,0,0|1,0,0]=3 8296 B10R1.20 C=Cc1ccccc1CN 271570a_100011290941_100000689332 [1,1,0,0,0,0|2,0,0]=4 8297 B10R1.20 C=Cc1ccccc1CO 271570a_100011290941_100000187465 [1,1,0,0,0,0|0,0,2]=4 8298 B10R1.20 C=Cc1ccccc1NC 271570a_100011290941_100020606079 [1,1,0,0,0,0|2,0,0]=4 8299 B10R1.20 C=Cc1ccccc1NC 34a_100012022501_200000210301 [1,1,0,0,0,0|2,0,0]=4 8300 B10R1.20 C=Cc1ccccc1N[13CH3] 34a_100012022501_200025704644 [1,1,0,0,0,0|2,0,0]=4 8301 B10R1.20 C=Cc1ccccc1OC 271570a_100011290941_100000174000 [1,1,0,0,0,0|0,0,2]=4 8302 B10R1.20 C=Cc1ccccc1SC 271570a_100011290941_100011217816 [1,1,0,0,0,0|2,0,0]=4 8303 B10R1.20 C=Cc1ccccc1SC 62a_100011218376_200000210301 [1,1,0,0,0,0|2,0,0]=4 8304 B10R1.20 C=Cc1ccccc1SC 62a_200000210301_100011218376 [1,1,0,0,0,0|2,0,0]=4 8305 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_100011218376_200025704644 [1,1,0,0,0,0|2,0,0]=4 8306 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_200025704644_100011218376 [1,1,0,0,0,0|2,0,0]=4 8307 B10R1.20 C=Cc1cccnc1CC 271570a_100011290941_100009877225 [1,1,0,0,0,0|2,0,0]=4 8308 B10R1.20 C=Cc1ccncc1CC 271570a_100011290941_100025704421 [1,1,0,0,0,0|2,0,0]=4 8309 B10R1.20 C=Cc1cnccc1CC 271570a_100011290941_100009819861 [1,1,0,0,0,0|2,0,0]=4 8310 B10R1.20 CCc1ccccc1NC 2230a_100000212081_200000210301 [1,1,0,0,0,0|1,0,0]=3 8311 B10R1.20 CCc1ccccc1NC 34a_100000212081_200000210301 [1,1,0,0,0,0|1,0,0]=3 8312 B10R1.20 CCc1ccccc1NC 7a_100000212081_200000210301 [1,1,0,0,0,0|1,0,0]=3 8313 B10R1.20 CCc1ccccc1N[13CH3] 2230a_100000212081_200025704644 [1,1,0,0,0,0|1,0,0]=3 8314 B10R1.20 CCc1ccccc1N[13CH3] 34a_100000212081_200025704644 [1,1,0,0,0,0|1,0,0]=3 8315 B10R1.20 CCc1ccccc1N[13CH3] 7a_100000212081_200025704644 [1,1,0,0,0,0|1,0,0]=3 8316 B10R1.20 CCc1ccccc1OC 34a_100000210936_200000210301 [1,1,0,0,0,0|0,0,0]=2 8317 B10R1.20 CCc1ccccc1OC 7a_100000210936_200000210301 [1,1,0,0,0,0|0,0,0]=2 8318 B10R1.20 CCc1ccccc1O[13CH3] 34a_100000210936_200025704644 [1,1,0,0,0,0|0,0,0]=2 8319 B10R1.20 CCc1ccccc1O[13CH3] 7a_100000210936_200025704644 [1,1,0,0,0,0|0,0,0]=2 8320 B10R1.20 CCc1ccccc1SC 62a_100011215823_200000210301 [1,1,0,0,0,0|0,1,0]=3 8321 B10R1.20 CCc1ccccc1SC 62a_200000210301_100011215823 [1,1,0,0,0,0|0,1,0]=3 8322 B10R1.20 CCc1ccccc1S[13CH3] 62a_100011215823_200025704644 [1,1,0,0,0,0|0,1,0]=3 8323 B10R1.20 CCc1ccccc1S[13CH3] 62a_200025704644_100011215823 [1,1,0,0,0,0|0,1,0]=3 8324 B10R1.20 CCc1ccncc1SC 62a_100009819861_200000210301 [1,1,0,0,0,0|1,1,0]=4 8325 B10R1.20 CCc1ccncc1SC 62a_200000210301_100009819861 [1,1,0,0,0,0|1,1,0]=4 8326 B10R1.20 CCc1ccncc1S[13CH3] 62a_100009819861_200025704644 [1,1,0,0,0,0|1,1,0]=4 8327 B10R1.20 CCc1ccncc1S[13CH3] 62a_200025704644_100009819861 [1,1,0,0,0,0|1,1,0]=4 8328 B10R1.20 CCc1cnccc1SC 62a_100025704421_200000210301 [1,1,0,0,0,0|1,1,0]=4 8329 B10R1.20 CCc1cnccc1SC 62a_200000210301_100025704421 [1,1,0,0,0,0|1,1,0]=4 8330 B10R1.20 CCc1cnccc1S[13CH3] 62a_100025704421_200025704644 [1,1,0,0,0,0|1,1,0]=4 8331 B10R1.20 CCc1cnccc1S[13CH3] 62a_200025704644_100025704421 [1,1,0,0,0,0|1,1,0]=4 8332 B10R1.20 CCc1ncccc1SC 62a_100009877225_200000210301 [1,1,0,0,0,0|1,1,0]=4 8333 B10R1.20 CCc1ncccc1SC 62a_200000210301_100009877225 [1,1,0,0,0,0|1,1,0]=4 8334 B10R1.20 CCc1ncccc1S[13CH3] 62a_100009877225_200025704644 [1,1,0,0,0,0|1,1,0]=4 8335 B10R1.20 CCc1ncccc1S[13CH3] 62a_200025704644_100009877225 [1,1,0,0,0,0|1,1,0]=4 8336 B10R1.20 CNc1ccccc1C#N 34a_100000211148_200000210301 [1,1,0,0,0,0|2,0,0]=4 8337 B10R1.20 CNc1ccccc1CO 34a_100000212039_200000210301 [1,1,0,0,0,0|1,0,0]=3 8338 B10R1.20 CNc1ccccc1OC 34a_100000033821_200000210301 [1,1,0,0,0,0|1,0,0]=3 8339 B10R1.20 CNc1ccccc1OC 34a_100000210025_200000210301 [1,1,0,0,0,0|1,0,0]=3 8340 B10R1.20 CNc1ccccc1O[13CH3] 34a_100000033821_200025704644 [1,1,0,0,0,0|1,0,0]=3 8341 B10R1.20 CNc1ccccc1SC 34a_100000211160_200000210301 [1,1,0,0,0,0|1,1,0]=4 8342 B10R1.20 CNc1ccccc1SC 62a_100020606079_200000210301 [1,1,0,0,0,0|1,1,0]=4 8343 B10R1.20 CNc1ccccc1SC 62a_200000210301_100020606079 [1,1,0,0,0,0|1,1,0]=4 8344 B10R1.20 CNc1ccccc1S[13CH3] 62a_100020606079_200025704644 [1,1,0,0,0,0|1,1,0]=4 8345 B10R1.20 CNc1ccccc1S[13CH3] 62a_200025704644_100020606079 [1,1,0,0,0,0|1,1,0]=4 8346 B10R1.20 CNc1ccncc1CO 27a_100102657272_100000117392 [1,1,0,0,0,0|2,0,0]=4 8347 B10R1.20 COc1ccccc1C#N 34a_100000211048_200000210301 [1,1,0,0,0,0|1,0,1]=4 8348 B10R1.20 COc1ccccc1C#N 7a_100000211048_200000210301 [1,1,0,0,0,0|1,0,1]=4 8349 B10R1.20 COc1ccccc1CN 34a_100000185550_200000210301 [1,1,0,0,0,0|1,0,0]=3 8350 B10R1.20 COc1ccccc1CO 34a_100011216872_200000210301 [1,1,0,0,0,0|1,0,0]=3 8351 B10R1.20 COc1ccccc1N[13CH3] 34a_100000210025_200025704644 [1,1,0,0,0,0|1,0,0]=3 8352 B10R1.20 COc1ccccc1OC 34a_100000210385_200000210301 [1,1,0,0,0,0|1,0,0]=3 8353 B10R1.20 COc1ccccc1O[13CH3] 34a_100000210385_200025704644 [1,1,0,0,0,0|1,0,0]=3 8354 B10R1.20 COc1ccccc1SC 34a_100011216402_200000210301 [1,1,0,0,0,0|1,0,0]=3 8355 B10R1.20 COc1ccccc1SC 62a_100000210334_200000210301 [1,1,0,0,0,0|1,0,0]=3 8356 B10R1.20 COc1ccccc1SC 62a_200000210301_100000210334 [1,1,0,0,0,0|1,0,0]=3 8357 B10R1.20 COc1ccccc1S[13CH3] 62a_100000210334_200025704644 [1,1,0,0,0,0|1,0,0]=3 8358 B10R1.20 COc1ccccc1S[13CH3] 62a_200025704644_100000210334 [1,1,0,0,0,0|1,0,0]=3 8359 B10R1.20 COc1cccnc1CBr 34a_200020655725_200000210301 [1,1,0,0,0,0|2,0,0]=4 8360 B10R1.20 COc1cccnc1CBr 7a_200020655725_200000210301 [1,1,0,0,0,0|2,0,0]=4 8361 B10R1.20 COc1cccnc1CO 34a_100000731849_200000210301 [1,1,0,0,0,0|2,0,0]=4 8362 B10R1.20 COc1cccnc1OC 34a_100000698397_200000210301 [1,1,0,0,0,0|2,0,0]=4 8363 B10R1.20 COc1cccnc1OC 34a_100025773188_200000210301 [1,1,0,0,0,0|2,0,0]=4 8364 B10R1.20 COc1cccnc1OC 7a_100000698397_200000210301 [1,1,0,0,0,0|2,0,0]=4 8365 B10R1.20 COc1cccnc1O[13CH3] 34a_100025773188_200025704644 [1,1,0,0,0,0|2,0,0]=4 8366 B10R1.20 COc1cccnc1SC 62a_100000767102_200000210301 [1,1,0,0,0,0|2,0,0]=4 8367 B10R1.20 COc1cccnc1SC 62a_200000210301_100000690851 [1,1,0,0,0,0|2,0,0]=4 8368 B10R1.20 COc1cccnc1S[13CH3] 62a_100000767102_200025704644 [1,1,0,0,0,0|2,0,0]=4 8369 B10R1.20 COc1cccnc1S[13CH3] 62a_200025704644_100000690851 [1,1,0,0,0,0|2,0,0]=4 8370 B10R1.20 COc1ccncc1OC 34a_100000101186_200000210301 [1,1,0,0,0,0|2,0,0]=4 8371 B10R1.20 COc1ccncc1O[13CH3] 34a_100000101186_200025704644 [1,1,0,0,0,0|2,0,0]=4 8372 B10R1.20 COc1ccncc1SC 62a_100011997281_200000210301 [1,1,0,0,0,0|2,0,0]=4 8373 B10R1.20 COc1ccncc1SC 62a_200000210301_100011997281 [1,1,0,0,0,0|2,0,0]=4 8374 B10R1.20 COc1ccncc1S[13CH3] 62a_100011997281_200025704644 [1,1,0,0,0,0|2,0,0]=4 8375 B10R1.20 COc1ccncc1S[13CH3] 62a_200025704644_100011997281 [1,1,0,0,0,0|2,0,0]=4 8376 B10R1.20 COc1cnccc1CO 34a_100000078615_200000210301 [1,1,0,0,0,0|2,0,0]=4 8377 B10R1.20 COc1cnccc1SC 62a_100016988167_200000210301 [1,1,0,0,0,0|2,0,0]=4 8378 B10R1.20 COc1cnccc1SC 62a_200000210301_100016988167 [1,1,0,0,0,0|2,0,0]=4 8379 B10R1.20 COc1cnccc1S[13CH3] 62a_100016988167_200025704644 [1,1,0,0,0,0|2,0,0]=4 8380 B10R1.20 COc1cnccc1S[13CH3] 62a_200025704644_100016988167 [1,1,0,0,0,0|2,0,0]=4 8381 B10R1.20 COc1ncccc1O[13CH3] 34a_100000698397_200025704644 [1,1,0,0,0,0|2,0,0]=4 8382 B10R1.20 COc1ncccc1O[13CH3] 7a_100000698397_200025704644 [1,1,0,0,0,0|2,0,0]=4 8383 B10R1.20 COc1ncccc1SC 62a_100000047025_200000210301 [1,1,0,0,0,0|2,0,0]=4 8384 B10R1.20 COc1ncccc1SC 62a_200000210301_100000047025 [1,1,0,0,0,0|2,0,0]=4 8385 B10R1.20 COc1ncccc1S[13CH3] 62a_100000047025_200025704644 [1,1,0,0,0,0|2,0,0]=4 8386 B10R1.20 COc1ncccc1S[13CH3] 62a_200025704644_100000047025 [1,1,0,0,0,0|2,0,0]=4 8387 B10R1.20 CSc1ccccc1C#N 62a_200000210301_100000188569 [1,1,0,0,0,0|2,0,0]=4 8388 B10R1.20 CSc1ccccc1C=O 62a_100000210073_200000210301 [1,1,0,0,0,0|1,0,1]=4 8389 B10R1.20 CSc1ccccc1C=O 62a_200000210301_100000210073 [1,1,0,0,0,0|1,0,1]=4 8390 B10R1.20 CSc1ccccc1CN 62a_100000689332_200000210301 [1,1,0,0,0,0|1,1,0]=4 8391 B10R1.20 CSc1ccccc1CN 62a_200000210301_100000689332 [1,1,0,0,0,0|1,1,0]=4 8392 B10R1.20 CSc1ccccc1CO 62a_100000187465_200000210301 [1,1,0,0,0,0|1,0,0]=3 8393 B10R1.20 CSc1ccccc1CO 62a_200000210301_100000187465 [1,1,0,0,0,0|1,0,0]=3 8394 B10R1.20 CSc1ccccc1NN 62a_100000241748_200000210301 [1,1,0,0,0,0|2,0,0]=4 8395 B10R1.20 CSc1ccccc1NN 62a_200000210301_100000241748 [1,1,0,0,0,0|2,0,0]=4 8396 B10R1.20 CSc1ccccc1N[13CH3] 34a_100000211160_200025704644 [1,1,0,0,0,0|1,1,0]=4 8397 B10R1.20 CSc1ccccc1O[13CH3] 34a_100011216402_200025704644 [1,1,0,0,0,0|1,0,0]=3 8398 B10R1.20 CSc1ccccc1SC 62a_100011217816_200000210301 [1,1,0,0,0,0|1,1,0]=4 8399 B10R1.20 CSc1ccccc1SC 62a_200000210301_100011217816 [1,1,0,0,0,0|1,1,0]=4 8400 B10R1.20 CSc1ccccc1S[13CH3] 62a_100011217816_200025704644 [1,1,0,0,0,0|1,1,0]=4 8401 B10R1.20 CSc1ccccc1S[13CH3] 62a_200025704644_100011217816 [1,1,0,0,0,0|1,1,0]=4 8402 B10R1.20 CSc1cccnc1CO 62a_100011996772_200000210301 [1,1,0,0,0,0|2,0,0]=4 8403 B10R1.20 CSc1cccnc1CO 62a_200000210301_100011996772 [1,1,0,0,0,0|2,0,0]=4 8404 B10R1.20 CSc1ccncc1CO 62a_100000117392_200000210301 [1,1,0,0,0,0|2,0,0]=4 8405 B10R1.20 CSc1ccncc1CO 62a_200000210301_100000117392 [1,1,0,0,0,0|2,0,0]=4 8406 B10R1.20 CSc1cnccc1CO 62a_100009873359_200000210301 [1,1,0,0,0,0|2,0,0]=4 8407 B10R1.20 CSc1cnccc1CO 62a_200000210301_100009873359 [1,1,0,0,0,0|2,0,0]=4 8408 B10R1.20 CSc1ncccc1CO 62a_100000748726_200000210301 [1,1,0,0,0,0|2,0,0]=4 8409 B10R1.20 CSc1ncccc1CO 62a_200000210301_100000748726 [1,1,0,0,0,0|2,0,0]=4 8410 B10R1.20 [13CH3]Nc1ccccc1C#N 34a_100000211148_200025704644 [1,1,0,0,0,0|2,0,0]=4 8411 B10R1.20 [13CH3]Nc1ccccc1CO 34a_100000212039_200025704644 [1,1,0,0,0,0|1,0,0]=3 8412 B10R1.20 [13CH3]Oc1ccccc1C#N 34a_100000211048_200025704644 [1,1,0,0,0,0|1,0,1]=4 8413 B10R1.20 [13CH3]Oc1ccccc1C#N 7a_100000211048_200025704644 [1,1,0,0,0,0|1,0,1]=4 8414 B10R1.20 [13CH3]Oc1ccccc1CN 34a_100000185550_200025704644 [1,1,0,0,0,0|1,0,0]=3 8415 B10R1.20 [13CH3]Oc1ccccc1CO 34a_100011216872_200025704644 [1,1,0,0,0,0|1,0,0]=3 8416 B10R1.20 [13CH3]Oc1cccnc1CBr 34a_200020655725_200025704644 [1,1,0,0,0,0|2,0,0]=4 8417 B10R1.20 [13CH3]Oc1cccnc1CBr 7a_200020655725_200025704644 [1,1,0,0,0,0|2,0,0]=4 8418 B10R1.20 [13CH3]Oc1cccnc1CO 34a_100000731849_200025704644 [1,1,0,0,0,0|2,0,0]=4 8419 B10R1.20 [13CH3]Oc1cnccc1CO 34a_100000078615_200025704644 [1,1,0,0,0,0|2,0,0]=4 8420 B10R1.20 [13CH3]Sc1ccccc1C#N 62a_200025704644_100000188569 [1,1,0,0,0,0|2,0,0]=4 8421 B10R1.20 [13CH3]Sc1ccccc1C=O 62a_100000210073_200025704644 [1,1,0,0,0,0|1,0,1]=4 8422 B10R1.20 [13CH3]Sc1ccccc1C=O 62a_200025704644_100000210073 [1,1,0,0,0,0|1,0,1]=4 8423 B10R1.20 [13CH3]Sc1ccccc1CN 62a_100000689332_200025704644 [1,1,0,0,0,0|1,1,0]=4 8424 B10R1.20 [13CH3]Sc1ccccc1CN 62a_200025704644_100000689332 [1,1,0,0,0,0|1,1,0]=4 8425 B10R1.20 [13CH3]Sc1ccccc1CO 62a_100000187465_200025704644 [1,1,0,0,0,0|1,0,0]=3 8426 B10R1.20 [13CH3]Sc1ccccc1CO 62a_200025704644_100000187465 [1,1,0,0,0,0|1,0,0]=3 8427 B10R1.20 [13CH3]Sc1ccccc1NN 62a_100000241748_200025704644 [1,1,0,0,0,0|2,0,0]=4 8428 B10R1.20 [13CH3]Sc1ccccc1NN 62a_200025704644_100000241748 [1,1,0,0,0,0|2,0,0]=4 8429 B10R1.20 [13CH3]Sc1cccnc1CO 62a_100011996772_200025704644 [1,1,0,0,0,0|2,0,0]=4 8430 B10R1.20 [13CH3]Sc1cccnc1CO 62a_200025704644_100011996772 [1,1,0,0,0,0|2,0,0]=4 8431 B10R1.20 [13CH3]Sc1ccncc1CO 62a_100000117392_200025704644 [1,1,0,0,0,0|2,0,0]=4 8432 B10R1.20 [13CH3]Sc1ccncc1CO 62a_200025704644_100000117392 [1,1,0,0,0,0|2,0,0]=4 8433 B10R1.20 [13CH3]Sc1cnccc1CO 62a_100009873359_200025704644 [1,1,0,0,0,0|2,0,0]=4 8434 B10R1.20 [13CH3]Sc1cnccc1CO 62a_200025704644_100009873359 [1,1,0,0,0,0|2,0,0]=4 8435 B10R1.20 [13CH3]Sc1ncccc1CO 62a_100000748726_200025704644 [1,1,0,0,0,0|2,0,0]=4 8436 B10R1.20 [13CH3]Sc1ncccc1CO 62a_200025704644_100000748726 [1,1,0,0,0,0|2,0,0]=4 8437 B10R1.25 C=Cc1ccc(cc1O)Br 271570a_100011290941_100012344904 [1,1,0,0,0,0|0,0,2]=4 8438 B10R1.25 C=Cc1ccc(cc1O)C 271570a_100011290941_100012002257 [1,1,0,0,0,0|0,0,2]=4 8439 B10R1.25 C=Cc1ccc(cc1O)Cl 271570a_100011290941_100000050036 [1,1,0,0,0,0|0,0,2]=4 8440 B10R1.25 C=Cc1ccc(cc1O)F 271570a_100011290941_100000690578 [1,1,0,0,0,0|0,0,2]=4 8441 B10R1.25 C=Cc1ccc(cc1O)O 271570a_100011290941_100009813921 [1,1,0,0,0,0|0,0,2]=4 8442 B10R1.25 CCc1ccc(cc1F)O 271570a_203496583355_200010071577 [1,1,0,0,0,0|1,0,0]=3 8443 B10R1.25 CCc1ccc(cc1N)O 271570a_203496583355_100012354963 [1,1,0,0,0,0|1,0,0]=3 8444 B10R1.25 CCc1cnc(cc1O)C 271570a_203496583355_100010291839 [1,1,0,0,0,0|1,0,0]=3 8445 B10R1.25 CCc1cnc(nc1O)C 271570a_203496583355_200000069817 [1,1,0,0,0,0|2,0,0]=4 8446 B10R1.25 CCc1ncc(cc1O)N 271570a_203496583355_100013085292 [1,1,0,0,0,0|1,0,0]=3 8447 B10R1.25 CNc1ccc(cc1Br)Br 34a_100000211012_200000210301 [1,1,0,0,0,0|2,0,0]=4 8448 B10R1.25 CNc1ccc(cc1Br)C 34a_100000210942_200000210301 [1,1,0,0,0,0|2,0,0]=4 8449 B10R1.25 CNc1ccc(cc1Br)Cl 34a_100000752454_200000210301 [1,1,0,0,0,0|2,0,0]=4 8450 B10R1.25 CNc1ccc(cc1Br)F 34a_100000738039_200000210301 [1,1,0,0,0,0|2,0,0]=4 8451 B10R1.25 CNc1ccc(cc1Br)O 34a_100012001276_200000210301 [1,1,0,0,0,0|2,0,0]=4 8452 B10R1.25 CNc1ccc(cc1C)Br 34a_100000211769_200000210301 [1,1,0,0,0,0|2,0,0]=4 8453 B10R1.25 CNc1ccc(cc1C)Br 7a_100000211769_200000210301 [1,1,0,0,0,0|2,0,0]=4 8454 B10R1.25 CNc1ccc(cc1C)C 34a_100000736561_200000210301 [1,1,0,0,0,0|2,0,0]=4 8455 B10R1.25 CNc1ccc(cc1C)C 7a_100000736561_200000210301 [1,1,0,0,0,0|2,0,0]=4 8456 B10R1.25 CNc1ccc(cc1C)Cl 34a_100000210418_200000210301 [1,1,0,0,0,0|2,0,0]=4 8457 B10R1.25 CNc1ccc(cc1C)Cl 7a_100000210418_200000210301 [1,1,0,0,0,0|2,0,0]=4 8458 B10R1.25 CNc1ccc(cc1C)F 34a_100000211637_200000210301 [1,1,0,0,0,0|2,0,0]=4 8459 B10R1.25 CNc1ccc(cc1C)F 7a_100000211637_200000210301 [1,1,0,0,0,0|2,0,0]=4 8460 B10R1.25 CNc1ccc(cc1C)I 34a_100000184554_200000210301 [1,1,0,0,0,0|2,0,0]=4 8461 B10R1.25 CNc1ccc(cc1C)I 7a_100000184554_200000210301 [1,1,0,0,0,0|2,0,0]=4 8462 B10R1.25 CNc1ccc(cc1C)O 271570a_203496583355_100000221803 [1,1,0,0,0,0|2,0,0]=4 8463 B10R1.25 CNc1ccc(cc1C)O 34a_100000756630_200000210301 [1,1,0,0,0,0|2,0,0]=4 8464 B10R1.25 CNc1ccc(cc1Cl)Br 34a_100000211467_200000210301 [1,1,0,0,0,0|2,0,0]=4 8465 B10R1.25 CNc1ccc(cc1Cl)C 34a_100000210522_200000210301 [1,1,0,0,0,0|2,0,0]=4 8466 B10R1.25 CNc1ccc(cc1Cl)Cl 34a_100000185861_200000210301 [1,1,0,0,0,0|2,0,0]=4 8467 B10R1.25 CNc1ccc(cc1Cl)F 34a_100000212003_200000210301 [1,1,0,0,0,0|2,0,0]=4 8468 B10R1.25 CNc1ccc(cc1Cl)I 34a_100011218065_200000210301 [1,1,0,0,0,0|2,0,0]=4 8469 B10R1.25 CNc1ccc(cc1Cl)O 34a_100011215599_200000210301 [1,1,0,0,0,0|2,0,0]=4 8470 B10R1.25 CNc1ccc(cc1F)Br 34a_100000210722_200000210301 [1,1,0,0,0,0|2,0,0]=4 8471 B10R1.25 CNc1ccc(cc1F)C 34a_100000211023_200000210301 [1,1,0,0,0,0|2,0,0]=4 8472 B10R1.25 CNc1ccc(cc1F)Cl 34a_100000211020_200000210301 [1,1,0,0,0,0|2,0,0]=4 8473 B10R1.25 CNc1ccc(cc1F)F 34a_100000210720_200000210301 [1,1,0,0,0,0|2,0,0]=4 8474 B10R1.25 CNc1ccc(cc1F)I 34a_100011215594_200000210301 [1,1,0,0,0,0|2,0,0]=4 8475 B10R1.25 CNc1ccc(cc1F)O 271570a_203496583355_100000743884 [1,1,0,0,0,0|2,0,0]=4 8476 B10R1.25 CNc1ccc(cc1F)O 34a_100000759473_200000210301 [1,1,0,0,0,0|2,0,0]=4 8477 B10R1.25 CNc1ccc(cc1I)Br 34a_100000187925_200000210301 [1,1,0,0,0,0|2,0,0]=4 8478 B10R1.25 CNc1ccc(cc1I)C 34a_100011356834_200000210301 [1,1,0,0,0,0|2,0,0]=4 8479 B10R1.25 CNc1ccc(cc1I)Cl 34a_100000761889_200000210301 [1,1,0,0,0,0|2,0,0]=4 8480 B10R1.25 CNc1ccc(cc1I)F 34a_100000760547_200000210301 [1,1,0,0,0,0|2,0,0]=4 8481 B10R1.25 CNc1ccc(cc1I)O 34a_100010084370_200000210301 [1,1,0,0,0,0|2,0,0]=4 8482 B10R1.25 CNc1ccc(cc1N)O 271570a_203496583355_100000741790 [1,1,0,0,0,0|2,0,0]=4 8483 B10R1.25 CNc1ccc(cc1O)Br 34a_100000739049_200000210301 [1,1,0,0,0,0|1,0,0]=3 8484 B10R1.25 CNc1ccc(cc1O)C 271570a_203496583355_100000221369 [1,1,0,0,0,0|1,0,0]=3 8485 B10R1.25 CNc1ccc(cc1O)C 34a_100000211527_200000210301 [1,1,0,0,0,0|1,0,0]=3 8486 B10R1.25 CNc1ccc(cc1O)Cl 34a_100000185728_200000210301 [1,1,0,0,0,0|1,0,0]=3 8487 B10R1.25 CNc1ccc(cc1O)F 271570a_203496583355_100011246292 [1,1,0,0,0,0|1,0,0]=3 8488 B10R1.25 CNc1ccc(cc1O)F 34a_100000753323_200000210301 [1,1,0,0,0,0|1,0,0]=3 8489 B10R1.25 CNc1ccc(cc1O)O 34a_100000106777_200000210301 [1,1,0,0,0,0|1,0,0]=3 8490 B10R1.25 COc1c[nH]c(=O)cc1O 271570a_203496583355_100121573661 [1,1,0,0,0,0|2,0,0]=4 8491 B10R1.25 COc1ccc(cc1Br)Br 34a_100000188717_200000210301 [1,1,0,0,0,0|2,0,0]=4 8492 B10R1.25 COc1ccc(cc1Br)Br 7a_100000188717_200000210301 [1,1,0,0,0,0|2,0,0]=4 8493 B10R1.25 COc1ccc(cc1Br)C 34a_100000210800_200000210301 [1,1,0,0,0,0|2,0,0]=4 8494 B10R1.25 COc1ccc(cc1Br)C 7a_100000210800_200000210301 [1,1,0,0,0,0|2,0,0]=4 8495 B10R1.25 COc1ccc(cc1Br)Cl 34a_100000211998_200000210301 [1,1,0,0,0,0|2,0,0]=4 8496 B10R1.25 COc1ccc(cc1Br)Cl 7a_100000211998_200000210301 [1,1,0,0,0,0|2,0,0]=4 8497 B10R1.25 COc1ccc(cc1Br)F 34a_100000211999_200000210301 [1,1,0,0,0,0|2,0,0]=4 8498 B10R1.25 COc1ccc(cc1Br)F 7a_100000211999_200000210301 [1,1,0,0,0,0|2,0,0]=4 8499 B10R1.25 COc1ccc(cc1Br)I 34a_100012361655_200000210301 [1,1,0,0,0,0|2,0,0]=4 8500 B10R1.25 COc1ccc(cc1Br)I 7a_100012361655_200000210301 [1,1,0,0,0,0|2,0,0]=4 8501 B10R1.25 COc1ccc(cc1Br)N 34a_100011534360_200000210301 [1,1,0,0,0,0|2,0,0]=4 8502 B10R1.25 COc1ccc(cc1Br)N 7a_100011534360_200000210301 [1,1,0,0,0,0|2,0,0]=4 8503 B10R1.25 COc1ccc(cc1Br)O 271570a_203496583355_100011249507 [1,1,0,0,0,0|2,0,0]=4 8504 B10R1.25 COc1ccc(cc1C)Br 34a_100000186361_200000210301 [1,1,0,0,0,0|2,0,0]=4 8505 B10R1.25 COc1ccc(cc1C)Br 7a_100000186361_200000210301 [1,1,0,0,0,0|2,0,0]=4 8506 B10R1.25 COc1ccc(cc1C)C 34a_100000211776_200000210301 [1,1,0,0,0,0|2,0,0]=4 8507 B10R1.25 COc1ccc(cc1C)C 7a_100000211776_200000210301 [1,1,0,0,0,0|2,0,0]=4 8508 B10R1.25 COc1ccc(cc1C)Cl 34a_100000211091_200000210301 [1,1,0,0,0,0|2,0,0]=4 8509 B10R1.25 COc1ccc(cc1C)Cl 7a_100000211091_200000210301 [1,1,0,0,0,0|2,0,0]=4 8510 B10R1.25 COc1ccc(cc1C)F 34a_100000764316_200000210301 [1,1,0,0,0,0|2,0,0]=4 8511 B10R1.25 COc1ccc(cc1C)F 7a_100000764316_200000210301 [1,1,0,0,0,0|2,0,0]=4 8512 B10R1.25 COc1ccc(cc1C)I 34a_100011218673_200000210301 [1,1,0,0,0,0|2,0,0]=4 8513 B10R1.25 COc1ccc(cc1C)I 7a_100011218673_200000210301 [1,1,0,0,0,0|2,0,0]=4 8514 B10R1.25 COc1ccc(cc1C)N 34a_100011218179_200000210301 [1,1,0,0,0,0|2,0,0]=4 8515 B10R1.25 COc1ccc(cc1C)N 7a_100011218179_200000210301 [1,1,0,0,0,0|2,0,0]=4 8516 B10R1.25 COc1ccc(cc1C)O 271570a_203496583355_100011219705 [1,1,0,0,0,0|2,0,0]=4 8517 B10R1.25 COc1ccc(cc1Cl)Br 34a_100000186472_200000210301 [1,1,0,0,0,0|2,0,0]=4 8518 B10R1.25 COc1ccc(cc1Cl)Br 7a_100000186472_200000210301 [1,1,0,0,0,0|2,0,0]=4 8519 B10R1.25 COc1ccc(cc1Cl)C 34a_100000749699_200000210301 [1,1,0,0,0,0|2,0,0]=4 8520 B10R1.25 COc1ccc(cc1Cl)C 7a_100000749699_200000210301 [1,1,0,0,0,0|2,0,0]=4 8521 B10R1.25 COc1ccc(cc1Cl)Cl 34a_100015191787_200000210301 [1,1,0,0,0,0|2,0,0]=4 8522 B10R1.25 COc1ccc(cc1Cl)Cl 7a_100015191787_200000210301 [1,1,0,0,0,0|2,0,0]=4 8523 B10R1.25 COc1ccc(cc1Cl)F 34a_100000212004_200000210301 [1,1,0,0,0,0|2,0,0]=4 8524 B10R1.25 COc1ccc(cc1Cl)F 7a_100000212004_200000210301 [1,1,0,0,0,0|2,0,0]=4 8525 B10R1.25 COc1ccc(cc1Cl)I 34a_100012360047_200000210301 [1,1,0,0,0,0|2,0,0]=4 8526 B10R1.25 COc1ccc(cc1Cl)I 7a_100012360047_200000210301 [1,1,0,0,0,0|2,0,0]=4 8527 B10R1.25 COc1ccc(cc1Cl)N 34a_100000744943_200000210301 [1,1,0,0,0,0|2,0,0]=4 8528 B10R1.25 COc1ccc(cc1Cl)N 7a_100000744943_200000210301 [1,1,0,0,0,0|2,0,0]=4 8529 B10R1.25 COc1ccc(cc1Cl)O 271570a_203496583355_100012355395 [1,1,0,0,0,0|2,0,0]=4 8530 B10R1.25 COc1ccc(cc1F)Br 34a_100000185481_200000210301 [1,1,0,0,0,0|2,0,0]=4 8531 B10R1.25 COc1ccc(cc1F)Br 7a_100000185481_200000210301 [1,1,0,0,0,0|2,0,0]=4 8532 B10R1.25 COc1ccc(cc1F)C 34a_100011216688_200000210301 [1,1,0,0,0,0|2,0,0]=4 8533 B10R1.25 COc1ccc(cc1F)C 7a_100011216688_200000210301 [1,1,0,0,0,0|2,0,0]=4 8534 B10R1.25 COc1ccc(cc1F)Cl 34a_100000230166_200000210301 [1,1,0,0,0,0|2,0,0]=4 8535 B10R1.25 COc1ccc(cc1F)Cl 7a_100000230166_200000210301 [1,1,0,0,0,0|2,0,0]=4 8536 B10R1.25 COc1ccc(cc1F)F 34a_100000230127_200000210301 [1,1,0,0,0,0|2,0,0]=4 8537 B10R1.25 COc1ccc(cc1F)F 7a_100000230127_200000210301 [1,1,0,0,0,0|2,0,0]=4 8538 B10R1.25 COc1ccc(cc1F)I 34a_100011356965_200000210301 [1,1,0,0,0,0|2,0,0]=4 8539 B10R1.25 COc1ccc(cc1F)I 7a_100011356965_200000210301 [1,1,0,0,0,0|2,0,0]=4 8540 B10R1.25 COc1ccc(cc1F)N 34a_100011220035_200000210301 [1,1,0,0,0,0|2,0,0]=4 8541 B10R1.25 COc1ccc(cc1F)N 7a_100011220035_200000210301 [1,1,0,0,0,0|2,0,0]=4 8542 B10R1.25 COc1ccc(cc1F)O 271570a_203496583355_100000185480 [1,1,0,0,0,0|2,0,0]=4 8543 B10R1.25 COc1ccc(cc1I)Br 34a_100012355227_200000210301 [1,1,0,0,0,0|2,0,0]=4 8544 B10R1.25 COc1ccc(cc1I)Br 7a_100012355227_200000210301 [1,1,0,0,0,0|2,0,0]=4 8545 B10R1.25 COc1ccc(cc1I)C 34a_100000765521_200000210301 [1,1,0,0,0,0|2,0,0]=4 8546 B10R1.25 COc1ccc(cc1I)C 7a_100000765521_200000210301 [1,1,0,0,0,0|2,0,0]=4 8547 B10R1.25 COc1ccc(cc1I)Cl 34a_100011356953_200000210301 [1,1,0,0,0,0|2,0,0]=4 8548 B10R1.25 COc1ccc(cc1I)Cl 7a_100011356953_200000210301 [1,1,0,0,0,0|2,0,0]=4 8549 B10R1.25 COc1ccc(cc1I)F 34a_100012355409_200000210301 [1,1,0,0,0,0|2,0,0]=4 8550 B10R1.25 COc1ccc(cc1I)F 7a_100012355409_200000210301 [1,1,0,0,0,0|2,0,0]=4 8551 B10R1.25 COc1ccc(cc1I)I 7a_100010001573_200000210301 [1,1,0,0,0,0|2,0,0]=4 8552 B10R1.25 COc1ccc(cc1N)Br 34a_100000752626_200000210301 [1,1,0,0,0,0|2,0,0]=4 8553 B10R1.25 COc1ccc(cc1N)Br 7a_100000752626_200000210301 [1,1,0,0,0,0|2,0,0]=4 8554 B10R1.25 COc1ccc(cc1N)C 34a_100011215204_200000210301 [1,1,0,0,0,0|2,0,0]=4 8555 B10R1.25 COc1ccc(cc1N)C 7a_100011215204_200000210301 [1,1,0,0,0,0|2,0,0]=4 8556 B10R1.25 COc1ccc(cc1N)Cl 34a_100000210500_200000210301 [1,1,0,0,0,0|2,0,0]=4 8557 B10R1.25 COc1ccc(cc1N)Cl 7a_100000210500_200000210301 [1,1,0,0,0,0|2,0,0]=4 8558 B10R1.25 COc1ccc(cc1N)F 34a_100000759472_200000210301 [1,1,0,0,0,0|2,0,0]=4 8559 B10R1.25 COc1ccc(cc1N)F 7a_100000759472_200000210301 [1,1,0,0,0,0|2,0,0]=4 8560 B10R1.25 COc1ccc(cc1N)I 34a_100000753495_200000210301 [1,1,0,0,0,0|2,0,0]=4 8561 B10R1.25 COc1ccc(cc1N)I 7a_100000753495_200000210301 [1,1,0,0,0,0|2,0,0]=4 8562 B10R1.25 COc1ccc(cc1N)N 34a_100000725306_200000210301 [1,1,0,0,0,0|2,0,0]=4 8563 B10R1.25 COc1ccc(cc1N)O 271570a_203496583355_100000743470 [1,1,0,0,0,0|2,0,0]=4 8564 B10R1.25 COc1ccc(cc1O)Br 271570a_203496583355_100012351588 [1,1,0,0,0,0|1,0,0]=3 8565 B10R1.25 COc1ccc(cc1O)C 271570a_203496583355_100000186399 [1,1,0,0,0,0|1,0,0]=3 8566 B10R1.25 COc1ccc(cc1O)Cl 271570a_203496583355_100011215930 [1,1,0,0,0,0|1,0,0]=3 8567 B10R1.25 COc1ccc(cc1O)F 271570a_203496583355_100000171694 [1,1,0,0,0,0|1,0,0]=3 8568 B10R1.25 COc1ccc(cc1O)N 271570a_203496583355_100000187427 [1,1,0,0,0,0|1,0,0]=3 8569 B10R1.25 COc1ccc(cc1O)O 271570a_203496583355_100009816560 [1,1,0,0,0,0|1,0,0]=3 8570 B10R1.25 COc1ccc(cc1O)O 271570a_203496583355_100010084122 [1,1,0,0,0,0|1,0,0]=3 8571 B10R1.25 COc1ccc(nc1O)C 271570a_203496583355_100009820875 [1,1,0,0,0,0|2,0,0]=4 8572 B10R1.25 COc1ccc(nc1O)N 271570a_203496583355_100010172607 [1,1,0,0,0,0|2,0,0]=4 8573 B10R1.25 COc1cnc(cc1O)C 271570a_203496583355_100010109759 [1,1,0,0,0,0|2,0,0]=4 8574 B10R1.25 COc1cnc(cc1O)O 271570a_203496583355_100010264082 [1,1,0,0,0,0|2,0,0]=4 8575 B10R1.25 COc1ncc(cc1O)Br 271570a_203496583355_100009814608 [1,1,0,0,0,0|2,0,0]=4 8576 B10R1.25 COc1ncc(cc1O)C 271570a_203496583355_100012353929 [1,1,0,0,0,0|2,0,0]=4 8577 B10R1.25 COc1ncc(cc1O)F 271570a_203496583355_100009828472 [1,1,0,0,0,0|2,0,0]=4 8578 B10R1.25 COc1ncc(cc1O)N 271570a_203496583355_100012351452 [1,1,0,0,0,0|2,0,0]=4 8579 B10R1.25 COc1ncc(cc1O)O 271570a_203496583355_100010135713 [1,1,0,0,0,0|2,0,0]=4 8580 B10R1.25 CSc1ccc(cc1Br)Br 62a_100011484698_200000210301 [1,1,0,0,0,0|2,0,0]=4 8581 B10R1.25 CSc1ccc(cc1Br)Br 62a_200000210301_100011484698 [1,1,0,0,0,0|2,0,0]=4 8582 B10R1.25 CSc1ccc(cc1Br)C 62a_100009813563_200000210301 [1,1,0,0,0,0|2,0,0]=4 8583 B10R1.25 CSc1ccc(cc1Br)C 62a_200000210301_100009813563 [1,1,0,0,0,0|2,0,0]=4 8584 B10R1.25 CSc1ccc(cc1Br)Cl 62a_100011219703_200000210301 [1,1,0,0,0,0|2,0,0]=4 8585 B10R1.25 CSc1ccc(cc1Br)Cl 62a_200000210301_100011219703 [1,1,0,0,0,0|2,0,0]=4 8586 B10R1.25 CSc1ccc(cc1Br)F 62a_100011217111_200000210301 [1,1,0,0,0,0|2,0,0]=4 8587 B10R1.25 CSc1ccc(cc1Br)F 62a_200000210301_100011217111 [1,1,0,0,0,0|2,0,0]=4 8588 B10R1.25 CSc1ccc(cc1Br)N 62a_100000750458_200000210301 [1,1,0,0,0,0|2,0,0]=4 8589 B10R1.25 CSc1ccc(cc1Br)N 62a_200000210301_100000750458 [1,1,0,0,0,0|2,0,0]=4 8590 B10R1.25 CSc1ccc(cc1Br)O 62a_100000701344_200000210301 [1,1,0,0,0,0|2,0,0]=4 8591 B10R1.25 CSc1ccc(cc1Br)O 62a_200000210301_100000701344 [1,1,0,0,0,0|2,0,0]=4 8592 B10R1.25 CSc1ccc(cc1C)Br 62a_100000701812_200000210301 [1,1,0,0,0,0|2,0,0]=4 8593 B10R1.25 CSc1ccc(cc1C)Br 62a_200000210301_100000701812 [1,1,0,0,0,0|2,0,0]=4 8594 B10R1.25 CSc1ccc(cc1C)C 62a_100011217332_200000210301 [1,1,0,0,0,0|2,0,0]=4 8595 B10R1.25 CSc1ccc(cc1C)C 62a_200000210301_100011217332 [1,1,0,0,0,0|2,0,0]=4 8596 B10R1.25 CSc1ccc(cc1C)Cl 62a_100011219607_200000210301 [1,1,0,0,0,0|2,0,0]=4 8597 B10R1.25 CSc1ccc(cc1C)Cl 62a_200000210301_100011219607 [1,1,0,0,0,0|2,0,0]=4 8598 B10R1.25 CSc1ccc(cc1C)F 62a_100011205405_200000210301 [1,1,0,0,0,0|2,0,0]=4 8599 B10R1.25 CSc1ccc(cc1C)F 62a_200000210301_100011205405 [1,1,0,0,0,0|2,0,0]=4 8600 B10R1.25 CSc1ccc(cc1C)N 62a_100000210723_200000210301 [1,1,0,0,0,0|2,0,0]=4 8601 B10R1.25 CSc1ccc(cc1C)N 62a_200000210301_100000210723 [1,1,0,0,0,0|2,0,0]=4 8602 B10R1.25 CSc1ccc(cc1C)O 62a_200000210301_100000690111 [1,1,0,0,0,0|2,0,0]=4 8603 B10R1.25 CSc1ccc(cc1Cl)Br 62a_100011216062_200000210301 [1,1,0,0,0,0|2,0,0]=4 8604 B10R1.25 CSc1ccc(cc1Cl)Br 62a_200000210301_100011216062 [1,1,0,0,0,0|2,0,0]=4 8605 B10R1.25 CSc1ccc(cc1Cl)C 62a_100011263221_200000210301 [1,1,0,0,0,0|2,0,0]=4 8606 B10R1.25 CSc1ccc(cc1Cl)C 62a_200000210301_100011263221 [1,1,0,0,0,0|2,0,0]=4 8607 B10R1.25 CSc1ccc(cc1Cl)Cl 62a_100000699841_200000210301 [1,1,0,0,0,0|2,0,0]=4 8608 B10R1.25 CSc1ccc(cc1Cl)Cl 62a_200000210301_100000699841 [1,1,0,0,0,0|2,0,0]=4 8609 B10R1.25 CSc1ccc(cc1Cl)F 62a_100000733362_200000210301 [1,1,0,0,0,0|2,0,0]=4 8610 B10R1.25 CSc1ccc(cc1Cl)F 62a_200000210301_100000733362 [1,1,0,0,0,0|2,0,0]=4 8611 B10R1.25 CSc1ccc(cc1Cl)N 62a_100000761885_200000210301 [1,1,0,0,0,0|2,0,0]=4 8612 B10R1.25 CSc1ccc(cc1Cl)N 62a_200000210301_100000761885 [1,1,0,0,0,0|2,0,0]=4 8613 B10R1.25 CSc1ccc(cc1Cl)O 271570a_203496583355_206447510565 [1,1,0,0,0,0|2,0,0]=4 8614 B10R1.25 CSc1ccc(cc1Cl)O 62a_100000047559_200000210301 [1,1,0,0,0,0|2,0,0]=4 8615 B10R1.25 CSc1ccc(cc1Cl)O 62a_200000210301_100000047559 [1,1,0,0,0,0|2,0,0]=4 8616 B10R1.25 CSc1ccc(cc1F)Br 62a_100009814013_200000210301 [1,1,0,0,0,0|2,0,0]=4 8617 B10R1.25 CSc1ccc(cc1F)Br 62a_200000210301_100009814013 [1,1,0,0,0,0|2,0,0]=4 8618 B10R1.25 CSc1ccc(cc1F)C 62a_100011216119_200000210301 [1,1,0,0,0,0|2,0,0]=4 8619 B10R1.25 CSc1ccc(cc1F)C 62a_200000210301_100011216119 [1,1,0,0,0,0|2,0,0]=4 8620 B10R1.25 CSc1ccc(cc1F)Cl 62a_100011216042_200000210301 [1,1,0,0,0,0|2,0,0]=4 8621 B10R1.25 CSc1ccc(cc1F)Cl 62a_200000210301_100011216042 [1,1,0,0,0,0|2,0,0]=4 8622 B10R1.25 CSc1ccc(cc1F)F 62a_100000750030_200000210301 [1,1,0,0,0,0|2,0,0]=4 8623 B10R1.25 CSc1ccc(cc1F)F 62a_200000210301_100000750030 [1,1,0,0,0,0|2,0,0]=4 8624 B10R1.25 CSc1ccc(cc1F)N 62a_100011356925_200000210301 [1,1,0,0,0,0|2,0,0]=4 8625 B10R1.25 CSc1ccc(cc1F)N 62a_200000210301_100011356925 [1,1,0,0,0,0|2,0,0]=4 8626 B10R1.25 CSc1ccc(cc1F)O 271570a_203496583355_100010161220 [1,1,0,0,0,0|2,0,0]=4 8627 B10R1.25 CSc1ccc(cc1F)O 62a_100000755031_200000210301 [1,1,0,0,0,0|2,0,0]=4 8628 B10R1.25 CSc1ccc(cc1F)O 62a_200000210301_100000755031 [1,1,0,0,0,0|2,0,0]=4 8629 B10R1.25 CSc1ccc(cc1N)Br 62a_100000743836_200000210301 [1,1,0,0,0,0|2,0,0]=4 8630 B10R1.25 CSc1ccc(cc1N)Br 62a_200000210301_100000743836 [1,1,0,0,0,0|2,0,0]=4 8631 B10R1.25 CSc1ccc(cc1N)C 62a_100011216686_200000210301 [1,1,0,0,0,0|2,0,0]=4 8632 B10R1.25 CSc1ccc(cc1N)C 62a_200000210301_100011216686 [1,1,0,0,0,0|2,0,0]=4 8633 B10R1.25 CSc1ccc(cc1N)Cl 62a_100000761886_200000210301 [1,1,0,0,0,0|2,0,0]=4 8634 B10R1.25 CSc1ccc(cc1N)Cl 62a_200000210301_100000761886 [1,1,0,0,0,0|2,0,0]=4 8635 B10R1.25 CSc1ccc(cc1N)F 62a_100000687223_200000210301 [1,1,0,0,0,0|2,0,0]=4 8636 B10R1.25 CSc1ccc(cc1N)F 62a_200000210301_100000687223 [1,1,0,0,0,0|2,0,0]=4 8637 B10R1.25 CSc1ccc(cc1N)N 62a_200000210301_200012175722 [1,1,0,0,0,0|2,0,0]=4 8638 B10R1.25 CSc1ccc(cc1N)N 62a_200012175722_200000210301 [1,1,0,0,0,0|2,0,0]=4 8639 B10R1.25 CSc1ccc(cc1N)O 62a_100011999798_200000210301 [1,1,0,0,0,0|2,0,0]=4 8640 B10R1.25 CSc1ccc(cc1N)O 62a_200000210301_100011999798 [1,1,0,0,0,0|2,0,0]=4 8641 B10R1.25 CSc1ccc(cc1O)Br 62a_100012344904_200000210301 [1,1,0,0,0,0|1,0,0]=3 8642 B10R1.25 CSc1ccc(cc1O)Br 62a_200000210301_100012344904 [1,1,0,0,0,0|1,0,0]=3 8643 B10R1.25 CSc1ccc(cc1O)C 271570a_203496583355_200010201864 [1,1,0,0,0,0|1,0,0]=3 8644 B10R1.25 CSc1ccc(cc1O)C 62a_100012002257_200000210301 [1,1,0,0,0,0|1,0,0]=3 8645 B10R1.25 CSc1ccc(cc1O)C 62a_200000210301_100012002257 [1,1,0,0,0,0|1,0,0]=3 8646 B10R1.25 CSc1ccc(cc1O)Cl 62a_100000050036_200000210301 [1,1,0,0,0,0|1,0,0]=3 8647 B10R1.25 CSc1ccc(cc1O)Cl 62a_200000210301_100000050036 [1,1,0,0,0,0|1,0,0]=3 8648 B10R1.25 CSc1ccc(cc1O)F 271570a_203496583355_100009817003 [1,1,0,0,0,0|1,0,0]=3 8649 B10R1.25 CSc1ccc(cc1O)F 62a_100000690578_200000210301 [1,1,0,0,0,0|1,0,0]=3 8650 B10R1.25 CSc1ccc(cc1O)F 62a_200000210301_100000690578 [1,1,0,0,0,0|1,0,0]=3 8651 B10R1.25 CSc1ccc(cc1O)O 62a_200000210301_100009813921 [1,1,0,0,0,0|1,0,0]=3 8652 B10R1.25 CSc1ccc(nc1O)C 62a_100009817604_200000210301 [1,1,0,0,0,0|2,0,0]=4 8653 B10R1.25 CSc1ccc(nc1O)C 62a_200000210301_100009817604 [1,1,0,0,0,0|2,0,0]=4 8654 B10R1.25 CSc1cnc(cc1O)C 62a_100011016184_200000210301 [1,1,0,0,0,0|2,0,0]=4 8655 B10R1.25 CSc1cnc(cc1O)C 62a_200000210301_100011016184 [1,1,0,0,0,0|2,0,0]=4 8656 B10R1.25 CSc1ncc(cc1O)Br 62a_100010210634_200000210301 [1,1,0,0,0,0|2,0,0]=4 8657 B10R1.25 CSc1ncc(cc1O)Br 62a_200000210301_100010210634 [1,1,0,0,0,0|2,0,0]=4 8658 B10R1.25 CSc1ncc(cc1O)C 62a_200000210301_100012000487 [1,1,0,0,0,0|2,0,0]=4 8659 B10R1.25 CSc1ncc(cc1O)Cl 62a_100010233512_200000210301 [1,1,0,0,0,0|2,0,0]=4 8660 B10R1.25 CSc1ncc(cc1O)Cl 62a_200000210301_100010233512 [1,1,0,0,0,0|2,0,0]=4 8661 B10R1.25 CSc1ncc(cc1O)F 62a_100009820119_200000210301 [1,1,0,0,0,0|2,0,0]=4 8662 B10R1.25 CSc1ncc(cc1O)F 62a_200000210301_100000079967 [1,1,0,0,0,0|2,0,0]=4 8663 B10R1.25 Cc1cc(c(cn1)S[13CH3])O 62a_100011016184_200025704644 [1,1,0,0,0,0|2,0,0]=4 8664 B10R1.25 Cc1cc(c(cn1)S[13CH3])O 62a_200025704644_100011016184 [1,1,0,0,0,0|2,0,0]=4 8665 B10R1.25 Cc1cc(ccc1CF)O 271570a_203496583355_200010711859 [1,1,0,0,0,0|2,0,0]=4 8666 B10R1.25 Cc1cc(ccc1CN)O 271570a_203496583355_100000753881 [1,1,0,0,0,0|2,0,0]=4 8667 B10R1.25 Cc1cc(ccc1CO)O 271570a_203496583355_100000748258 [1,1,0,0,0,0|2,0,0]=4 8668 B10R1.25 Cc1cc(ccc1N[13CH3])Br 34a_100000211769_200025704644 [1,1,0,0,0,0|2,0,0]=4 8669 B10R1.25 Cc1cc(ccc1N[13CH3])Br 7a_100000211769_200025704644 [1,1,0,0,0,0|2,0,0]=4 8670 B10R1.25 Cc1cc(ccc1N[13CH3])Cl 34a_100000210418_200025704644 [1,1,0,0,0,0|2,0,0]=4 8671 B10R1.25 Cc1cc(ccc1N[13CH3])Cl 7a_100000210418_200025704644 [1,1,0,0,0,0|2,0,0]=4 8672 B10R1.25 Cc1cc(ccc1N[13CH3])F 34a_100000211637_200025704644 [1,1,0,0,0,0|2,0,0]=4 8673 B10R1.25 Cc1cc(ccc1N[13CH3])F 7a_100000211637_200025704644 [1,1,0,0,0,0|2,0,0]=4 8674 B10R1.25 Cc1cc(ccc1N[13CH3])I 34a_100000184554_200025704644 [1,1,0,0,0,0|2,0,0]=4 8675 B10R1.25 Cc1cc(ccc1N[13CH3])I 7a_100000184554_200025704644 [1,1,0,0,0,0|2,0,0]=4 8676 B10R1.25 Cc1cc(ccc1N[13CH3])O 34a_100000756630_200025704644 [1,1,0,0,0,0|2,0,0]=4 8677 B10R1.25 Cc1cc(ccc1O[13CH3])Br 34a_100000186361_200025704644 [1,1,0,0,0,0|2,0,0]=4 8678 B10R1.25 Cc1cc(ccc1O[13CH3])Br 7a_100000186361_200025704644 [1,1,0,0,0,0|2,0,0]=4 8679 B10R1.25 Cc1cc(ccc1O[13CH3])Cl 34a_100000211091_200025704644 [1,1,0,0,0,0|2,0,0]=4 8680 B10R1.25 Cc1cc(ccc1O[13CH3])Cl 7a_100000211091_200025704644 [1,1,0,0,0,0|2,0,0]=4 8681 B10R1.25 Cc1cc(ccc1O[13CH3])F 34a_100000764316_200025704644 [1,1,0,0,0,0|2,0,0]=4 8682 B10R1.25 Cc1cc(ccc1O[13CH3])F 7a_100000764316_200025704644 [1,1,0,0,0,0|2,0,0]=4 8683 B10R1.25 Cc1cc(ccc1O[13CH3])I 34a_100011218673_200025704644 [1,1,0,0,0,0|2,0,0]=4 8684 B10R1.25 Cc1cc(ccc1O[13CH3])I 7a_100011218673_200025704644 [1,1,0,0,0,0|2,0,0]=4 8685 B10R1.25 Cc1cc(ccc1O[13CH3])N 34a_100011218179_200025704644 [1,1,0,0,0,0|2,0,0]=4 8686 B10R1.25 Cc1cc(ccc1O[13CH3])N 7a_100011218179_200025704644 [1,1,0,0,0,0|2,0,0]=4 8687 B10R1.25 Cc1cc(ccc1S[13CH3])Br 62a_100000701812_200025704644 [1,1,0,0,0,0|2,0,0]=4 8688 B10R1.25 Cc1cc(ccc1S[13CH3])Br 62a_200025704644_100000701812 [1,1,0,0,0,0|2,0,0]=4 8689 B10R1.25 Cc1cc(ccc1S[13CH3])Cl 62a_100011219607_200025704644 [1,1,0,0,0,0|2,0,0]=4 8690 B10R1.25 Cc1cc(ccc1S[13CH3])Cl 62a_200025704644_100011219607 [1,1,0,0,0,0|2,0,0]=4 8691 B10R1.25 Cc1cc(ccc1S[13CH3])F 62a_100011205405_200025704644 [1,1,0,0,0,0|2,0,0]=4 8692 B10R1.25 Cc1cc(ccc1S[13CH3])F 62a_200025704644_100011205405 [1,1,0,0,0,0|2,0,0]=4 8693 B10R1.25 Cc1cc(ccc1S[13CH3])N 62a_100000210723_200025704644 [1,1,0,0,0,0|2,0,0]=4 8694 B10R1.25 Cc1cc(ccc1S[13CH3])N 62a_200025704644_100000210723 [1,1,0,0,0,0|2,0,0]=4 8695 B10R1.25 Cc1cc(ccc1S[13CH3])O 62a_200025704644_100000690111 [1,1,0,0,0,0|2,0,0]=4 8696 B10R1.25 Cc1ccc(c(c1)Br)N[13CH3] 34a_100000210942_200025704644 [1,1,0,0,0,0|2,0,0]=4 8697 B10R1.25 Cc1ccc(c(c1)Br)O[13CH3] 34a_100000210800_200025704644 [1,1,0,0,0,0|2,0,0]=4 8698 B10R1.25 Cc1ccc(c(c1)Br)O[13CH3] 7a_100000210800_200025704644 [1,1,0,0,0,0|2,0,0]=4 8699 B10R1.25 Cc1ccc(c(c1)Br)S[13CH3] 62a_100009813563_200025704644 [1,1,0,0,0,0|2,0,0]=4 8700 B10R1.25 Cc1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100009813563 [1,1,0,0,0,0|2,0,0]=4 8701 B10R1.25 Cc1ccc(c(c1)C)N[13CH3] 34a_100000736561_200025704644 [1,1,0,0,0,0|2,0,0]=4 8702 B10R1.25 Cc1ccc(c(c1)C)N[13CH3] 7a_100000736561_200025704644 [1,1,0,0,0,0|2,0,0]=4 8703 B10R1.25 Cc1ccc(c(c1)C)O[13CH3] 34a_100000211776_200025704644 [1,1,0,0,0,0|2,0,0]=4 8704 B10R1.25 Cc1ccc(c(c1)C)O[13CH3] 7a_100000211776_200025704644 [1,1,0,0,0,0|2,0,0]=4 8705 B10R1.25 Cc1ccc(c(c1)C)S[13CH3] 62a_100011217332_200025704644 [1,1,0,0,0,0|2,0,0]=4 8706 B10R1.25 Cc1ccc(c(c1)C)S[13CH3] 62a_200025704644_100011217332 [1,1,0,0,0,0|2,0,0]=4 8707 B10R1.25 Cc1ccc(c(c1)Cl)N[13CH3] 34a_100000210522_200025704644 [1,1,0,0,0,0|2,0,0]=4 8708 B10R1.25 Cc1ccc(c(c1)Cl)O[13CH3] 34a_100000749699_200025704644 [1,1,0,0,0,0|2,0,0]=4 8709 B10R1.25 Cc1ccc(c(c1)Cl)O[13CH3] 7a_100000749699_200025704644 [1,1,0,0,0,0|2,0,0]=4 8710 B10R1.25 Cc1ccc(c(c1)Cl)S[13CH3] 62a_100011263221_200025704644 [1,1,0,0,0,0|2,0,0]=4 8711 B10R1.25 Cc1ccc(c(c1)Cl)S[13CH3] 62a_200025704644_100011263221 [1,1,0,0,0,0|2,0,0]=4 8712 B10R1.25 Cc1ccc(c(c1)F)N[13CH3] 34a_100000211023_200025704644 [1,1,0,0,0,0|2,0,0]=4 8713 B10R1.25 Cc1ccc(c(c1)F)O[13CH3] 34a_100011216688_200025704644 [1,1,0,0,0,0|2,0,0]=4 8714 B10R1.25 Cc1ccc(c(c1)F)O[13CH3] 7a_100011216688_200025704644 [1,1,0,0,0,0|2,0,0]=4 8715 B10R1.25 Cc1ccc(c(c1)F)S[13CH3] 62a_100011216119_200025704644 [1,1,0,0,0,0|2,0,0]=4 8716 B10R1.25 Cc1ccc(c(c1)F)S[13CH3] 62a_200025704644_100011216119 [1,1,0,0,0,0|2,0,0]=4 8717 B10R1.25 Cc1ccc(c(c1)I)N[13CH3] 34a_100011356834_200025704644 [1,1,0,0,0,0|2,0,0]=4 8718 B10R1.25 Cc1ccc(c(c1)I)O[13CH3] 34a_100000765521_200025704644 [1,1,0,0,0,0|2,0,0]=4 8719 B10R1.25 Cc1ccc(c(c1)I)O[13CH3] 7a_100000765521_200025704644 [1,1,0,0,0,0|2,0,0]=4 8720 B10R1.25 Cc1ccc(c(c1)N)O[13CH3] 34a_100011215204_200025704644 [1,1,0,0,0,0|2,0,0]=4 8721 B10R1.25 Cc1ccc(c(c1)N)O[13CH3] 7a_100011215204_200025704644 [1,1,0,0,0,0|2,0,0]=4 8722 B10R1.25 Cc1ccc(c(c1)N)S[13CH3] 62a_100011216686_200025704644 [1,1,0,0,0,0|2,0,0]=4 8723 B10R1.25 Cc1ccc(c(c1)N)S[13CH3] 62a_200025704644_100011216686 [1,1,0,0,0,0|2,0,0]=4 8724 B10R1.25 Cc1ccc(c(c1)O)C#N 271570a_203496583355_100000693804 [1,1,0,0,0,0|1,0,1]=4 8725 B10R1.25 Cc1ccc(c(c1)O)C=O 271570a_203496583355_100000692596 [1,1,0,0,0,0|1,0,1]=4 8726 B10R1.25 Cc1ccc(c(c1)O)NN 271570a_203496583355_100016996181 [1,1,0,0,0,0|2,0,0]=4 8727 B10R1.25 Cc1ccc(c(c1)O)N[13CH3] 34a_100000211527_200025704644 [1,1,0,0,0,0|1,0,0]=3 8728 B10R1.25 Cc1ccc(c(c1)O)S[13CH3] 62a_100012002257_200025704644 [1,1,0,0,0,0|1,0,0]=3 8729 B10R1.25 Cc1ccc(c(c1)O)S[13CH3] 62a_200025704644_100012002257 [1,1,0,0,0,0|1,0,0]=3 8730 B10R1.25 Cc1ccc(c(n1)O)CO 271570a_203496583355_102495338573 [1,1,0,0,0,0|2,0,0]=4 8731 B10R1.25 Cc1ccc(c(n1)O)S[13CH3] 62a_100009817604_200025704644 [1,1,0,0,0,0|2,0,0]=4 8732 B10R1.25 Cc1ccc(c(n1)O)S[13CH3] 62a_200025704644_100009817604 [1,1,0,0,0,0|2,0,0]=4 8733 B10R1.25 Cc1cnc(c(c1)O)S[13CH3] 62a_200025704644_100012000487 [1,1,0,0,0,0|2,0,0]=4 8734 B10R1.25 N#Cc1ccc(cc1O)Br 271570a_203496583355_100010214477 [1,1,0,0,0,0|1,0,1]=4 8735 B10R1.25 N#Cc1ccc(cc1O)Cl 271570a_203496583355_100012355178 [1,1,0,0,0,0|1,0,1]=4 8736 B10R1.25 N#Cc1ccc(cc1O)F 271570a_203496583355_100000747196 [1,1,0,0,0,0|1,0,1]=4 8737 B10R1.25 N#Cc1ccc(cc1O)N 271570a_203496583355_100000689153 [1,1,0,0,0,0|1,0,1]=4 8738 B10R1.25 N#Cc1ccc(cc1O)O 271570a_203496583355_100011934713 [1,1,0,0,0,0|1,0,1]=4 8739 B10R1.25 N#Cc1ccc(cc1O)O 271570a_203496583355_100012184851 [1,1,0,0,0,0|1,0,1]=4 8740 B10R1.25 NCc1ccc(cc1F)O 271570a_203496583355_100000754580 [1,1,0,0,0,0|2,0,0]=4 8741 B10R1.25 NCc1ccc(cc1O)F 271570a_203496583355_100000708791 [1,1,0,0,0,0|1,0,0]=3 8742 B10R1.25 Nc1cc(ccc1CO)O 271570a_203496583355_100000718831 [1,1,0,0,0,0|2,0,0]=4 8743 B10R1.25 O=Cc1ccc(cc1O)Br 271570a_203496583355_100010146562 [1,1,0,0,0,0|1,0,1]=4 8744 B10R1.25 O=Cc1ccc(cc1O)F 271570a_203496583355_100000752949 [1,1,0,0,0,0|1,0,1]=4 8745 B10R1.25 O=Cc1ccc(cc1O)O 271570a_203496583355_100011236494 [1,1,0,0,0,0|1,0,1]=4 8746 B10R1.25 O=Cc1ccc(cc1O)O 271570a_203496583355_100011277552 [1,1,0,0,0,0|1,0,1]=4 8747 B10R1.25 OCc1ccc(cc1Br)O 271570a_203496583355_100010240206 [1,1,0,0,0,0|2,0,0]=4 8748 B10R1.25 OCc1ccc(cc1F)O 271570a_203496583355_100011191541 [1,1,0,0,0,0|2,0,0]=4 8749 B10R1.25 OCc1ccc(cc1O)Br 271570a_203496583355_100010146605 [1,1,0,0,0,0|1,0,0]=3 8750 B10R1.25 OCc1ccc(cc1O)Cl 271570a_203496583355_100000722340 [1,1,0,0,0,0|1,0,0]=3 8751 B10R1.25 OCc1ccc(cc1O)F 271570a_203496583355_100000744086 [1,1,0,0,0,0|1,0,0]=3 8752 B10R1.25 OCc1ccc(cc1O)O 271570a_203496583355_100000071718 [1,1,0,0,0,0|1,0,0]=3 8753 B10R1.25 OCc1ccc(cc1O)O 271570a_203496583355_100010146404 [1,1,0,0,0,0|1,0,0]=3 8754 B10R1.25 [13CH3]Nc1ccc(cc1Br)Br 34a_100000211012_200025704644 [1,1,0,0,0,0|2,0,0]=4 8755 B10R1.25 [13CH3]Nc1ccc(cc1Br)Cl 34a_100000752454_200025704644 [1,1,0,0,0,0|2,0,0]=4 8756 B10R1.25 [13CH3]Nc1ccc(cc1Br)F 34a_100000738039_200025704644 [1,1,0,0,0,0|2,0,0]=4 8757 B10R1.25 [13CH3]Nc1ccc(cc1Br)O 34a_100012001276_200025704644 [1,1,0,0,0,0|2,0,0]=4 8758 B10R1.25 [13CH3]Nc1ccc(cc1Cl)Br 34a_100000211467_200025704644 [1,1,0,0,0,0|2,0,0]=4 8759 B10R1.25 [13CH3]Nc1ccc(cc1Cl)Cl 34a_100000185861_200025704644 [1,1,0,0,0,0|2,0,0]=4 8760 B10R1.25 [13CH3]Nc1ccc(cc1Cl)F 34a_100000212003_200025704644 [1,1,0,0,0,0|2,0,0]=4 8761 B10R1.25 [13CH3]Nc1ccc(cc1Cl)I 34a_100011218065_200025704644 [1,1,0,0,0,0|2,0,0]=4 8762 B10R1.25 [13CH3]Nc1ccc(cc1Cl)O 34a_100011215599_200025704644 [1,1,0,0,0,0|2,0,0]=4 8763 B10R1.25 [13CH3]Nc1ccc(cc1F)Br 34a_100000210722_200025704644 [1,1,0,0,0,0|2,0,0]=4 8764 B10R1.25 [13CH3]Nc1ccc(cc1F)Cl 34a_100000211020_200025704644 [1,1,0,0,0,0|2,0,0]=4 8765 B10R1.25 [13CH3]Nc1ccc(cc1F)F 34a_100000210720_200025704644 [1,1,0,0,0,0|2,0,0]=4 8766 B10R1.25 [13CH3]Nc1ccc(cc1F)I 34a_100011215594_200025704644 [1,1,0,0,0,0|2,0,0]=4 8767 B10R1.25 [13CH3]Nc1ccc(cc1F)O 34a_100000759473_200025704644 [1,1,0,0,0,0|2,0,0]=4 8768 B10R1.25 [13CH3]Nc1ccc(cc1I)Br 34a_100000187925_200025704644 [1,1,0,0,0,0|2,0,0]=4 8769 B10R1.25 [13CH3]Nc1ccc(cc1I)Cl 34a_100000761889_200025704644 [1,1,0,0,0,0|2,0,0]=4 8770 B10R1.25 [13CH3]Nc1ccc(cc1I)F 34a_100000760547_200025704644 [1,1,0,0,0,0|2,0,0]=4 8771 B10R1.25 [13CH3]Nc1ccc(cc1I)O 34a_100010084370_200025704644 [1,1,0,0,0,0|2,0,0]=4 8772 B10R1.25 [13CH3]Nc1ccc(cc1O)Br 34a_100000739049_200025704644 [1,1,0,0,0,0|1,0,0]=3 8773 B10R1.25 [13CH3]Nc1ccc(cc1O)Cl 34a_100000185728_200025704644 [1,1,0,0,0,0|1,0,0]=3 8774 B10R1.25 [13CH3]Nc1ccc(cc1O)F 34a_100000753323_200025704644 [1,1,0,0,0,0|1,0,0]=3 8775 B10R1.25 [13CH3]Nc1ccc(cc1O)O 34a_100000106777_200025704644 [1,1,0,0,0,0|1,0,0]=3 8776 B10R1.25 [13CH3]Oc1ccc(cc1Br)Br 34a_100000188717_200025704644 [1,1,0,0,0,0|2,0,0]=4 8777 B10R1.25 [13CH3]Oc1ccc(cc1Br)Br 7a_100000188717_200025704644 [1,1,0,0,0,0|2,0,0]=4 8778 B10R1.25 [13CH3]Oc1ccc(cc1Br)Cl 34a_100000211998_200025704644 [1,1,0,0,0,0|2,0,0]=4 8779 B10R1.25 [13CH3]Oc1ccc(cc1Br)Cl 7a_100000211998_200025704644 [1,1,0,0,0,0|2,0,0]=4 8780 B10R1.25 [13CH3]Oc1ccc(cc1Br)F 34a_100000211999_200025704644 [1,1,0,0,0,0|2,0,0]=4 8781 B10R1.25 [13CH3]Oc1ccc(cc1Br)F 7a_100000211999_200025704644 [1,1,0,0,0,0|2,0,0]=4 8782 B10R1.25 [13CH3]Oc1ccc(cc1Br)I 34a_100012361655_200025704644 [1,1,0,0,0,0|2,0,0]=4 8783 B10R1.25 [13CH3]Oc1ccc(cc1Br)I 7a_100012361655_200025704644 [1,1,0,0,0,0|2,0,0]=4 8784 B10R1.25 [13CH3]Oc1ccc(cc1Br)N 34a_100011534360_200025704644 [1,1,0,0,0,0|2,0,0]=4 8785 B10R1.25 [13CH3]Oc1ccc(cc1Br)N 7a_100011534360_200025704644 [1,1,0,0,0,0|2,0,0]=4 8786 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Br 34a_100000186472_200025704644 [1,1,0,0,0,0|2,0,0]=4 8787 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Br 7a_100000186472_200025704644 [1,1,0,0,0,0|2,0,0]=4 8788 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Cl 34a_100015191787_200025704644 [1,1,0,0,0,0|2,0,0]=4 8789 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Cl 7a_100015191787_200025704644 [1,1,0,0,0,0|2,0,0]=4 8790 B10R1.25 [13CH3]Oc1ccc(cc1Cl)F 34a_100000212004_200025704644 [1,1,0,0,0,0|2,0,0]=4 8791 B10R1.25 [13CH3]Oc1ccc(cc1Cl)F 7a_100000212004_200025704644 [1,1,0,0,0,0|2,0,0]=4 8792 B10R1.25 [13CH3]Oc1ccc(cc1Cl)I 34a_100012360047_200025704644 [1,1,0,0,0,0|2,0,0]=4 8793 B10R1.25 [13CH3]Oc1ccc(cc1Cl)I 7a_100012360047_200025704644 [1,1,0,0,0,0|2,0,0]=4 8794 B10R1.25 [13CH3]Oc1ccc(cc1Cl)N 34a_100000744943_200025704644 [1,1,0,0,0,0|2,0,0]=4 8795 B10R1.25 [13CH3]Oc1ccc(cc1Cl)N 7a_100000744943_200025704644 [1,1,0,0,0,0|2,0,0]=4 8796 B10R1.25 [13CH3]Oc1ccc(cc1F)Br 34a_100000185481_200025704644 [1,1,0,0,0,0|2,0,0]=4 8797 B10R1.25 [13CH3]Oc1ccc(cc1F)Br 7a_100000185481_200025704644 [1,1,0,0,0,0|2,0,0]=4 8798 B10R1.25 [13CH3]Oc1ccc(cc1F)Cl 34a_100000230166_200025704644 [1,1,0,0,0,0|2,0,0]=4 8799 B10R1.25 [13CH3]Oc1ccc(cc1F)Cl 7a_100000230166_200025704644 [1,1,0,0,0,0|2,0,0]=4 8800 B10R1.25 [13CH3]Oc1ccc(cc1F)F 34a_100000230127_200025704644 [1,1,0,0,0,0|2,0,0]=4 8801 B10R1.25 [13CH3]Oc1ccc(cc1F)F 7a_100000230127_200025704644 [1,1,0,0,0,0|2,0,0]=4 8802 B10R1.25 [13CH3]Oc1ccc(cc1F)I 34a_100011356965_200025704644 [1,1,0,0,0,0|2,0,0]=4 8803 B10R1.25 [13CH3]Oc1ccc(cc1F)I 7a_100011356965_200025704644 [1,1,0,0,0,0|2,0,0]=4 8804 B10R1.25 [13CH3]Oc1ccc(cc1F)N 34a_100011220035_200025704644 [1,1,0,0,0,0|2,0,0]=4 8805 B10R1.25 [13CH3]Oc1ccc(cc1F)N 7a_100011220035_200025704644 [1,1,0,0,0,0|2,0,0]=4 8806 B10R1.25 [13CH3]Oc1ccc(cc1I)Br 34a_100012355227_200025704644 [1,1,0,0,0,0|2,0,0]=4 8807 B10R1.25 [13CH3]Oc1ccc(cc1I)Br 7a_100012355227_200025704644 [1,1,0,0,0,0|2,0,0]=4 8808 B10R1.25 [13CH3]Oc1ccc(cc1I)Cl 34a_100011356953_200025704644 [1,1,0,0,0,0|2,0,0]=4 8809 B10R1.25 [13CH3]Oc1ccc(cc1I)Cl 7a_100011356953_200025704644 [1,1,0,0,0,0|2,0,0]=4 8810 B10R1.25 [13CH3]Oc1ccc(cc1I)F 34a_100012355409_200025704644 [1,1,0,0,0,0|2,0,0]=4 8811 B10R1.25 [13CH3]Oc1ccc(cc1I)F 7a_100012355409_200025704644 [1,1,0,0,0,0|2,0,0]=4 8812 B10R1.25 [13CH3]Oc1ccc(cc1I)I 7a_100010001573_200025704644 [1,1,0,0,0,0|2,0,0]=4 8813 B10R1.25 [13CH3]Oc1ccc(cc1N)Br 34a_100000752626_200025704644 [1,1,0,0,0,0|2,0,0]=4 8814 B10R1.25 [13CH3]Oc1ccc(cc1N)Br 7a_100000752626_200025704644 [1,1,0,0,0,0|2,0,0]=4 8815 B10R1.25 [13CH3]Oc1ccc(cc1N)Cl 34a_100000210500_200025704644 [1,1,0,0,0,0|2,0,0]=4 8816 B10R1.25 [13CH3]Oc1ccc(cc1N)Cl 7a_100000210500_200025704644 [1,1,0,0,0,0|2,0,0]=4 8817 B10R1.25 [13CH3]Oc1ccc(cc1N)F 34a_100000759472_200025704644 [1,1,0,0,0,0|2,0,0]=4 8818 B10R1.25 [13CH3]Oc1ccc(cc1N)F 7a_100000759472_200025704644 [1,1,0,0,0,0|2,0,0]=4 8819 B10R1.25 [13CH3]Oc1ccc(cc1N)I 34a_100000753495_200025704644 [1,1,0,0,0,0|2,0,0]=4 8820 B10R1.25 [13CH3]Oc1ccc(cc1N)I 7a_100000753495_200025704644 [1,1,0,0,0,0|2,0,0]=4 8821 B10R1.25 [13CH3]Oc1ccc(cc1N)N 34a_100000725306_200025704644 [1,1,0,0,0,0|2,0,0]=4 8822 B10R1.25 [13CH3]Sc1ccc(cc1Br)Br 62a_100011484698_200025704644 [1,1,0,0,0,0|2,0,0]=4 8823 B10R1.25 [13CH3]Sc1ccc(cc1Br)Br 62a_200025704644_100011484698 [1,1,0,0,0,0|2,0,0]=4 8824 B10R1.25 [13CH3]Sc1ccc(cc1Br)Cl 62a_100011219703_200025704644 [1,1,0,0,0,0|2,0,0]=4 8825 B10R1.25 [13CH3]Sc1ccc(cc1Br)Cl 62a_200025704644_100011219703 [1,1,0,0,0,0|2,0,0]=4 8826 B10R1.25 [13CH3]Sc1ccc(cc1Br)F 62a_100011217111_200025704644 [1,1,0,0,0,0|2,0,0]=4 8827 B10R1.25 [13CH3]Sc1ccc(cc1Br)F 62a_200025704644_100011217111 [1,1,0,0,0,0|2,0,0]=4 8828 B10R1.25 [13CH3]Sc1ccc(cc1Br)N 62a_100000750458_200025704644 [1,1,0,0,0,0|2,0,0]=4 8829 B10R1.25 [13CH3]Sc1ccc(cc1Br)N 62a_200025704644_100000750458 [1,1,0,0,0,0|2,0,0]=4 8830 B10R1.25 [13CH3]Sc1ccc(cc1Br)O 62a_100000701344_200025704644 [1,1,0,0,0,0|2,0,0]=4 8831 B10R1.25 [13CH3]Sc1ccc(cc1Br)O 62a_200025704644_100000701344 [1,1,0,0,0,0|2,0,0]=4 8832 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Br 62a_100011216062_200025704644 [1,1,0,0,0,0|2,0,0]=4 8833 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Br 62a_200025704644_100011216062 [1,1,0,0,0,0|2,0,0]=4 8834 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Cl 62a_100000699841_200025704644 [1,1,0,0,0,0|2,0,0]=4 8835 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Cl 62a_200025704644_100000699841 [1,1,0,0,0,0|2,0,0]=4 8836 B10R1.25 [13CH3]Sc1ccc(cc1Cl)F 62a_100000733362_200025704644 [1,1,0,0,0,0|2,0,0]=4 8837 B10R1.25 [13CH3]Sc1ccc(cc1Cl)F 62a_200025704644_100000733362 [1,1,0,0,0,0|2,0,0]=4 8838 B10R1.25 [13CH3]Sc1ccc(cc1Cl)N 62a_100000761885_200025704644 [1,1,0,0,0,0|2,0,0]=4 8839 B10R1.25 [13CH3]Sc1ccc(cc1Cl)N 62a_200025704644_100000761885 [1,1,0,0,0,0|2,0,0]=4 8840 B10R1.25 [13CH3]Sc1ccc(cc1Cl)O 62a_100000047559_200025704644 [1,1,0,0,0,0|2,0,0]=4 8841 B10R1.25 [13CH3]Sc1ccc(cc1Cl)O 62a_200025704644_100000047559 [1,1,0,0,0,0|2,0,0]=4 8842 B10R1.25 [13CH3]Sc1ccc(cc1F)Br 62a_100009814013_200025704644 [1,1,0,0,0,0|2,0,0]=4 8843 B10R1.25 [13CH3]Sc1ccc(cc1F)Br 62a_200025704644_100009814013 [1,1,0,0,0,0|2,0,0]=4 8844 B10R1.25 [13CH3]Sc1ccc(cc1F)Cl 62a_100011216042_200025704644 [1,1,0,0,0,0|2,0,0]=4 8845 B10R1.25 [13CH3]Sc1ccc(cc1F)Cl 62a_200025704644_100011216042 [1,1,0,0,0,0|2,0,0]=4 8846 B10R1.25 [13CH3]Sc1ccc(cc1F)F 62a_100000750030_200025704644 [1,1,0,0,0,0|2,0,0]=4 8847 B10R1.25 [13CH3]Sc1ccc(cc1F)F 62a_200025704644_100000750030 [1,1,0,0,0,0|2,0,0]=4 8848 B10R1.25 [13CH3]Sc1ccc(cc1F)N 62a_100011356925_200025704644 [1,1,0,0,0,0|2,0,0]=4 8849 B10R1.25 [13CH3]Sc1ccc(cc1F)N 62a_200025704644_100011356925 [1,1,0,0,0,0|2,0,0]=4 8850 B10R1.25 [13CH3]Sc1ccc(cc1F)O 62a_100000755031_200025704644 [1,1,0,0,0,0|2,0,0]=4 8851 B10R1.25 [13CH3]Sc1ccc(cc1F)O 62a_200025704644_100000755031 [1,1,0,0,0,0|2,0,0]=4 8852 B10R1.25 [13CH3]Sc1ccc(cc1N)Br 62a_100000743836_200025704644 [1,1,0,0,0,0|2,0,0]=4 8853 B10R1.25 [13CH3]Sc1ccc(cc1N)Br 62a_200025704644_100000743836 [1,1,0,0,0,0|2,0,0]=4 8854 B10R1.25 [13CH3]Sc1ccc(cc1N)Cl 62a_100000761886_200025704644 [1,1,0,0,0,0|2,0,0]=4 8855 B10R1.25 [13CH3]Sc1ccc(cc1N)Cl 62a_200025704644_100000761886 [1,1,0,0,0,0|2,0,0]=4 8856 B10R1.25 [13CH3]Sc1ccc(cc1N)F 62a_100000687223_200025704644 [1,1,0,0,0,0|2,0,0]=4 8857 B10R1.25 [13CH3]Sc1ccc(cc1N)F 62a_200025704644_100000687223 [1,1,0,0,0,0|2,0,0]=4 8858 B10R1.25 [13CH3]Sc1ccc(cc1N)N 62a_200012175722_200025704644 [1,1,0,0,0,0|2,0,0]=4 8859 B10R1.25 [13CH3]Sc1ccc(cc1N)N 62a_200025704644_200012175722 [1,1,0,0,0,0|2,0,0]=4 8860 B10R1.25 [13CH3]Sc1ccc(cc1N)O 62a_100011999798_200025704644 [1,1,0,0,0,0|2,0,0]=4 8861 B10R1.25 [13CH3]Sc1ccc(cc1N)O 62a_200025704644_100011999798 [1,1,0,0,0,0|2,0,0]=4 8862 B10R1.25 [13CH3]Sc1ccc(cc1O)Br 62a_100012344904_200025704644 [1,1,0,0,0,0|1,0,0]=3 8863 B10R1.25 [13CH3]Sc1ccc(cc1O)Br 62a_200025704644_100012344904 [1,1,0,0,0,0|1,0,0]=3 8864 B10R1.25 [13CH3]Sc1ccc(cc1O)Cl 62a_100000050036_200025704644 [1,1,0,0,0,0|1,0,0]=3 8865 B10R1.25 [13CH3]Sc1ccc(cc1O)Cl 62a_200025704644_100000050036 [1,1,0,0,0,0|1,0,0]=3 8866 B10R1.25 [13CH3]Sc1ccc(cc1O)F 62a_100000690578_200025704644 [1,1,0,0,0,0|1,0,0]=3 8867 B10R1.25 [13CH3]Sc1ccc(cc1O)F 62a_200025704644_100000690578 [1,1,0,0,0,0|1,0,0]=3 8868 B10R1.25 [13CH3]Sc1ccc(cc1O)O 62a_200025704644_100009813921 [1,1,0,0,0,0|1,0,0]=3 8869 B10R1.25 [13CH3]Sc1ncc(cc1O)Br 62a_100010210634_200025704644 [1,1,0,0,0,0|2,0,0]=4 8870 B10R1.25 [13CH3]Sc1ncc(cc1O)Br 62a_200025704644_100010210634 [1,1,0,0,0,0|2,0,0]=4 8871 B10R1.25 [13CH3]Sc1ncc(cc1O)Cl 62a_100010233512_200025704644 [1,1,0,0,0,0|2,0,0]=4 8872 B10R1.25 [13CH3]Sc1ncc(cc1O)Cl 62a_200025704644_100010233512 [1,1,0,0,0,0|2,0,0]=4 8873 B10R1.25 [13CH3]Sc1ncc(cc1O)F 62a_100009820119_200025704644 [1,1,0,0,0,0|2,0,0]=4 8874 B10R1.25 [13CH3]Sc1ncc(cc1O)F 62a_200025704644_100000079967 [1,1,0,0,0,0|2,0,0]=4 8875 B10R1.30 C=Cc1cc(ccc1O)Br 271570a_100011290941_100012355227 [1,1,0,0,0,0|0,0,2]=4 8876 B10R1.30 C=Cc1cc(ccc1O)C 271570a_100011290941_100000765521 [1,1,0,0,0,0|0,0,2]=4 8877 B10R1.30 C=Cc1cc(ccc1O)Cl 271570a_100011290941_100011356953 [1,1,0,0,0,0|0,0,2]=4 8878 B10R1.30 C=Cc1cc(ccc1O)F 271570a_100011290941_100000211999 [1,1,0,0,0,0|0,0,2]=4 8879 B10R1.30 C=Cc1cc(ccc1O)N 271570a_100011290941_100011534360 [1,1,0,0,0,0|0,0,2]=4 8880 B10R1.30 C=Cc1cc(ccc1O)O 271570a_100011290941_100009813629 [1,1,0,0,0,0|0,0,2]=4 8881 B10R1.30 CCc1cc(ccc1Br)O 271570a_203496583355_100010244631 [1,1,0,0,0,0|1,0,0]=3 8882 B10R1.30 CCc1cc(ccc1F)O 271570a_203496583355_100010244625 [1,1,0,0,0,0|1,0,0]=3 8883 B10R1.30 CCc1cc(ccc1N)O 271570a_203496583355_100000686106 [1,1,0,0,0,0|1,0,0]=3 8884 B10R1.30 CCc1cc(ccc1O)Br 271570a_203496583355_100011216195 [1,1,0,0,0,0|0,0,0]=2 8885 B10R1.30 CCc1cc(ccc1O)N 271570a_203496583355_100010109747 [1,1,0,0,0,0|0,0,0]=2 8886 B10R1.30 CCc1cc(ccc1O)O 271570a_203496583355_100012338938 [1,1,0,0,0,0|0,0,0]=2 8887 B10R1.30 CCc1nc(ccc1N)O 271570a_203496583355_100009871203 [1,1,0,0,0,0|2,0,0]=4 8888 B10R1.30 CCn1cc(ccc1=O)O 271570a_203496583355_100000231005 [1,1,0,0,0,0|1,0,1]=4 8889 B10R1.30 CNc1cc(ccc1Br)Br 34a_100000737762_200000210301 [1,1,0,0,0,0|2,0,0]=4 8890 B10R1.30 CNc1cc(ccc1Br)C 34a_100000745044_200000210301 [1,1,0,0,0,0|2,0,0]=4 8891 B10R1.30 CNc1cc(ccc1Br)Cl 34a_100000687073_200000210301 [1,1,0,0,0,0|2,0,0]=4 8892 B10R1.30 CNc1cc(ccc1Br)F 34a_100000687223_200000210301 [1,1,0,0,0,0|2,0,0]=4 8893 B10R1.30 CNc1cc(ccc1Br)O 34a_100011999798_200000210301 [1,1,0,0,0,0|2,0,0]=4 8894 B10R1.30 CNc1cc(ccc1C)Br 34a_100000741167_200000210301 [1,1,0,0,0,0|2,0,0]=4 8895 B10R1.30 CNc1cc(ccc1C)Br 7a_100000741167_200000210301 [1,1,0,0,0,0|2,0,0]=4 8896 B10R1.30 CNc1cc(ccc1C)C 2230a_100000185781_200000210301 [1,1,0,0,0,0|2,0,0]=4 8897 B10R1.30 CNc1cc(ccc1C)C 34a_100000185781_200000210301 [1,1,0,0,0,0|2,0,0]=4 8898 B10R1.30 CNc1cc(ccc1C)C 7a_100000185781_200000210301 [1,1,0,0,0,0|2,0,0]=4 8899 B10R1.30 CNc1cc(ccc1C)Cl 34a_100000211374_200000210301 [1,1,0,0,0,0|2,0,0]=4 8900 B10R1.30 CNc1cc(ccc1C)Cl 7a_100000211374_200000210301 [1,1,0,0,0,0|2,0,0]=4 8901 B10R1.30 CNc1cc(ccc1C)F 34a_100000211107_200000210301 [1,1,0,0,0,0|2,0,0]=4 8902 B10R1.30 CNc1cc(ccc1C)F 7a_100000211107_200000210301 [1,1,0,0,0,0|2,0,0]=4 8903 B10R1.30 CNc1cc(ccc1C)I 7a_100000761890_200000210301 [1,1,0,0,0,0|2,0,0]=4 8904 B10R1.30 CNc1cc(ccc1C)O 271570a_203496583355_100020629602 [1,1,0,0,0,0|2,0,0]=4 8905 B10R1.30 CNc1cc(ccc1C)O 34a_100011216113_200000210301 [1,1,0,0,0,0|2,0,0]=4 8906 B10R1.30 CNc1cc(ccc1Cl)Br 34a_100000750497_200000210301 [1,1,0,0,0,0|2,0,0]=4 8907 B10R1.30 CNc1cc(ccc1Cl)C 34a_100011215360_200000210301 [1,1,0,0,0,0|2,0,0]=4 8908 B10R1.30 CNc1cc(ccc1Cl)Cl 34a_100000184485_200000210301 [1,1,0,0,0,0|2,0,0]=4 8909 B10R1.30 CNc1cc(ccc1Cl)F 34a_100000751338_200000210301 [1,1,0,0,0,0|2,0,0]=4 8910 B10R1.30 CNc1cc(ccc1Cl)I 34a_200000761891_200000210301 [1,1,0,0,0,0|2,0,0]=4 8911 B10R1.30 CNc1cc(ccc1Cl)O 34a_100011934297_200000210301 [1,1,0,0,0,0|2,0,0]=4 8912 B10R1.30 CNc1cc(ccc1F)Br 34a_100000740924_200000210301 [1,1,0,0,0,0|2,0,0]=4 8913 B10R1.30 CNc1cc(ccc1F)C 34a_100000211285_200000210301 [1,1,0,0,0,0|2,0,0]=4 8914 B10R1.30 CNc1cc(ccc1F)Cl 34a_100000212115_200000210301 [1,1,0,0,0,0|2,0,0]=4 8915 B10R1.30 CNc1cc(ccc1F)F 34a_100000210742_200000210301 [1,1,0,0,0,0|2,0,0]=4 8916 B10R1.30 CNc1cc(ccc1F)I 34a_100011464823_200000210301 [1,1,0,0,0,0|2,0,0]=4 8917 B10R1.30 CNc1cc(ccc1F)O 271570a_203496583355_100011314990 [1,1,0,0,0,0|2,0,0]=4 8918 B10R1.30 CNc1cc(ccc1F)O 34a_100012017239_200000210301 [1,1,0,0,0,0|2,0,0]=4 8919 B10R1.30 CNc1cc(ccc1I)Br 34a_100000743836_200000210301 [1,1,0,0,0,0|2,0,0]=4 8920 B10R1.30 CNc1cc(ccc1I)C 34a_100011216686_200000210301 [1,1,0,0,0,0|2,0,0]=4 8921 B10R1.30 CNc1cc(ccc1I)Cl 34a_100000761886_200000210301 [1,1,0,0,0,0|2,0,0]=4 8922 B10R1.30 CNc1cc(ccc1I)F 34a_100011218093_200000210301 [1,1,0,0,0,0|2,0,0]=4 8923 B10R1.30 CNc1cc(ccc1N)O 271570a_203496583355_100000694363 [1,1,0,0,0,0|2,0,0]=4 8924 B10R1.30 CNc1cc(ccc1O)Br 34a_100000752626_200000210301 [1,1,0,0,0,0|1,0,0]=3 8925 B10R1.30 CNc1cc(ccc1O)C 34a_100011215204_200000210301 [1,1,0,0,0,0|1,0,0]=3 8926 B10R1.30 CNc1cc(ccc1O)Cl 34a_100000210500_200000210301 [1,1,0,0,0,0|1,0,0]=3 8927 B10R1.30 CNc1cc(ccc1O)F 271570a_203496583355_100020633008 [1,1,0,0,0,0|1,0,0]=3 8928 B10R1.30 CNc1cc(ccc1O)F 34a_100000759472_200000210301 [1,1,0,0,0,0|1,0,0]=3 8929 B10R1.30 COc1cc(ccc1Br)Br 34a_100011220040_200000210301 [1,1,0,0,0,0|2,0,0]=4 8930 B10R1.30 COc1cc(ccc1Br)Br 7a_100011220040_200000210301 [1,1,0,0,0,0|2,0,0]=4 8931 B10R1.30 COc1cc(ccc1Br)C 34a_100012002257_200000210301 [1,1,0,0,0,0|2,0,0]=4 8932 B10R1.30 COc1cc(ccc1Br)C 7a_100012002257_200000210301 [1,1,0,0,0,0|2,0,0]=4 8933 B10R1.30 COc1cc(ccc1Br)Cl 34a_100012339455_200000210301 [1,1,0,0,0,0|2,0,0]=4 8934 B10R1.30 COc1cc(ccc1Br)Cl 7a_100012339455_200000210301 [1,1,0,0,0,0|2,0,0]=4 8935 B10R1.30 COc1cc(ccc1Br)F 34a_100000690578_200000210301 [1,1,0,0,0,0|2,0,0]=4 8936 B10R1.30 COc1cc(ccc1Br)F 7a_100000690578_200000210301 [1,1,0,0,0,0|2,0,0]=4 8937 B10R1.30 COc1cc(ccc1Br)I 34a_100012356990_200000210301 [1,1,0,0,0,0|2,0,0]=4 8938 B10R1.30 COc1cc(ccc1Br)I 7a_100012356990_200000210301 [1,1,0,0,0,0|2,0,0]=4 8939 B10R1.30 COc1cc(ccc1Br)O 271570a_203496583355_100012353699 [1,1,0,0,0,0|2,0,0]=4 8940 B10R1.30 COc1cc(ccc1C)Br 34a_100000685420_200000210301 [1,1,0,0,0,0|2,0,0]=4 8941 B10R1.30 COc1cc(ccc1C)Br 7a_100000685420_200000210301 [1,1,0,0,0,0|2,0,0]=4 8942 B10R1.30 COc1cc(ccc1C)C 34a_100000210931_200000210301 [1,1,0,0,0,0|2,0,0]=4 8943 B10R1.30 COc1cc(ccc1C)C 7a_100000210931_200000210301 [1,1,0,0,0,0|2,0,0]=4 8944 B10R1.30 COc1cc(ccc1C)Cl 34a_100000756515_200000210301 [1,1,0,0,0,0|2,0,0]=4 8945 B10R1.30 COc1cc(ccc1C)Cl 7a_100000756515_200000210301 [1,1,0,0,0,0|2,0,0]=4 8946 B10R1.30 COc1cc(ccc1C)F 34a_100000690566_200000210301 [1,1,0,0,0,0|2,0,0]=4 8947 B10R1.30 COc1cc(ccc1C)F 7a_100000690566_200000210301 [1,1,0,0,0,0|2,0,0]=4 8948 B10R1.30 COc1cc(ccc1C)I 7a_100000766334_200000210301 [1,1,0,0,0,0|2,0,0]=4 8949 B10R1.30 COc1cc(ccc1C)N 34a_100000759471_200000210301 [1,1,0,0,0,0|2,0,0]=4 8950 B10R1.30 COc1cc(ccc1C)N 7a_100000759471_200000210301 [1,1,0,0,0,0|2,0,0]=4 8951 B10R1.30 COc1cc(ccc1C)O 271570a_203496583355_100011830276 [1,1,0,0,0,0|2,0,0]=4 8952 B10R1.30 COc1cc(ccc1Cl)Br 34a_100000738945_200000210301 [1,1,0,0,0,0|2,0,0]=4 8953 B10R1.30 COc1cc(ccc1Cl)Br 7a_100000738945_200000210301 [1,1,0,0,0,0|2,0,0]=4 8954 B10R1.30 COc1cc(ccc1Cl)C 34a_100000211493_200000210301 [1,1,0,0,0,0|2,0,0]=4 8955 B10R1.30 COc1cc(ccc1Cl)C 7a_100000211493_200000210301 [1,1,0,0,0,0|2,0,0]=4 8956 B10R1.30 COc1cc(ccc1Cl)Cl 34a_100000211422_200000210301 [1,1,0,0,0,0|2,0,0]=4 8957 B10R1.30 COc1cc(ccc1Cl)Cl 7a_100000211422_200000210301 [1,1,0,0,0,0|2,0,0]=4 8958 B10R1.30 COc1cc(ccc1Cl)F 34a_100000692107_200000210301 [1,1,0,0,0,0|2,0,0]=4 8959 B10R1.30 COc1cc(ccc1Cl)F 7a_100000692107_200000210301 [1,1,0,0,0,0|2,0,0]=4 8960 B10R1.30 COc1cc(ccc1Cl)I 34a_100011356854_200000210301 [1,1,0,0,0,0|2,0,0]=4 8961 B10R1.30 COc1cc(ccc1Cl)I 7a_100011356854_200000210301 [1,1,0,0,0,0|2,0,0]=4 8962 B10R1.30 COc1cc(ccc1Cl)N 34a_100011934209_200000210301 [1,1,0,0,0,0|2,0,0]=4 8963 B10R1.30 COc1cc(ccc1Cl)O 271570a_203496583355_100011356853 [1,1,0,0,0,0|2,0,0]=4 8964 B10R1.30 COc1cc(ccc1F)Br 34a_100000686035_200000210301 [1,1,0,0,0,0|2,0,0]=4 8965 B10R1.30 COc1cc(ccc1F)Br 7a_100000686035_200000210301 [1,1,0,0,0,0|2,0,0]=4 8966 B10R1.30 COc1cc(ccc1F)C 34a_100000759540_200000210301 [1,1,0,0,0,0|2,0,0]=4 8967 B10R1.30 COc1cc(ccc1F)C 7a_100000759540_200000210301 [1,1,0,0,0,0|2,0,0]=4 8968 B10R1.30 COc1cc(ccc1F)Cl 34a_100000757397_200000210301 [1,1,0,0,0,0|2,0,0]=4 8969 B10R1.30 COc1cc(ccc1F)Cl 7a_100000757397_200000210301 [1,1,0,0,0,0|2,0,0]=4 8970 B10R1.30 COc1cc(ccc1F)F 34a_100000752141_200000210301 [1,1,0,0,0,0|2,0,0]=4 8971 B10R1.30 COc1cc(ccc1F)F 7a_100000752141_200000210301 [1,1,0,0,0,0|2,0,0]=4 8972 B10R1.30 COc1cc(ccc1F)I 34a_100009958187_200000210301 [1,1,0,0,0,0|2,0,0]=4 8973 B10R1.30 COc1cc(ccc1F)I 7a_100009958187_200000210301 [1,1,0,0,0,0|2,0,0]=4 8974 B10R1.30 COc1cc(ccc1F)N 34a_100012017398_200000210301 [1,1,0,0,0,0|2,0,0]=4 8975 B10R1.30 COc1cc(ccc1F)N 7a_100012017398_200000210301 [1,1,0,0,0,0|2,0,0]=4 8976 B10R1.30 COc1cc(ccc1F)O 271570a_203496583355_100011934186 [1,1,0,0,0,0|2,0,0]=4 8977 B10R1.30 COc1cc(ccc1I)Br 34a_100012344904_200000210301 [1,1,0,0,0,0|2,0,0]=4 8978 B10R1.30 COc1cc(ccc1I)Br 7a_100012344904_200000210301 [1,1,0,0,0,0|2,0,0]=4 8979 B10R1.30 COc1cc(ccc1I)Cl 34a_100000050036_200000210301 [1,1,0,0,0,0|2,0,0]=4 8980 B10R1.30 COc1cc(ccc1I)Cl 7a_100000050036_200000210301 [1,1,0,0,0,0|2,0,0]=4 8981 B10R1.30 COc1cc(ccc1I)F 34a_100010084537_200000210301 [1,1,0,0,0,0|2,0,0]=4 8982 B10R1.30 COc1cc(ccc1I)F 7a_100010084537_200000210301 [1,1,0,0,0,0|2,0,0]=4 8983 B10R1.30 COc1cc(ccc1N)Br 34a_100000739049_200000210301 [1,1,0,0,0,0|2,0,0]=4 8984 B10R1.30 COc1cc(ccc1N)Br 7a_100000739049_200000210301 [1,1,0,0,0,0|2,0,0]=4 8985 B10R1.30 COc1cc(ccc1N)C 34a_100000211527_200000210301 [1,1,0,0,0,0|2,0,0]=4 8986 B10R1.30 COc1cc(ccc1N)C 7a_100000211527_200000210301 [1,1,0,0,0,0|2,0,0]=4 8987 B10R1.30 COc1cc(ccc1N)Cl 34a_100000185728_200000210301 [1,1,0,0,0,0|2,0,0]=4 8988 B10R1.30 COc1cc(ccc1N)Cl 7a_100000185728_200000210301 [1,1,0,0,0,0|2,0,0]=4 8989 B10R1.30 COc1cc(ccc1N)F 34a_100000753323_200000210301 [1,1,0,0,0,0|2,0,0]=4 8990 B10R1.30 COc1cc(ccc1N)F 7a_100000753323_200000210301 [1,1,0,0,0,0|2,0,0]=4 8991 B10R1.30 COc1cc(ccc1N)I 34a_100000057187_200000210301 [1,1,0,0,0,0|2,0,0]=4 8992 B10R1.30 COc1cc(ccc1N)I 7a_100000057187_200000210301 [1,1,0,0,0,0|2,0,0]=4 8993 B10R1.30 COc1cc(ccc1N)N 34a_100025717382_200000210301 [1,1,0,0,0,0|2,0,0]=4 8994 B10R1.30 COc1cc(ccc1N)O 271570a_203496583355_100011279103 [1,1,0,0,0,0|2,0,0]=4 8995 B10R1.30 COc1cc(ccc1O)Br 271570a_203496583355_100010245111 [1,1,0,0,0,0|1,0,0]=3 8996 B10R1.30 COc1cc(ccc1O)C 271570a_203496583355_100010200004 [1,1,0,0,0,0|1,0,0]=3 8997 B10R1.30 COc1cc(ccc1O)Cl 271570a_203496583355_100000050115 [1,1,0,0,0,0|1,0,0]=3 8998 B10R1.30 COc1cc(ccc1O)F 271570a_203496583355_100000757151 [1,1,0,0,0,0|1,0,0]=3 8999 B10R1.30 COc1cc(ccc1O)N 271570a_203496583355_100000765947 [1,1,0,0,0,0|1,0,0]=3 9000 B10R1.30 COc1cc(ccc1O)O 271570a_203496583355_100000694246 [1,1,0,0,0,0|1,0,0]=3 9001 B10R1.30 COc1cc(ccc1O)O 271570a_203496583355_100011827694 [1,1,0,0,0,0|1,0,0]=3 9002 B10R1.30 COc1cc(cnc1O)C 271570a_203496583355_200000118316 [1,1,0,0,0,0|2,0,0]=4 9003 B10R1.30 COc1cc(cnc1O)F 271570a_203496583355_100009867738 [1,1,0,0,0,0|2,0,0]=4 9004 B10R1.30 COc1cc(cnc1O)N 271570a_203496583355_100000097218 [1,1,0,0,0,0|2,0,0]=4 9005 B10R1.30 COc1cc(ncc1O)C 271570a_203496583355_100000717771 [1,1,0,0,0,0|2,0,0]=4 9006 B10R1.30 COc1cc(ncc1O)Cl 271570a_203496583355_100010154656 [1,1,0,0,0,0|2,0,0]=4 9007 B10R1.30 COc1cc(ncc1O)F 271570a_203496583355_100010135560 [1,1,0,0,0,0|2,0,0]=4 9008 B10R1.30 COc1cc(ncc1O)N 271570a_203496583355_100015506990 [1,1,0,0,0,0|2,0,0]=4 9009 B10R1.30 COc1nc(ccc1O)C 271570a_203496583355_100010138632 [1,1,0,0,0,0|2,0,0]=4 9010 B10R1.30 COc1nc(ccc1O)N 271570a_203496583355_100010187630 [1,1,0,0,0,0|2,0,0]=4 9011 B10R1.30 COc1nc(ccc1O)O 271570a_203496583355_100010893133 [1,1,0,0,0,0|2,0,0]=4 9012 B10R1.30 CSc1cc(ccc1Br)Br 62a_100011483371_200000210301 [1,1,0,0,0,0|2,0,0]=4 9013 B10R1.30 CSc1cc(ccc1Br)Br 62a_200000210301_100011483371 [1,1,0,0,0,0|2,0,0]=4 9014 B10R1.30 CSc1cc(ccc1Br)C 62a_100012353751_200000210301 [1,1,0,0,0,0|2,0,0]=4 9015 B10R1.30 CSc1cc(ccc1Br)C 62a_200000210301_100012353751 [1,1,0,0,0,0|2,0,0]=4 9016 B10R1.30 CSc1cc(ccc1Br)Cl 62a_100012339723_200000210301 [1,1,0,0,0,0|2,0,0]=4 9017 B10R1.30 CSc1cc(ccc1Br)Cl 62a_200000210301_100012339723 [1,1,0,0,0,0|2,0,0]=4 9018 B10R1.30 CSc1cc(ccc1Br)F 62a_100011217576_200000210301 [1,1,0,0,0,0|2,0,0]=4 9019 B10R1.30 CSc1cc(ccc1Br)F 62a_200000210301_100011217576 [1,1,0,0,0,0|2,0,0]=4 9020 B10R1.30 CSc1cc(ccc1Br)N 62a_100000750459_200000210301 [1,1,0,0,0,0|2,0,0]=4 9021 B10R1.30 CSc1cc(ccc1Br)N 62a_200000210301_100000750459 [1,1,0,0,0,0|2,0,0]=4 9022 B10R1.30 CSc1cc(ccc1Br)O 62a_100012339312_200000210301 [1,1,0,0,0,0|2,0,0]=4 9023 B10R1.30 CSc1cc(ccc1Br)O 62a_200000210301_100012339312 [1,1,0,0,0,0|2,0,0]=4 9024 B10R1.30 CSc1cc(ccc1C)Br 62a_100011344865_200000210301 [1,1,0,0,0,0|2,0,0]=4 9025 B10R1.30 CSc1cc(ccc1C)Br 62a_200000210301_100011344865 [1,1,0,0,0,0|2,0,0]=4 9026 B10R1.30 CSc1cc(ccc1C)C 62a_100000210833_200000210301 [1,1,0,0,0,0|2,0,0]=4 9027 B10R1.30 CSc1cc(ccc1C)C 62a_200000210301_100000210833 [1,1,0,0,0,0|2,0,0]=4 9028 B10R1.30 CSc1cc(ccc1C)Cl 62a_100011263213_200000210301 [1,1,0,0,0,0|2,0,0]=4 9029 B10R1.30 CSc1cc(ccc1C)Cl 62a_200000210301_100011263213 [1,1,0,0,0,0|2,0,0]=4 9030 B10R1.30 CSc1cc(ccc1C)F 62a_100011218078_200000210301 [1,1,0,0,0,0|2,0,0]=4 9031 B10R1.30 CSc1cc(ccc1C)F 62a_200000210301_100011218078 [1,1,0,0,0,0|2,0,0]=4 9032 B10R1.30 CSc1cc(ccc1C)N 62a_100000736455_200000210301 [1,1,0,0,0,0|2,0,0]=4 9033 B10R1.30 CSc1cc(ccc1C)N 62a_200000210301_100000736455 [1,1,0,0,0,0|2,0,0]=4 9034 B10R1.30 CSc1cc(ccc1C)O 62a_100011380479_200000210301 [1,1,0,0,0,0|2,0,0]=4 9035 B10R1.30 CSc1cc(ccc1C)O 62a_200000210301_100011380479 [1,1,0,0,0,0|2,0,0]=4 9036 B10R1.30 CSc1cc(ccc1Cl)Br 62a_100011772130_200000210301 [1,1,0,0,0,0|2,0,0]=4 9037 B10R1.30 CSc1cc(ccc1Cl)Br 62a_200000210301_100011772130 [1,1,0,0,0,0|2,0,0]=4 9038 B10R1.30 CSc1cc(ccc1Cl)C 62a_100012356289_200000210301 [1,1,0,0,0,0|2,0,0]=4 9039 B10R1.30 CSc1cc(ccc1Cl)C 62a_200000210301_100012356289 [1,1,0,0,0,0|2,0,0]=4 9040 B10R1.30 CSc1cc(ccc1Cl)Cl 62a_100000707729_200000210301 [1,1,0,0,0,0|2,0,0]=4 9041 B10R1.30 CSc1cc(ccc1Cl)Cl 62a_200000210301_100000707729 [1,1,0,0,0,0|2,0,0]=4 9042 B10R1.30 CSc1cc(ccc1Cl)F 62a_100011217299_200000210301 [1,1,0,0,0,0|2,0,0]=4 9043 B10R1.30 CSc1cc(ccc1Cl)F 62a_200000210301_100011217299 [1,1,0,0,0,0|2,0,0]=4 9044 B10R1.30 CSc1cc(ccc1Cl)N 62a_100012360549_200000210301 [1,1,0,0,0,0|2,0,0]=4 9045 B10R1.30 CSc1cc(ccc1Cl)N 62a_200000210301_100012360549 [1,1,0,0,0,0|2,0,0]=4 9046 B10R1.30 CSc1cc(ccc1Cl)O 62a_100000049588_200000210301 [1,1,0,0,0,0|2,0,0]=4 9047 B10R1.30 CSc1cc(ccc1Cl)O 62a_200000210301_100000049588 [1,1,0,0,0,0|2,0,0]=4 9048 B10R1.30 CSc1cc(ccc1F)Br 62a_100011217312_200000210301 [1,1,0,0,0,0|2,0,0]=4 9049 B10R1.30 CSc1cc(ccc1F)Br 62a_200000210301_100011217312 [1,1,0,0,0,0|2,0,0]=4 9050 B10R1.30 CSc1cc(ccc1F)C 62a_100000736223_200000210301 [1,1,0,0,0,0|2,0,0]=4 9051 B10R1.30 CSc1cc(ccc1F)C 62a_200000210301_100000736223 [1,1,0,0,0,0|2,0,0]=4 9052 B10R1.30 CSc1cc(ccc1F)Cl 62a_100011218116_200000210301 [1,1,0,0,0,0|2,0,0]=4 9053 B10R1.30 CSc1cc(ccc1F)Cl 62a_200000210301_100011218116 [1,1,0,0,0,0|2,0,0]=4 9054 B10R1.30 CSc1cc(ccc1F)F 62a_100011219198_200000210301 [1,1,0,0,0,0|2,0,0]=4 9055 B10R1.30 CSc1cc(ccc1F)F 62a_200000210301_100011219198 [1,1,0,0,0,0|2,0,0]=4 9056 B10R1.30 CSc1cc(ccc1F)N 62a_100000760356_200000210301 [1,1,0,0,0,0|2,0,0]=4 9057 B10R1.30 CSc1cc(ccc1F)N 62a_200000210301_100000760356 [1,1,0,0,0,0|2,0,0]=4 9058 B10R1.30 CSc1cc(ccc1F)O 271570a_203496583355_100010341305 [1,1,0,0,0,0|2,0,0]=4 9059 B10R1.30 CSc1cc(ccc1F)O 62a_100000693481_200000210301 [1,1,0,0,0,0|2,0,0]=4 9060 B10R1.30 CSc1cc(ccc1F)O 62a_200000210301_100000693481 [1,1,0,0,0,0|2,0,0]=4 9061 B10R1.30 CSc1cc(ccc1N)Br 62a_100000187925_200000210301 [1,1,0,0,0,0|2,0,0]=4 9062 B10R1.30 CSc1cc(ccc1N)Br 62a_200000210301_100000187925 [1,1,0,0,0,0|2,0,0]=4 9063 B10R1.30 CSc1cc(ccc1N)C 62a_100011356834_200000210301 [1,1,0,0,0,0|2,0,0]=4 9064 B10R1.30 CSc1cc(ccc1N)C 62a_200000210301_100011356834 [1,1,0,0,0,0|2,0,0]=4 9065 B10R1.30 CSc1cc(ccc1N)Cl 62a_100000761889_200000210301 [1,1,0,0,0,0|2,0,0]=4 9066 B10R1.30 CSc1cc(ccc1N)Cl 62a_200000210301_100000761889 [1,1,0,0,0,0|2,0,0]=4 9067 B10R1.30 CSc1cc(ccc1N)F 62a_100000760547_200000210301 [1,1,0,0,0,0|2,0,0]=4 9068 B10R1.30 CSc1cc(ccc1N)F 62a_200000210301_100000760547 [1,1,0,0,0,0|2,0,0]=4 9069 B10R1.30 CSc1cc(ccc1N)N 62a_100011534242_200000210301 [1,1,0,0,0,0|2,0,0]=4 9070 B10R1.30 CSc1cc(ccc1N)N 62a_200000210301_100011534242 [1,1,0,0,0,0|2,0,0]=4 9071 B10R1.30 CSc1cc(ccc1N)O 62a_100012001276_200000210301 [1,1,0,0,0,0|2,0,0]=4 9072 B10R1.30 CSc1cc(ccc1N)O 62a_200000210301_100012001276 [1,1,0,0,0,0|2,0,0]=4 9073 B10R1.30 CSc1cc(ccc1O)Br 62a_100012355227_200000210301 [1,1,0,0,0,0|1,0,0]=3 9074 B10R1.30 CSc1cc(ccc1O)Br 62a_200000210301_100012355227 [1,1,0,0,0,0|1,0,0]=3 9075 B10R1.30 CSc1cc(ccc1O)C 271570a_203496583355_200010709736 [1,1,0,0,0,0|1,0,0]=3 9076 B10R1.30 CSc1cc(ccc1O)C 62a_100000765521_200000210301 [1,1,0,0,0,0|1,0,0]=3 9077 B10R1.30 CSc1cc(ccc1O)C 62a_200000210301_100000765521 [1,1,0,0,0,0|1,0,0]=3 9078 B10R1.30 CSc1cc(ccc1O)Cl 62a_100011356953_200000210301 [1,1,0,0,0,0|1,0,0]=3 9079 B10R1.30 CSc1cc(ccc1O)Cl 62a_200000210301_100011356953 [1,1,0,0,0,0|1,0,0]=3 9080 B10R1.30 CSc1cc(ccc1O)F 62a_100000211999_200000210301 [1,1,0,0,0,0|1,0,0]=3 9081 B10R1.30 CSc1cc(ccc1O)F 62a_200000210301_100000211999 [1,1,0,0,0,0|1,0,0]=3 9082 B10R1.30 CSc1cc(ccc1O)N 62a_100011534360_200000210301 [1,1,0,0,0,0|1,0,0]=3 9083 B10R1.30 CSc1cc(ccc1O)N 62a_200000210301_100011534360 [1,1,0,0,0,0|1,0,0]=3 9084 B10R1.30 CSc1cc(ccc1O)O 62a_200000210301_100009813629 [1,1,0,0,0,0|1,0,0]=3 9085 B10R1.30 CSc1cc(cnc1O)Br 62a_100010197142_200000210301 [1,1,0,0,0,0|2,0,0]=4 9086 B10R1.30 CSc1cc(cnc1O)Br 62a_200000210301_100010197142 [1,1,0,0,0,0|2,0,0]=4 9087 B10R1.30 CSc1cc(cnc1O)C 271570a_203496583355_100010884634 [1,1,0,0,0,0|2,0,0]=4 9088 B10R1.30 CSc1cc(cnc1O)C 62a_100000719714_200000210301 [1,1,0,0,0,0|2,0,0]=4 9089 B10R1.30 CSc1cc(cnc1O)C 62a_200000210301_100000719714 [1,1,0,0,0,0|2,0,0]=4 9090 B10R1.30 CSc1cc(cnc1O)Cl 62a_100010188700_200000210301 [1,1,0,0,0,0|2,0,0]=4 9091 B10R1.30 CSc1cc(cnc1O)Cl 62a_200000210301_100010188700 [1,1,0,0,0,0|2,0,0]=4 9092 B10R1.30 CSc1cc(ncc1O)C 62a_100009843476_200000210301 [1,1,0,0,0,0|2,0,0]=4 9093 B10R1.30 CSc1cc(ncc1O)C 62a_200000210301_100009843476 [1,1,0,0,0,0|2,0,0]=4 9094 B10R1.30 CSc1cc(ncc1O)Cl 62a_100000698892_200000210301 [1,1,0,0,0,0|2,0,0]=4 9095 B10R1.30 CSc1cc(ncc1O)Cl 62a_200000210301_100000698892 [1,1,0,0,0,0|2,0,0]=4 9096 B10R1.30 CSc1nc(ccc1O)Br 62a_100010253912_200000210301 [1,1,0,0,0,0|2,0,0]=4 9097 B10R1.30 CSc1nc(ccc1O)Br 62a_200000210301_100010253912 [1,1,0,0,0,0|2,0,0]=4 9098 B10R1.30 CSc1nc(ccc1O)C 62a_100000702858_200000210301 [1,1,0,0,0,0|2,0,0]=4 9099 B10R1.30 CSc1nc(ccc1O)C 62a_200000210301_100000702858 [1,1,0,0,0,0|2,0,0]=4 9100 B10R1.30 CSc1nc(ccc1O)Cl 62a_200000210301_100000696390 [1,1,0,0,0,0|2,0,0]=4 9101 B10R1.30 CSc1nc(ccc1O)F 62a_100010382442_200000210301 [1,1,0,0,0,0|2,0,0]=4 9102 B10R1.30 CSc1nc(ccc1O)F 62a_200000210301_100010382442 [1,1,0,0,0,0|2,0,0]=4 9103 B10R1.30 Cc1cc(c(cn1)O)CO 271570a_203496583355_100015579599 [1,1,0,0,0,0|2,0,0]=4 9104 B10R1.30 Cc1cc(c(cn1)O)S[13CH3] 62a_100009843476_200025704644 [1,1,0,0,0,0|2,0,0]=4 9105 B10R1.30 Cc1cc(c(cn1)O)S[13CH3] 62a_200025704644_100009843476 [1,1,0,0,0,0|2,0,0]=4 9106 B10R1.30 Cc1ccc(c(c1)C#N)O 271570a_203496583355_100011935190 [1,1,0,0,0,0|1,0,1]=4 9107 B10R1.30 Cc1ccc(c(c1)C=O)O 271570a_203496583355_100011551863 [1,1,0,0,0,0|1,0,1]=4 9108 B10R1.30 Cc1ccc(c(c1)CO)O 271570a_203496583355_100012361352 [1,1,0,0,0,0|1,0,0]=3 9109 B10R1.30 Cc1ccc(c(c1)N[13CH3])Br 34a_100000745044_200025704644 [1,1,0,0,0,0|2,0,0]=4 9110 B10R1.30 Cc1ccc(c(c1)N[13CH3])C 2230a_100000185781_200025704644 [1,1,0,0,0,0|2,0,0]=4 9111 B10R1.30 Cc1ccc(c(c1)N[13CH3])C 34a_100000185781_200025704644 [1,1,0,0,0,0|2,0,0]=4 9112 B10R1.30 Cc1ccc(c(c1)N[13CH3])C 7a_100000185781_200025704644 [1,1,0,0,0,0|2,0,0]=4 9113 B10R1.30 Cc1ccc(c(c1)N[13CH3])Cl 34a_100011215360_200025704644 [1,1,0,0,0,0|2,0,0]=4 9114 B10R1.30 Cc1ccc(c(c1)N[13CH3])F 34a_100000211285_200025704644 [1,1,0,0,0,0|2,0,0]=4 9115 B10R1.30 Cc1ccc(c(c1)N[13CH3])I 34a_100011216686_200025704644 [1,1,0,0,0,0|2,0,0]=4 9116 B10R1.30 Cc1ccc(c(c1)N[13CH3])O 34a_100011215204_200025704644 [1,1,0,0,0,0|1,0,0]=3 9117 B10R1.30 Cc1ccc(c(c1)O[13CH3])Br 34a_100012002257_200025704644 [1,1,0,0,0,0|2,0,0]=4 9118 B10R1.30 Cc1ccc(c(c1)O[13CH3])Br 7a_100012002257_200025704644 [1,1,0,0,0,0|2,0,0]=4 9119 B10R1.30 Cc1ccc(c(c1)O[13CH3])C 34a_100000210931_200025704644 [1,1,0,0,0,0|2,0,0]=4 9120 B10R1.30 Cc1ccc(c(c1)O[13CH3])C 7a_100000210931_200025704644 [1,1,0,0,0,0|2,0,0]=4 9121 B10R1.30 Cc1ccc(c(c1)O[13CH3])Cl 34a_100000211493_200025704644 [1,1,0,0,0,0|2,0,0]=4 9122 B10R1.30 Cc1ccc(c(c1)O[13CH3])Cl 7a_100000211493_200025704644 [1,1,0,0,0,0|2,0,0]=4 9123 B10R1.30 Cc1ccc(c(c1)O[13CH3])F 34a_100000759540_200025704644 [1,1,0,0,0,0|2,0,0]=4 9124 B10R1.30 Cc1ccc(c(c1)O[13CH3])F 7a_100000759540_200025704644 [1,1,0,0,0,0|2,0,0]=4 9125 B10R1.30 Cc1ccc(c(c1)O[13CH3])N 34a_100000211527_200025704644 [1,1,0,0,0,0|2,0,0]=4 9126 B10R1.30 Cc1ccc(c(c1)O[13CH3])N 7a_100000211527_200025704644 [1,1,0,0,0,0|2,0,0]=4 9127 B10R1.30 Cc1ccc(c(c1)S[13CH3])Br 62a_100012353751_200025704644 [1,1,0,0,0,0|2,0,0]=4 9128 B10R1.30 Cc1ccc(c(c1)S[13CH3])Br 62a_200025704644_100012353751 [1,1,0,0,0,0|2,0,0]=4 9129 B10R1.30 Cc1ccc(c(c1)S[13CH3])C 62a_100000210833_200025704644 [1,1,0,0,0,0|2,0,0]=4 9130 B10R1.30 Cc1ccc(c(c1)S[13CH3])C 62a_200025704644_100000210833 [1,1,0,0,0,0|2,0,0]=4 9131 B10R1.30 Cc1ccc(c(c1)S[13CH3])Cl 62a_100012356289_200025704644 [1,1,0,0,0,0|2,0,0]=4 9132 B10R1.30 Cc1ccc(c(c1)S[13CH3])Cl 62a_200025704644_100012356289 [1,1,0,0,0,0|2,0,0]=4 9133 B10R1.30 Cc1ccc(c(c1)S[13CH3])F 62a_100000736223_200025704644 [1,1,0,0,0,0|2,0,0]=4 9134 B10R1.30 Cc1ccc(c(c1)S[13CH3])F 62a_200025704644_100000736223 [1,1,0,0,0,0|2,0,0]=4 9135 B10R1.30 Cc1ccc(c(c1)S[13CH3])N 62a_100011356834_200025704644 [1,1,0,0,0,0|2,0,0]=4 9136 B10R1.30 Cc1ccc(c(c1)S[13CH3])N 62a_200025704644_100011356834 [1,1,0,0,0,0|2,0,0]=4 9137 B10R1.30 Cc1ccc(c(c1)S[13CH3])O 62a_100000765521_200025704644 [1,1,0,0,0,0|1,0,0]=3 9138 B10R1.30 Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100000765521 [1,1,0,0,0,0|1,0,0]=3 9139 B10R1.30 Cc1ccc(c(n1)CO)O 271570a_203496583355_100010074375 [1,1,0,0,0,0|2,0,0]=4 9140 B10R1.30 Cc1ccc(c(n1)S[13CH3])O 62a_100000702858_200025704644 [1,1,0,0,0,0|2,0,0]=4 9141 B10R1.30 Cc1ccc(c(n1)S[13CH3])O 62a_200025704644_100000702858 [1,1,0,0,0,0|2,0,0]=4 9142 B10R1.30 Cc1ccc(cc1CO)O 271570a_203496583355_100000700630 [1,1,0,0,0,0|2,0,0]=4 9143 B10R1.30 Cc1ccc(cc1N[13CH3])Br 34a_100000741167_200025704644 [1,1,0,0,0,0|2,0,0]=4 9144 B10R1.30 Cc1ccc(cc1N[13CH3])Br 7a_100000741167_200025704644 [1,1,0,0,0,0|2,0,0]=4 9145 B10R1.30 Cc1ccc(cc1N[13CH3])Cl 34a_100000211374_200025704644 [1,1,0,0,0,0|2,0,0]=4 9146 B10R1.30 Cc1ccc(cc1N[13CH3])Cl 7a_100000211374_200025704644 [1,1,0,0,0,0|2,0,0]=4 9147 B10R1.30 Cc1ccc(cc1N[13CH3])F 34a_100000211107_200025704644 [1,1,0,0,0,0|2,0,0]=4 9148 B10R1.30 Cc1ccc(cc1N[13CH3])F 7a_100000211107_200025704644 [1,1,0,0,0,0|2,0,0]=4 9149 B10R1.30 Cc1ccc(cc1N[13CH3])I 7a_100000761890_200025704644 [1,1,0,0,0,0|2,0,0]=4 9150 B10R1.30 Cc1ccc(cc1N[13CH3])O 34a_100011216113_200025704644 [1,1,0,0,0,0|2,0,0]=4 9151 B10R1.30 Cc1ccc(cc1O[13CH3])Br 34a_100000685420_200025704644 [1,1,0,0,0,0|2,0,0]=4 9152 B10R1.30 Cc1ccc(cc1O[13CH3])Br 7a_100000685420_200025704644 [1,1,0,0,0,0|2,0,0]=4 9153 B10R1.30 Cc1ccc(cc1O[13CH3])Cl 34a_100000756515_200025704644 [1,1,0,0,0,0|2,0,0]=4 9154 B10R1.30 Cc1ccc(cc1O[13CH3])Cl 7a_100000756515_200025704644 [1,1,0,0,0,0|2,0,0]=4 9155 B10R1.30 Cc1ccc(cc1O[13CH3])F 34a_100000690566_200025704644 [1,1,0,0,0,0|2,0,0]=4 9156 B10R1.30 Cc1ccc(cc1O[13CH3])F 7a_100000690566_200025704644 [1,1,0,0,0,0|2,0,0]=4 9157 B10R1.30 Cc1ccc(cc1O[13CH3])I 7a_100000766334_200025704644 [1,1,0,0,0,0|2,0,0]=4 9158 B10R1.30 Cc1ccc(cc1O[13CH3])N 34a_100000759471_200025704644 [1,1,0,0,0,0|2,0,0]=4 9159 B10R1.30 Cc1ccc(cc1O[13CH3])N 7a_100000759471_200025704644 [1,1,0,0,0,0|2,0,0]=4 9160 B10R1.30 Cc1ccc(cc1S[13CH3])Br 62a_100011344865_200025704644 [1,1,0,0,0,0|2,0,0]=4 9161 B10R1.30 Cc1ccc(cc1S[13CH3])Br 62a_200025704644_100011344865 [1,1,0,0,0,0|2,0,0]=4 9162 B10R1.30 Cc1ccc(cc1S[13CH3])Cl 62a_100011263213_200025704644 [1,1,0,0,0,0|2,0,0]=4 9163 B10R1.30 Cc1ccc(cc1S[13CH3])Cl 62a_200025704644_100011263213 [1,1,0,0,0,0|2,0,0]=4 9164 B10R1.30 Cc1ccc(cc1S[13CH3])F 62a_100011218078_200025704644 [1,1,0,0,0,0|2,0,0]=4 9165 B10R1.30 Cc1ccc(cc1S[13CH3])F 62a_200025704644_100011218078 [1,1,0,0,0,0|2,0,0]=4 9166 B10R1.30 Cc1ccc(cc1S[13CH3])N 62a_100000736455_200025704644 [1,1,0,0,0,0|2,0,0]=4 9167 B10R1.30 Cc1ccc(cc1S[13CH3])N 62a_200025704644_100000736455 [1,1,0,0,0,0|2,0,0]=4 9168 B10R1.30 Cc1ccc(cc1S[13CH3])O 62a_100011380479_200025704644 [1,1,0,0,0,0|2,0,0]=4 9169 B10R1.30 Cc1ccc(cc1S[13CH3])O 62a_200025704644_100011380479 [1,1,0,0,0,0|2,0,0]=4 9170 B10R1.30 Cc1cnc(c(c1)CO)O 271570a_203496583355_100000118064 [1,1,0,0,0,0|2,0,0]=4 9171 B10R1.30 Cc1cnc(c(c1)S[13CH3])O 62a_100000719714_200025704644 [1,1,0,0,0,0|2,0,0]=4 9172 B10R1.30 Cc1cnc(c(c1)S[13CH3])O 62a_200025704644_100000719714 [1,1,0,0,0,0|2,0,0]=4 9173 B10R1.30 N#Cc1cc(ccc1O)Br 271570a_203496583355_100011219714 [1,1,0,0,0,0|1,0,1]=4 9174 B10R1.30 N#Cc1cc(ccc1O)Cl 271570a_203496583355_200011356825 [1,1,0,0,0,0|1,0,1]=4 9175 B10R1.30 N#Cc1cc(ccc1O)F 271570a_203496583355_100000747550 [1,1,0,0,0,0|1,0,1]=4 9176 B10R1.30 N#Cc1cc(ccc1O)N 271570a_203496583355_100011934039 [1,1,0,0,0,0|1,0,1]=4 9177 B10R1.30 N#Cc1cc(ccc1O)O 271570a_203496583355_100000687585 [1,1,0,0,0,0|1,0,1]=4 9178 B10R1.30 N#Cc1cc(ccc1O)O 271570a_203496583355_100009818209 [1,1,0,0,0,0|1,0,1]=4 9179 B10R1.30 NCc1cc(ccc1F)O 271570a_203496583355_100009815772 [1,1,0,0,0,0|2,0,0]=4 9180 B10R1.30 NCc1cc(ccc1N)O 271570a_203496583355_100012349119 [1,1,0,0,0,0|2,0,0]=4 9181 B10R1.30 NCc1cc(ccc1O)F 271570a_203496583355_100000742738 [1,1,0,0,0,0|1,0,0]=3 9182 B10R1.30 NCc1cc(ccc1O)O 271570a_203496583355_100000730032 [1,1,0,0,0,0|1,0,0]=3 9183 B10R1.30 NCc1cc(cnc1O)F 271570a_203496583355_100010760786 [1,1,0,0,0,0|2,0,0]=4 9184 B10R1.30 NNc1cc(ccc1O)F 271570a_203496583355_100012362518 [1,1,0,0,0,0|2,0,0]=4 9185 B10R1.30 Nc1ccc(c(c1)CO)O 271570a_203496583355_100012347228 [1,1,0,0,0,0|1,0,0]=3 9186 B10R1.30 Nc1ccc(cc1CO)O 271570a_203496583355_100012353972 [1,1,0,0,0,0|2,0,0]=4 9187 B10R1.30 O=Cc1cc(ccc1O)Br 271570a_203496583355_100010185651 [1,1,0,0,0,0|1,0,1]=4 9188 B10R1.30 O=Cc1cc(ccc1O)Cl 271570a_203496583355_100010254386 [1,1,0,0,0,0|1,0,1]=4 9189 B10R1.30 O=Cc1cc(ccc1O)F 271570a_203496583355_100011218309 [1,1,0,0,0,0|1,0,1]=4 9190 B10R1.30 O=Cc1cc(ccc1O)O 271570a_203496583355_100000186750 [1,1,0,0,0,0|1,0,1]=4 9191 B10R1.30 O=Cc1cc(ccc1O)O 271570a_203496583355_100000690577 [1,1,0,0,0,0|1,0,1]=4 9192 B10R1.30 OCc1cc(ccc1Br)O 271570a_203496583355_100012359683 [1,1,0,0,0,0|2,0,0]=4 9193 B10R1.30 OCc1cc(ccc1Cl)O 271570a_203496583355_100010128486 [1,1,0,0,0,0|2,0,0]=4 9194 B10R1.30 OCc1cc(ccc1F)O 271570a_203496583355_100000049604 [1,1,0,0,0,0|2,0,0]=4 9195 B10R1.30 OCc1cc(ccc1O)Br 271570a_203496583355_100011356890 [1,1,0,0,0,0|1,0,0]=3 9196 B10R1.30 OCc1cc(ccc1O)F 271570a_203496583355_100011217561 [1,1,0,0,0,0|1,0,0]=3 9197 B10R1.30 OCc1cc(ccc1O)O 271570a_203496583355_100000184703 [1,1,0,0,0,0|1,0,0]=3 9198 B10R1.30 OCc1cc(ccc1O)O 271570a_203496583355_100012351483 [1,1,0,0,0,0|1,0,0]=3 9199 B10R1.30 OCc1cc(cnc1O)F 271570a_203496583355_100000079972 [1,1,0,0,0,0|2,0,0]=4 9200 B10R1.30 OCc1cc(cnc1O)O 271570a_203496583355_100010065268 [1,1,0,0,0,0|2,0,0]=4 9201 B10R1.30 OCc1nc(ccc1O)F 271570a_203496583355_100000701195 [1,1,0,0,0,0|2,0,0]=4 9202 B10R1.30 [13CH3]Nc1cc(ccc1Br)Br 34a_100000737762_200025704644 [1,1,0,0,0,0|2,0,0]=4 9203 B10R1.30 [13CH3]Nc1cc(ccc1Br)Cl 34a_100000687073_200025704644 [1,1,0,0,0,0|2,0,0]=4 9204 B10R1.30 [13CH3]Nc1cc(ccc1Br)F 34a_100000687223_200025704644 [1,1,0,0,0,0|2,0,0]=4 9205 B10R1.30 [13CH3]Nc1cc(ccc1Br)O 34a_100011999798_200025704644 [1,1,0,0,0,0|2,0,0]=4 9206 B10R1.30 [13CH3]Nc1cc(ccc1Cl)Br 34a_100000750497_200025704644 [1,1,0,0,0,0|2,0,0]=4 9207 B10R1.30 [13CH3]Nc1cc(ccc1Cl)Cl 34a_100000184485_200025704644 [1,1,0,0,0,0|2,0,0]=4 9208 B10R1.30 [13CH3]Nc1cc(ccc1Cl)F 34a_100000751338_200025704644 [1,1,0,0,0,0|2,0,0]=4 9209 B10R1.30 [13CH3]Nc1cc(ccc1Cl)I 34a_200000761891_200025704644 [1,1,0,0,0,0|2,0,0]=4 9210 B10R1.30 [13CH3]Nc1cc(ccc1Cl)O 34a_100011934297_200025704644 [1,1,0,0,0,0|2,0,0]=4 9211 B10R1.30 [13CH3]Nc1cc(ccc1F)Br 34a_100000740924_200025704644 [1,1,0,0,0,0|2,0,0]=4 9212 B10R1.30 [13CH3]Nc1cc(ccc1F)Cl 34a_100000212115_200025704644 [1,1,0,0,0,0|2,0,0]=4 9213 B10R1.30 [13CH3]Nc1cc(ccc1F)F 34a_100000210742_200025704644 [1,1,0,0,0,0|2,0,0]=4 9214 B10R1.30 [13CH3]Nc1cc(ccc1F)I 34a_100011464823_200025704644 [1,1,0,0,0,0|2,0,0]=4 9215 B10R1.30 [13CH3]Nc1cc(ccc1F)O 34a_100012017239_200025704644 [1,1,0,0,0,0|2,0,0]=4 9216 B10R1.30 [13CH3]Nc1cc(ccc1I)Br 34a_100000743836_200025704644 [1,1,0,0,0,0|2,0,0]=4 9217 B10R1.30 [13CH3]Nc1cc(ccc1I)Cl 34a_100000761886_200025704644 [1,1,0,0,0,0|2,0,0]=4 9218 B10R1.30 [13CH3]Nc1cc(ccc1I)F 34a_100011218093_200025704644 [1,1,0,0,0,0|2,0,0]=4 9219 B10R1.30 [13CH3]Nc1cc(ccc1O)Br 34a_100000752626_200025704644 [1,1,0,0,0,0|1,0,0]=3 9220 B10R1.30 [13CH3]Nc1cc(ccc1O)Cl 34a_100000210500_200025704644 [1,1,0,0,0,0|1,0,0]=3 9221 B10R1.30 [13CH3]Nc1cc(ccc1O)F 34a_100000759472_200025704644 [1,1,0,0,0,0|1,0,0]=3 9222 B10R1.30 [13CH3]Oc1cc(ccc1Br)Br 34a_100011220040_200025704644 [1,1,0,0,0,0|2,0,0]=4 9223 B10R1.30 [13CH3]Oc1cc(ccc1Br)Br 7a_100011220040_200025704644 [1,1,0,0,0,0|2,0,0]=4 9224 B10R1.30 [13CH3]Oc1cc(ccc1Br)Cl 34a_100012339455_200025704644 [1,1,0,0,0,0|2,0,0]=4 9225 B10R1.30 [13CH3]Oc1cc(ccc1Br)Cl 7a_100012339455_200025704644 [1,1,0,0,0,0|2,0,0]=4 9226 B10R1.30 [13CH3]Oc1cc(ccc1Br)F 34a_100000690578_200025704644 [1,1,0,0,0,0|2,0,0]=4 9227 B10R1.30 [13CH3]Oc1cc(ccc1Br)F 7a_100000690578_200025704644 [1,1,0,0,0,0|2,0,0]=4 9228 B10R1.30 [13CH3]Oc1cc(ccc1Br)I 34a_100012356990_200025704644 [1,1,0,0,0,0|2,0,0]=4 9229 B10R1.30 [13CH3]Oc1cc(ccc1Br)I 7a_100012356990_200025704644 [1,1,0,0,0,0|2,0,0]=4 9230 B10R1.30 [13CH3]Oc1cc(ccc1Cl)Br 34a_100000738945_200025704644 [1,1,0,0,0,0|2,0,0]=4 9231 B10R1.30 [13CH3]Oc1cc(ccc1Cl)Br 7a_100000738945_200025704644 [1,1,0,0,0,0|2,0,0]=4 9232 B10R1.30 [13CH3]Oc1cc(ccc1Cl)Cl 34a_100000211422_200025704644 [1,1,0,0,0,0|2,0,0]=4 9233 B10R1.30 [13CH3]Oc1cc(ccc1Cl)Cl 7a_100000211422_200025704644 [1,1,0,0,0,0|2,0,0]=4 9234 B10R1.30 [13CH3]Oc1cc(ccc1Cl)F 34a_100000692107_200025704644 [1,1,0,0,0,0|2,0,0]=4 9235 B10R1.30 [13CH3]Oc1cc(ccc1Cl)F 7a_100000692107_200025704644 [1,1,0,0,0,0|2,0,0]=4 9236 B10R1.30 [13CH3]Oc1cc(ccc1Cl)I 34a_100011356854_200025704644 [1,1,0,0,0,0|2,0,0]=4 9237 B10R1.30 [13CH3]Oc1cc(ccc1Cl)I 7a_100011356854_200025704644 [1,1,0,0,0,0|2,0,0]=4 9238 B10R1.30 [13CH3]Oc1cc(ccc1Cl)N 34a_100011934209_200025704644 [1,1,0,0,0,0|2,0,0]=4 9239 B10R1.30 [13CH3]Oc1cc(ccc1F)Br 34a_100000686035_200025704644 [1,1,0,0,0,0|2,0,0]=4 9240 B10R1.30 [13CH3]Oc1cc(ccc1F)Br 7a_100000686035_200025704644 [1,1,0,0,0,0|2,0,0]=4 9241 B10R1.30 [13CH3]Oc1cc(ccc1F)Cl 34a_100000757397_200025704644 [1,1,0,0,0,0|2,0,0]=4 9242 B10R1.30 [13CH3]Oc1cc(ccc1F)Cl 7a_100000757397_200025704644 [1,1,0,0,0,0|2,0,0]=4 9243 B10R1.30 [13CH3]Oc1cc(ccc1F)F 34a_100000752141_200025704644 [1,1,0,0,0,0|2,0,0]=4 9244 B10R1.30 [13CH3]Oc1cc(ccc1F)F 7a_100000752141_200025704644 [1,1,0,0,0,0|2,0,0]=4 9245 B10R1.30 [13CH3]Oc1cc(ccc1F)I 34a_100009958187_200025704644 [1,1,0,0,0,0|2,0,0]=4 9246 B10R1.30 [13CH3]Oc1cc(ccc1F)I 7a_100009958187_200025704644 [1,1,0,0,0,0|2,0,0]=4 9247 B10R1.30 [13CH3]Oc1cc(ccc1F)N 34a_100012017398_200025704644 [1,1,0,0,0,0|2,0,0]=4 9248 B10R1.30 [13CH3]Oc1cc(ccc1F)N 7a_100012017398_200025704644 [1,1,0,0,0,0|2,0,0]=4 9249 B10R1.30 [13CH3]Oc1cc(ccc1I)Br 34a_100012344904_200025704644 [1,1,0,0,0,0|2,0,0]=4 9250 B10R1.30 [13CH3]Oc1cc(ccc1I)Br 7a_100012344904_200025704644 [1,1,0,0,0,0|2,0,0]=4 9251 B10R1.30 [13CH3]Oc1cc(ccc1I)Cl 34a_100000050036_200025704644 [1,1,0,0,0,0|2,0,0]=4 9252 B10R1.30 [13CH3]Oc1cc(ccc1I)Cl 7a_100000050036_200025704644 [1,1,0,0,0,0|2,0,0]=4 9253 B10R1.30 [13CH3]Oc1cc(ccc1I)F 34a_100010084537_200025704644 [1,1,0,0,0,0|2,0,0]=4 9254 B10R1.30 [13CH3]Oc1cc(ccc1I)F 7a_100010084537_200025704644 [1,1,0,0,0,0|2,0,0]=4 9255 B10R1.30 [13CH3]Oc1cc(ccc1N)Br 34a_100000739049_200025704644 [1,1,0,0,0,0|2,0,0]=4 9256 B10R1.30 [13CH3]Oc1cc(ccc1N)Br 7a_100000739049_200025704644 [1,1,0,0,0,0|2,0,0]=4 9257 B10R1.30 [13CH3]Oc1cc(ccc1N)Cl 34a_100000185728_200025704644 [1,1,0,0,0,0|2,0,0]=4 9258 B10R1.30 [13CH3]Oc1cc(ccc1N)Cl 7a_100000185728_200025704644 [1,1,0,0,0,0|2,0,0]=4 9259 B10R1.30 [13CH3]Oc1cc(ccc1N)F 34a_100000753323_200025704644 [1,1,0,0,0,0|2,0,0]=4 9260 B10R1.30 [13CH3]Oc1cc(ccc1N)F 7a_100000753323_200025704644 [1,1,0,0,0,0|2,0,0]=4 9261 B10R1.30 [13CH3]Oc1cc(ccc1N)I 34a_100000057187_200025704644 [1,1,0,0,0,0|2,0,0]=4 9262 B10R1.30 [13CH3]Oc1cc(ccc1N)I 7a_100000057187_200025704644 [1,1,0,0,0,0|2,0,0]=4 9263 B10R1.30 [13CH3]Oc1cc(ccc1N)N 34a_100025717382_200025704644 [1,1,0,0,0,0|2,0,0]=4 9264 B10R1.30 [13CH3]Sc1cc(ccc1Br)Br 62a_100011483371_200025704644 [1,1,0,0,0,0|2,0,0]=4 9265 B10R1.30 [13CH3]Sc1cc(ccc1Br)Br 62a_200025704644_100011483371 [1,1,0,0,0,0|2,0,0]=4 9266 B10R1.30 [13CH3]Sc1cc(ccc1Br)Cl 62a_100012339723_200025704644 [1,1,0,0,0,0|2,0,0]=4 9267 B10R1.30 [13CH3]Sc1cc(ccc1Br)Cl 62a_200025704644_100012339723 [1,1,0,0,0,0|2,0,0]=4 9268 B10R1.30 [13CH3]Sc1cc(ccc1Br)F 62a_100011217576_200025704644 [1,1,0,0,0,0|2,0,0]=4 9269 B10R1.30 [13CH3]Sc1cc(ccc1Br)F 62a_200025704644_100011217576 [1,1,0,0,0,0|2,0,0]=4 9270 B10R1.30 [13CH3]Sc1cc(ccc1Br)N 62a_100000750459_200025704644 [1,1,0,0,0,0|2,0,0]=4 9271 B10R1.30 [13CH3]Sc1cc(ccc1Br)N 62a_200025704644_100000750459 [1,1,0,0,0,0|2,0,0]=4 9272 B10R1.30 [13CH3]Sc1cc(ccc1Br)O 62a_100012339312_200025704644 [1,1,0,0,0,0|2,0,0]=4 9273 B10R1.30 [13CH3]Sc1cc(ccc1Br)O 62a_200025704644_100012339312 [1,1,0,0,0,0|2,0,0]=4 9274 B10R1.30 [13CH3]Sc1cc(ccc1Cl)Br 62a_100011772130_200025704644 [1,1,0,0,0,0|2,0,0]=4 9275 B10R1.30 [13CH3]Sc1cc(ccc1Cl)Br 62a_200025704644_100011772130 [1,1,0,0,0,0|2,0,0]=4 9276 B10R1.30 [13CH3]Sc1cc(ccc1Cl)Cl 62a_100000707729_200025704644 [1,1,0,0,0,0|2,0,0]=4 9277 B10R1.30 [13CH3]Sc1cc(ccc1Cl)Cl 62a_200025704644_100000707729 [1,1,0,0,0,0|2,0,0]=4 9278 B10R1.30 [13CH3]Sc1cc(ccc1Cl)F 62a_100011217299_200025704644 [1,1,0,0,0,0|2,0,0]=4 9279 B10R1.30 [13CH3]Sc1cc(ccc1Cl)F 62a_200025704644_100011217299 [1,1,0,0,0,0|2,0,0]=4 9280 B10R1.30 [13CH3]Sc1cc(ccc1Cl)N 62a_100012360549_200025704644 [1,1,0,0,0,0|2,0,0]=4 9281 B10R1.30 [13CH3]Sc1cc(ccc1Cl)N 62a_200025704644_100012360549 [1,1,0,0,0,0|2,0,0]=4 9282 B10R1.30 [13CH3]Sc1cc(ccc1Cl)O 62a_100000049588_200025704644 [1,1,0,0,0,0|2,0,0]=4 9283 B10R1.30 [13CH3]Sc1cc(ccc1Cl)O 62a_200025704644_100000049588 [1,1,0,0,0,0|2,0,0]=4 9284 B10R1.30 [13CH3]Sc1cc(ccc1F)Br 62a_100011217312_200025704644 [1,1,0,0,0,0|2,0,0]=4 9285 B10R1.30 [13CH3]Sc1cc(ccc1F)Br 62a_200025704644_100011217312 [1,1,0,0,0,0|2,0,0]=4 9286 B10R1.30 [13CH3]Sc1cc(ccc1F)Cl 62a_100011218116_200025704644 [1,1,0,0,0,0|2,0,0]=4 9287 B10R1.30 [13CH3]Sc1cc(ccc1F)Cl 62a_200025704644_100011218116 [1,1,0,0,0,0|2,0,0]=4 9288 B10R1.30 [13CH3]Sc1cc(ccc1F)F 62a_100011219198_200025704644 [1,1,0,0,0,0|2,0,0]=4 9289 B10R1.30 [13CH3]Sc1cc(ccc1F)F 62a_200025704644_100011219198 [1,1,0,0,0,0|2,0,0]=4 9290 B10R1.30 [13CH3]Sc1cc(ccc1F)N 62a_100000760356_200025704644 [1,1,0,0,0,0|2,0,0]=4 9291 B10R1.30 [13CH3]Sc1cc(ccc1F)N 62a_200025704644_100000760356 [1,1,0,0,0,0|2,0,0]=4 9292 B10R1.30 [13CH3]Sc1cc(ccc1F)O 62a_100000693481_200025704644 [1,1,0,0,0,0|2,0,0]=4 9293 B10R1.30 [13CH3]Sc1cc(ccc1F)O 62a_200025704644_100000693481 [1,1,0,0,0,0|2,0,0]=4 9294 B10R1.30 [13CH3]Sc1cc(ccc1N)Br 62a_100000187925_200025704644 [1,1,0,0,0,0|2,0,0]=4 9295 B10R1.30 [13CH3]Sc1cc(ccc1N)Br 62a_200025704644_100000187925 [1,1,0,0,0,0|2,0,0]=4 9296 B10R1.30 [13CH3]Sc1cc(ccc1N)Cl 62a_100000761889_200025704644 [1,1,0,0,0,0|2,0,0]=4 9297 B10R1.30 [13CH3]Sc1cc(ccc1N)Cl 62a_200025704644_100000761889 [1,1,0,0,0,0|2,0,0]=4 9298 B10R1.30 [13CH3]Sc1cc(ccc1N)F 62a_100000760547_200025704644 [1,1,0,0,0,0|2,0,0]=4 9299 B10R1.30 [13CH3]Sc1cc(ccc1N)F 62a_200025704644_100000760547 [1,1,0,0,0,0|2,0,0]=4 9300 B10R1.30 [13CH3]Sc1cc(ccc1N)N 62a_100011534242_200025704644 [1,1,0,0,0,0|2,0,0]=4 9301 B10R1.30 [13CH3]Sc1cc(ccc1N)N 62a_200025704644_100011534242 [1,1,0,0,0,0|2,0,0]=4 9302 B10R1.30 [13CH3]Sc1cc(ccc1N)O 62a_100012001276_200025704644 [1,1,0,0,0,0|2,0,0]=4 9303 B10R1.30 [13CH3]Sc1cc(ccc1N)O 62a_200025704644_100012001276 [1,1,0,0,0,0|2,0,0]=4 9304 B10R1.30 [13CH3]Sc1cc(ccc1O)Br 62a_100012355227_200025704644 [1,1,0,0,0,0|1,0,0]=3 9305 B10R1.30 [13CH3]Sc1cc(ccc1O)Br 62a_200025704644_100012355227 [1,1,0,0,0,0|1,0,0]=3 9306 B10R1.30 [13CH3]Sc1cc(ccc1O)Cl 62a_100011356953_200025704644 [1,1,0,0,0,0|1,0,0]=3 9307 B10R1.30 [13CH3]Sc1cc(ccc1O)Cl 62a_200025704644_100011356953 [1,1,0,0,0,0|1,0,0]=3 9308 B10R1.30 [13CH3]Sc1cc(ccc1O)F 62a_100000211999_200025704644 [1,1,0,0,0,0|1,0,0]=3 9309 B10R1.30 [13CH3]Sc1cc(ccc1O)F 62a_200025704644_100000211999 [1,1,0,0,0,0|1,0,0]=3 9310 B10R1.30 [13CH3]Sc1cc(ccc1O)N 62a_100011534360_200025704644 [1,1,0,0,0,0|1,0,0]=3 9311 B10R1.30 [13CH3]Sc1cc(ccc1O)N 62a_200025704644_100011534360 [1,1,0,0,0,0|1,0,0]=3 9312 B10R1.30 [13CH3]Sc1cc(ccc1O)O 62a_200025704644_100009813629 [1,1,0,0,0,0|1,0,0]=3 9313 B10R1.30 [13CH3]Sc1cc(cnc1O)Br 62a_100010197142_200025704644 [1,1,0,0,0,0|2,0,0]=4 9314 B10R1.30 [13CH3]Sc1cc(cnc1O)Br 62a_200025704644_100010197142 [1,1,0,0,0,0|2,0,0]=4 9315 B10R1.30 [13CH3]Sc1cc(cnc1O)Cl 62a_100010188700_200025704644 [1,1,0,0,0,0|2,0,0]=4 9316 B10R1.30 [13CH3]Sc1cc(cnc1O)Cl 62a_200025704644_100010188700 [1,1,0,0,0,0|2,0,0]=4 9317 B10R1.30 [13CH3]Sc1cc(ncc1O)Cl 62a_100000698892_200025704644 [1,1,0,0,0,0|2,0,0]=4 9318 B10R1.30 [13CH3]Sc1cc(ncc1O)Cl 62a_200025704644_100000698892 [1,1,0,0,0,0|2,0,0]=4 9319 B10R1.30 [13CH3]Sc1nc(ccc1O)Br 62a_100010253912_200025704644 [1,1,0,0,0,0|2,0,0]=4 9320 B10R1.30 [13CH3]Sc1nc(ccc1O)Br 62a_200025704644_100010253912 [1,1,0,0,0,0|2,0,0]=4 9321 B10R1.30 [13CH3]Sc1nc(ccc1O)Cl 62a_200025704644_100000696390 [1,1,0,0,0,0|2,0,0]=4 9322 B10R1.30 [13CH3]Sc1nc(ccc1O)F 62a_100010382442_200025704644 [1,1,0,0,0,0|2,0,0]=4 9323 B10R1.30 [13CH3]Sc1nc(ccc1O)F 62a_200025704644_100010382442 [1,1,0,0,0,0|2,0,0]=4 9324 B10R1.61 C=C(C)c1ccccc1Br 271570a_100000694244_100000695589 [1,1,0,0,0,0|1,0,1]=4 9325 B10R1.61 C=C(C)c1ccccc1C 271570a_100000694244_100000210755 [1,1,0,0,0,0|1,0,1]=4 9326 B10R1.61 C=C(C)c1ccccc1Cl 271570a_100000694244_100000764095 [1,1,0,0,0,0|1,0,1]=4 9327 B10R1.61 C=C(C)c1ccccc1F 271570a_100000694244_100011215700 [1,1,0,0,0,0|1,0,1]=4 9328 B10R1.61 C=C(C)c1ccccc1N 271570a_100000694244_100000210017 [1,1,0,0,0,0|1,0,1]=4 9329 B10R1.61 C=C(C)c1ccccc1O 271570a_100000694244_100000739446 [1,1,0,0,0,0|0,0,1]=3 9330 B10R1.61 C=C(C)c1ccncc1O 271570a_100000694244_100009817591 [1,1,0,0,0,0|1,0,1]=4 9331 B10R1.61 C=C(C)c1ncccc1O 271570a_100000694244_100000034122 [1,1,0,0,0,0|1,0,1]=4 9332 B10R1.61 CC(=O)c1ccccc1Br 1458a_100000188424_200000210301 [1,1,0,0,0,0|1,0,1]=4 9333 B10R1.61 CC(=O)c1ccccc1C 1458a_100000212026_200000210301 [1,1,0,0,0,0|1,0,1]=4 9334 B10R1.61 CC(=O)c1ccccc1Cl 1458a_100000185844_200000210301 [1,1,0,0,0,0|1,0,1]=4 9335 B10R1.61 CC(=O)c1ccccc1F 1458a_100000188656_200000210301 [1,1,0,0,0,0|1,0,1]=4 9336 B10R1.61 CC(=O)c1ccccc1I 1458a_100000187884_200000210301 [1,1,0,0,0,0|1,0,1]=4 9337 B10R1.61 CC(=O)c1ccccc1O 1458a_100015234032_200000210301 [1,1,0,0,0,0|0,0,1]=3 9338 B10R1.61 CC(=O)c1ccccc1O 271570a_203496583355_100000751169 [1,1,0,0,0,0|0,0,1]=3 9339 B10R1.61 CC(=O)c1ccccc1[O-] 1458a_100009911694_200000210301 [1,1,0,0,0,0|0,0,2]=4 9340 B10R1.61 CC(=O)c1cccnc1O 271570a_203496583355_100000753718 [1,1,0,0,0,0|1,0,1]=4 9341 B10R1.61 CC(=O)c1ccncc1O 271570a_203496583355_100009993184 [1,1,0,0,0,0|1,0,1]=4 9342 B10R1.61 CC(=O)c1cnccc1O 271570a_203496583355_100160469449 [1,1,0,0,0,0|1,0,1]=4 9343 B10R1.61 CC(=O)c1ncccc1O 271570a_203496583355_100012348690 [1,1,0,0,0,0|1,0,1]=4 9344 B10R1.61 CC(C)c1ccccc1O 271570a_203496583355_100011218076 [1,1,0,0,0,0|0,0,0]=2 9345 B10R1.61 CC(C)c1cccnc1O 271570a_203496583355_200010382935 [1,1,0,0,0,0|1,0,0]=3 9346 B10R1.61 CC(C)c1ncncc1O 271570a_203496583355_100009816988 [1,1,0,0,0,0|2,0,0]=4 9347 B10R1.61 CC(N)c1ccccc1O 271570a_203496583355_100000181357 [1,1,0,0,0,0|0,0,0]=2 9348 B10R1.61 CC(N)c1ncccc1O 271570a_203496583355_100159271932 [1,1,0,0,0,0|1,0,0]=3 9349 B10R1.61 CC(O)c1ccccc1O 271570a_203496583355_100000702211 [1,1,0,0,0,0|0,0,0]=2 9350 B10R1.61 CC(O)c1cccnc1O 271570a_203496583355_100009865335 [1,1,0,0,0,0|1,0,0]=3 9351 B10R1.61 CN(C)c1ccccc1Br 2230a_100020606079_200000210301 [1,1,0,0,0,0|2,0,0]=4 9352 B10R1.61 CN(C)c1ccccc1Br 269982a_100020606079_200000210301 [1,1,0,0,0,0|2,0,0]=4 9353 B10R1.61 CN(C)c1ccccc1Br 34a_100020606079_200000210301 [1,1,0,0,0,0|2,0,0]=4 9354 B10R1.61 CN(C)c1ccccc1Cl 2230a_100000219374_200000210301 [1,1,0,0,0,0|2,0,0]=4 9355 B10R1.61 CN(C)c1ccccc1Cl 269982a_100000219374_200000210301 [1,1,0,0,0,0|2,0,0]=4 9356 B10R1.61 CN(C)c1ccccc1Cl 34a_100000219374_200000210301 [1,1,0,0,0,0|2,0,0]=4 9357 B10R1.61 CN(C)c1ccccc1F 2230a_100000220357_200000210301 [1,1,0,0,0,0|2,0,0]=4 9358 B10R1.61 CN(C)c1ccccc1F 269982a_100000220357_200000210301 [1,1,0,0,0,0|2,0,0]=4 9359 B10R1.61 CN(C)c1ccccc1F 34a_100000220357_200000210301 [1,1,0,0,0,0|2,0,0]=4 9360 B10R1.61 CN(C)c1ccccc1F 38a_100000220357_200000210301 [1,1,0,0,0,0|2,0,0]=4 9361 B10R1.61 CN(C)c1ccccc1O 269982a_100000033821_200000210301 [1,1,0,0,0,0|1,0,0]=3 9362 B10R1.61 CN(C)c1ccccc1O 271570a_203496583355_100011290883 [1,1,0,0,0,0|1,0,0]=3 9363 B10R1.61 CN(C)c1ccncc1O 271570a_203496583355_100012355995 [1,1,0,0,0,0|2,0,0]=4 9364 B10R1.61 CN(C)c1ncccc1O 271570a_203496583355_100011465059 [1,1,0,0,0,0|2,0,0]=4 9365 B10R1.61 CN([13CH3])c1ccccc1Br 2230a_100020606079_200025704644 [1,1,0,0,0,0|2,0,0]=4 9366 B10R1.61 CN([13CH3])c1ccccc1Br 269982a_100020606079_200025704644 [1,1,0,0,0,0|2,0,0]=4 9367 B10R1.61 CN([13CH3])c1ccccc1Br 34a_100020606079_200025704644 [1,1,0,0,0,0|2,0,0]=4 9368 B10R1.61 CN([13CH3])c1ccccc1Cl 2230a_100000219374_200025704644 [1,1,0,0,0,0|2,0,0]=4 9369 B10R1.61 CN([13CH3])c1ccccc1Cl 269982a_100000219374_200025704644 [1,1,0,0,0,0|2,0,0]=4 9370 B10R1.61 CN([13CH3])c1ccccc1Cl 34a_100000219374_200025704644 [1,1,0,0,0,0|2,0,0]=4 9371 B10R1.61 CN([13CH3])c1ccccc1F 2230a_100000220357_200025704644 [1,1,0,0,0,0|2,0,0]=4 9372 B10R1.61 CN([13CH3])c1ccccc1F 269982a_100000220357_200025704644 [1,1,0,0,0,0|2,0,0]=4 9373 B10R1.61 CN([13CH3])c1ccccc1F 34a_100000220357_200025704644 [1,1,0,0,0,0|2,0,0]=4 9374 B10R1.61 CN([13CH3])c1ccccc1F 38a_100000220357_200025704644 [1,1,0,0,0,0|2,0,0]=4 9375 B10R1.61 CN([13CH3])c1ccccc1O 269982a_100000033821_200025704644 [1,1,0,0,0,0|1,0,0]=3 9376 B10R1.61 CS(=O)c1ccccc1O 271570a_203496583355_100000734199 [1,1,0,0,0,0|1,0,0]=3 9377 B10R1.61 C[C@H](O)c1ncccc1O 271570a_203496583355_100013325542 [1,1,0,0,0,0|1,0,0]=3 9378 B10R1.61 Cc1ccccc1C(=O)[13CH3] 1458a_100000212026_200025704644 [1,1,0,0,0,0|1,0,1]=4 9379 B10R1.61 Cc1ccccc1N(C)C 2230a_100000219699_200000210301 [1,1,0,0,0,0|2,0,0]=4 9380 B10R1.61 Cc1ccccc1N(C)C 269982a_100000219699_200000210301 [1,1,0,0,0,0|2,0,0]=4 9381 B10R1.61 Cc1ccccc1N(C)C 34a_100000219699_200000210301 [1,1,0,0,0,0|2,0,0]=4 9382 B10R1.61 Cc1ccccc1N(C)[13CH3] 2230a_100000219699_200025704644 [1,1,0,0,0,0|2,0,0]=4 9383 B10R1.61 Cc1ccccc1N(C)[13CH3] 269982a_100000219699_200025704644 [1,1,0,0,0,0|2,0,0]=4 9384 B10R1.61 Cc1ccccc1N(C)[13CH3] 34a_100000219699_200025704644 [1,1,0,0,0,0|2,0,0]=4 9385 B10R1.61 NC(=O)c1ccccc1O 271570a_203496583355_100000162227 [1,1,0,0,0,0|1,0,1]=4 9386 B10R1.61 OB(O)c1ccccc1O 271570a_203496583355_100000693059 [1,1,0,0,0,0|2,0,0]=4 9387 B10R1.61 Oc1ccccc1C(F)F 271570a_203496583355_100010169824 [1,1,0,0,0,0|1,0,0]=3 9388 B10R1.61 Oc1cccnc1C(F)F 271570a_203496583355_100010079810 [1,1,0,0,0,0|2,0,0]=4 9389 B10R1.61 Oc1ncccc1C(F)F 271570a_203496583355_100010136063 [1,1,0,0,0,0|2,0,0]=4 9390 B10R1.61 [13CH3]C(=O)c1ccccc1Br 1458a_100000188424_200025704644 [1,1,0,0,0,0|1,0,1]=4 9391 B10R1.61 [13CH3]C(=O)c1ccccc1Cl 1458a_100000185844_200025704644 [1,1,0,0,0,0|1,0,1]=4 9392 B10R1.61 [13CH3]C(=O)c1ccccc1F 1458a_100000188656_200025704644 [1,1,0,0,0,0|1,0,1]=4 9393 B10R1.61 [13CH3]C(=O)c1ccccc1I 1458a_100000187884_200025704644 [1,1,0,0,0,0|1,0,1]=4 9394 B10R1.61 [13CH3]C(=O)c1ccccc1O 1458a_100015234032_200025704644 [1,1,0,0,0,0|0,0,1]=3 9395 B10R1.61 [13CH3]C(=O)c1ccccc1[O-] 1458a_100009911694_200025704644 [1,1,0,0,0,0|0,0,2]=4 9396 B10R1.245 C=Cc1c(cccc1Br)O 271570a_100011290941_100010187912 [1,1,0,0,0,0|0,0,2]=4 9397 B10R1.245 C=Cc1c(cccc1Cl)O 271570a_100011290941_100000050174 [1,1,0,0,0,0|0,0,2]=4 9398 B10R1.245 C=Cc1c(cccc1F)O 271570a_100011290941_100009820682 [1,1,0,0,0,0|0,0,2]=4 9399 B10R1.245 C=Cc1c(cccc1O)C 271570a_100011290941_100000686692 [1,1,0,0,0,0|0,0,2]=4 9400 B10R1.245 C=Cc1c(cccc1O)N 271570a_100011290941_100012183704 [1,1,0,0,0,0|0,0,2]=4 9401 B10R1.245 C=Cc1c(cccc1O)O 271570a_100011290941_100010205330 [1,1,0,0,0,0|0,0,2]=4 9402 B10R1.245 CNc1c(cccc1Br)Br 34a_100000690995_200000210301 [1,1,0,0,0,0|2,0,0]=4 9403 B10R1.245 CNc1c(cccc1Br)C 34a_100011834072_200000210301 [1,1,0,0,0,0|2,0,0]=4 9404 B10R1.245 CNc1c(cccc1Br)Cl 34a_100102946385_200000210301 [1,1,0,0,0,0|2,0,0]=4 9405 B10R1.245 CNc1c(cccc1Br)F 34a_100000684712_200000210301 [1,1,0,0,0,0|2,0,0]=4 9406 B10R1.245 CNc1c(cccc1Br)O 34a_100011934926_200000210301 [1,1,0,0,0,0|1,0,0]=3 9407 B10R1.245 CNc1c(cccc1C)C 34a_100000185769_200000210301 [1,1,0,0,0,0|2,0,0]=4 9408 B10R1.245 CNc1c(cccc1Cl)C 34a_100000756524_200000210301 [1,1,0,0,0,0|2,0,0]=4 9409 B10R1.245 CNc1c(cccc1Cl)Cl 34a_100000210028_200000210301 [1,1,0,0,0,0|2,0,0]=4 9410 B10R1.245 CNc1c(cccc1Cl)F 34a_100000760031_200000210301 [1,1,0,0,0,0|2,0,0]=4 9411 B10R1.245 CNc1c(cccc1Cl)O 34a_100012022510_200000210301 [1,1,0,0,0,0|1,0,0]=3 9412 B10R1.245 CNc1c(cccc1F)C 34a_100000766463_200000210301 [1,1,0,0,0,0|2,0,0]=4 9413 B10R1.245 CNc1c(cccc1F)F 2230a_100000210704_200000210301 [1,1,0,0,0,0|2,0,0]=4 9414 B10R1.245 CNc1c(cccc1F)F 34a_100000210704_200000210301 [1,1,0,0,0,0|2,0,0]=4 9415 B10R1.245 CNc1c(cccc1F)O 34a_100020591140_200000210301 [1,1,0,0,0,0|1,0,0]=3 9416 B10R1.245 CNc1c(cccc1I)F 34a_100000042321_200000210301 [1,1,0,0,0,0|2,0,0]=4 9417 B10R1.245 CNc1c(cccc1O)C 34a_100000743429_200000210301 [1,1,0,0,0,0|1,0,0]=3 9418 B10R1.245 CNc1c(cccc1O)N 271570a_203496583355_100010510394 [1,1,0,0,0,0|1,0,0]=3 9419 B10R1.245 COc1c(cccc1Br)Br 34a_100000736428_200000210301 [1,1,0,0,0,0|2,0,0]=4 9420 B10R1.245 COc1c(cccc1Br)Br 7a_100000736428_200000210301 [1,1,0,0,0,0|2,0,0]=4 9421 B10R1.245 COc1c(cccc1Br)C 34a_100009817157_200000210301 [1,1,0,0,0,0|2,0,0]=4 9422 B10R1.245 COc1c(cccc1Br)C 7a_100009817157_200000210301 [1,1,0,0,0,0|2,0,0]=4 9423 B10R1.245 COc1c(cccc1Br)Cl 34a_100010214474_200000210301 [1,1,0,0,0,0|2,0,0]=4 9424 B10R1.245 COc1c(cccc1Br)Cl 7a_100010214474_200000210301 [1,1,0,0,0,0|2,0,0]=4 9425 B10R1.245 COc1c(cccc1Br)F 34a_100009813666_200000210301 [1,1,0,0,0,0|2,0,0]=4 9426 B10R1.245 COc1c(cccc1Br)F 7a_100009813666_200000210301 [1,1,0,0,0,0|2,0,0]=4 9427 B10R1.245 COc1c(cccc1Br)N 34a_100011934915_200000210301 [1,1,0,0,0,0|2,0,0]=4 9428 B10R1.245 COc1c(cccc1Br)O 271570a_203496583355_100010146560 [1,1,0,0,0,0|1,0,0]=3 9429 B10R1.245 COc1c(cccc1C)C 34a_100000210341_200000210301 [1,1,0,0,0,0|2,0,0]=4 9430 B10R1.245 COc1c(cccc1C)C 7a_100000210341_200000210301 [1,1,0,0,0,0|2,0,0]=4 9431 B10R1.245 COc1c(cccc1Cl)C 34a_100000033731_200000210301 [1,1,0,0,0,0|2,0,0]=4 9432 B10R1.245 COc1c(cccc1Cl)C 7a_100000033731_200000210301 [1,1,0,0,0,0|2,0,0]=4 9433 B10R1.245 COc1c(cccc1Cl)Cl 34a_100000211709_200000210301 [1,1,0,0,0,0|2,0,0]=4 9434 B10R1.245 COc1c(cccc1Cl)Cl 7a_100000211709_200000210301 [1,1,0,0,0,0|2,0,0]=4 9435 B10R1.245 COc1c(cccc1Cl)F 34a_100000694953_200000210301 [1,1,0,0,0,0|2,0,0]=4 9436 B10R1.245 COc1c(cccc1Cl)F 7a_100000694953_200000210301 [1,1,0,0,0,0|2,0,0]=4 9437 B10R1.245 COc1c(cccc1Cl)N 34a_100000754742_200000210301 [1,1,0,0,0,0|2,0,0]=4 9438 B10R1.245 COc1c(cccc1Cl)O 271570a_203496583355_100010147678 [1,1,0,0,0,0|1,0,0]=3 9439 B10R1.245 COc1c(cccc1F)C 34a_100011659162_200000210301 [1,1,0,0,0,0|2,0,0]=4 9440 B10R1.245 COc1c(cccc1F)C 7a_100011659162_200000210301 [1,1,0,0,0,0|2,0,0]=4 9441 B10R1.245 COc1c(cccc1F)F 34a_100000230165_200000210301 [1,1,0,0,0,0|2,0,0]=4 9442 B10R1.245 COc1c(cccc1F)F 7a_100000230165_200000210301 [1,1,0,0,0,0|2,0,0]=4 9443 B10R1.245 COc1c(cccc1F)N 34a_100011934987_200000210301 [1,1,0,0,0,0|2,0,0]=4 9444 B10R1.245 COc1c(cccc1F)O 271570a_203496583355_100009816759 [1,1,0,0,0,0|1,0,0]=3 9445 B10R1.245 COc1c(cccc1I)Br 34a_100010084509_200000210301 [1,1,0,0,0,0|2,0,0]=4 9446 B10R1.245 COc1c(cccc1I)Br 7a_100010084509_200000210301 [1,1,0,0,0,0|2,0,0]=4 9447 B10R1.245 COc1c(cccc1I)Cl 34a_100010202889_200000210301 [1,1,0,0,0,0|2,0,0]=4 9448 B10R1.245 COc1c(cccc1I)Cl 7a_100010202889_200000210301 [1,1,0,0,0,0|2,0,0]=4 9449 B10R1.245 COc1c(cccc1I)F 34a_100010186298_200000210301 [1,1,0,0,0,0|2,0,0]=4 9450 B10R1.245 COc1c(cccc1I)F 7a_100010186298_200000210301 [1,1,0,0,0,0|2,0,0]=4 9451 B10R1.245 COc1c(cccc1I)N 34a_100010084371_200000210301 [1,1,0,0,0,0|2,0,0]=4 9452 B10R1.245 COc1c(cccc1N)C 34a_100000756359_200000210301 [1,1,0,0,0,0|2,0,0]=4 9453 B10R1.245 COc1c(cccc1N)C 7a_100000756359_200000210301 [1,1,0,0,0,0|2,0,0]=4 9454 B10R1.245 COc1c(cccc1N)N 34a_200016994477_200000210301 [1,1,0,0,0,0|2,0,0]=4 9455 B10R1.245 COc1c(cccc1O)C 271570a_203496583355_100010141385 [1,1,0,0,0,0|1,0,0]=3 9456 B10R1.245 COc1c(cccc1O)N 271570a_203496583355_100011935253 [1,1,0,0,0,0|1,0,0]=3 9457 B10R1.245 COc1c(cccc1O)O 271570a_203496583355_100010234590 [1,1,0,0,0,0|1,0,0]=3 9458 B10R1.245 COc1c(ccnc1C)O 271570a_203496583355_100000685116 [1,1,0,0,0,0|2,0,0]=4 9459 B10R1.245 COc1c(ccnc1Cl)O 271570a_203496583355_100010068014 [1,1,0,0,0,0|2,0,0]=4 9460 B10R1.245 COc1c(ccnc1N)O 271570a_203496583355_100009880012 [1,1,0,0,0,0|2,0,0]=4 9461 B10R1.245 COc1c(ccnc1O)N 271570a_203496583355_100000104429 [1,1,0,0,0,0|2,0,0]=4 9462 B10R1.245 COc1c(ccnc1O)O 271570a_203496583355_100000104430 [1,1,0,0,0,0|2,0,0]=4 9463 B10R1.245 COc1c(cncc1O)N 271570a_203496583355_100012359933 [1,1,0,0,0,0|2,0,0]=4 9464 B10R1.245 CSc1c(cccc1Br)Br 62a_100009994525_200000210301 [1,1,0,0,0,0|2,0,0]=4 9465 B10R1.245 CSc1c(cccc1Br)Br 62a_200000210301_100009994525 [1,1,0,0,0,0|2,0,0]=4 9466 B10R1.245 CSc1c(cccc1Br)C 62a_100010141302_200000210301 [1,1,0,0,0,0|2,0,0]=4 9467 B10R1.245 CSc1c(cccc1Br)C 62a_200000210301_100010141302 [1,1,0,0,0,0|2,0,0]=4 9468 B10R1.245 CSc1c(cccc1Br)Cl 62a_100010214488_200000210301 [1,1,0,0,0,0|2,0,0]=4 9469 B10R1.245 CSc1c(cccc1Br)Cl 62a_200000210301_100010214488 [1,1,0,0,0,0|2,0,0]=4 9470 B10R1.245 CSc1c(cccc1Br)F 62a_100011219512_200000210301 [1,1,0,0,0,0|2,0,0]=4 9471 B10R1.245 CSc1c(cccc1Br)F 62a_200000210301_100011219512 [1,1,0,0,0,0|2,0,0]=4 9472 B10R1.245 CSc1c(cccc1Br)N 62a_100020590159_200000210301 [1,1,0,0,0,0|2,0,0]=4 9473 B10R1.245 CSc1c(cccc1Br)N 62a_200000210301_100020590159 [1,1,0,0,0,0|2,0,0]=4 9474 B10R1.245 CSc1c(cccc1Br)O 62a_100010187912_200000210301 [1,1,0,0,0,0|1,0,0]=3 9475 B10R1.245 CSc1c(cccc1Br)O 62a_200000210301_100010187912 [1,1,0,0,0,0|1,0,0]=3 9476 B10R1.245 CSc1c(cccc1C)C 62a_100000033847_200000210301 [1,1,0,0,0,0|2,0,0]=4 9477 B10R1.245 CSc1c(cccc1C)C 62a_200000210301_100000033847 [1,1,0,0,0,0|2,0,0]=4 9478 B10R1.245 CSc1c(cccc1Cl)C 62a_100000043165_200000210301 [1,1,0,0,0,0|2,0,0]=4 9479 B10R1.245 CSc1c(cccc1Cl)C 62a_200000210301_100000043165 [1,1,0,0,0,0|2,0,0]=4 9480 B10R1.245 CSc1c(cccc1Cl)Cl 62a_100000034237_200000210301 [1,1,0,0,0,0|2,0,0]=4 9481 B10R1.245 CSc1c(cccc1Cl)Cl 62a_200000210301_100000034237 [1,1,0,0,0,0|2,0,0]=4 9482 B10R1.245 CSc1c(cccc1Cl)F 62a_100000050007_200000210301 [1,1,0,0,0,0|2,0,0]=4 9483 B10R1.245 CSc1c(cccc1Cl)F 62a_200000210301_100000050007 [1,1,0,0,0,0|2,0,0]=4 9484 B10R1.245 CSc1c(cccc1Cl)N 62a_100000049713_200000210301 [1,1,0,0,0,0|2,0,0]=4 9485 B10R1.245 CSc1c(cccc1Cl)N 62a_200000210301_100000049713 [1,1,0,0,0,0|2,0,0]=4 9486 B10R1.245 CSc1c(cccc1Cl)O 62a_200000210301_100000050174 [1,1,0,0,0,0|1,0,0]=3 9487 B10R1.245 CSc1c(cccc1F)C 62a_100011218421_200000210301 [1,1,0,0,0,0|2,0,0]=4 9488 B10R1.245 CSc1c(cccc1F)C 62a_200000210301_100011218421 [1,1,0,0,0,0|2,0,0]=4 9489 B10R1.245 CSc1c(cccc1F)F 62a_100000693133_200000210301 [1,1,0,0,0,0|2,0,0]=4 9490 B10R1.245 CSc1c(cccc1F)F 62a_200000210301_100000693133 [1,1,0,0,0,0|2,0,0]=4 9491 B10R1.245 CSc1c(cccc1F)N 62a_100000690935_200000210301 [1,1,0,0,0,0|2,0,0]=4 9492 B10R1.245 CSc1c(cccc1F)N 62a_200000210301_100000690935 [1,1,0,0,0,0|2,0,0]=4 9493 B10R1.245 CSc1c(cccc1F)O 271570a_203496583355_200010709249 [1,1,0,0,0,0|1,0,0]=3 9494 B10R1.245 CSc1c(cccc1F)O 62a_100009820682_200000210301 [1,1,0,0,0,0|1,0,0]=3 9495 B10R1.245 CSc1c(cccc1F)O 62a_200000210301_100009820682 [1,1,0,0,0,0|1,0,0]=3 9496 B10R1.245 CSc1c(cccc1N)C 62a_100000684715_200000210301 [1,1,0,0,0,0|2,0,0]=4 9497 B10R1.245 CSc1c(cccc1N)C 62a_200000210301_100000684715 [1,1,0,0,0,0|2,0,0]=4 9498 B10R1.245 CSc1c(cccc1O)C 62a_100000686692_200000210301 [1,1,0,0,0,0|1,0,0]=3 9499 B10R1.245 CSc1c(cccc1O)C 62a_200000210301_100000686692 [1,1,0,0,0,0|1,0,0]=3 9500 B10R1.245 CSc1c(cccc1O)N 62a_100012183704_200000210301 [1,1,0,0,0,0|1,0,0]=3 9501 B10R1.245 CSc1c(cccc1O)N 62a_200000210301_100012183704 [1,1,0,0,0,0|1,0,0]=3 9502 B10R1.245 CSc1c(cccc1O)O 62a_200000210301_100010205330 [1,1,0,0,0,0|1,0,0]=3 9503 B10R1.245 CSc1c(ccnc1O)C 62a_100012000493_200000210301 [1,1,0,0,0,0|2,0,0]=4 9504 B10R1.245 CSc1c(ccnc1O)C 62a_200000210301_100012000493 [1,1,0,0,0,0|2,0,0]=4 9505 B10R1.245 CSc1c(ccnc1O)O 62a_200000210301_200009817435 [1,1,0,0,0,0|2,0,0]=4 9506 B10R1.245 Cc1cccc(c1C#N)O 271570a_203496583355_100009819585 [1,1,0,0,0,0|1,0,1]=4 9507 B10R1.245 Cc1cccc(c1C=O)O 271570a_203496583355_100000041122 [1,1,0,0,0,0|1,0,1]=4 9508 B10R1.245 Cc1cccc(c1N[13CH3])Br 34a_100011834072_200025704644 [1,1,0,0,0,0|2,0,0]=4 9509 B10R1.245 Cc1cccc(c1N[13CH3])C 34a_100000185769_200025704644 [1,1,0,0,0,0|2,0,0]=4 9510 B10R1.245 Cc1cccc(c1N[13CH3])Cl 34a_100000756524_200025704644 [1,1,0,0,0,0|2,0,0]=4 9511 B10R1.245 Cc1cccc(c1N[13CH3])F 34a_100000766463_200025704644 [1,1,0,0,0,0|2,0,0]=4 9512 B10R1.245 Cc1cccc(c1N[13CH3])O 34a_100000743429_200025704644 [1,1,0,0,0,0|1,0,0]=3 9513 B10R1.245 Cc1cccc(c1O[13CH3])Br 34a_100009817157_200025704644 [1,1,0,0,0,0|2,0,0]=4 9514 B10R1.245 Cc1cccc(c1O[13CH3])Br 7a_100009817157_200025704644 [1,1,0,0,0,0|2,0,0]=4 9515 B10R1.245 Cc1cccc(c1O[13CH3])C 34a_100000210341_200025704644 [1,1,0,0,0,0|2,0,0]=4 9516 B10R1.245 Cc1cccc(c1O[13CH3])C 7a_100000210341_200025704644 [1,1,0,0,0,0|2,0,0]=4 9517 B10R1.245 Cc1cccc(c1O[13CH3])Cl 34a_100000033731_200025704644 [1,1,0,0,0,0|2,0,0]=4 9518 B10R1.245 Cc1cccc(c1O[13CH3])Cl 7a_100000033731_200025704644 [1,1,0,0,0,0|2,0,0]=4 9519 B10R1.245 Cc1cccc(c1O[13CH3])F 34a_100011659162_200025704644 [1,1,0,0,0,0|2,0,0]=4 9520 B10R1.245 Cc1cccc(c1O[13CH3])F 7a_100011659162_200025704644 [1,1,0,0,0,0|2,0,0]=4 9521 B10R1.245 Cc1cccc(c1O[13CH3])N 34a_100000756359_200025704644 [1,1,0,0,0,0|2,0,0]=4 9522 B10R1.245 Cc1cccc(c1O[13CH3])N 7a_100000756359_200025704644 [1,1,0,0,0,0|2,0,0]=4 9523 B10R1.245 Cc1cccc(c1S[13CH3])Br 62a_100010141302_200025704644 [1,1,0,0,0,0|2,0,0]=4 9524 B10R1.245 Cc1cccc(c1S[13CH3])Br 62a_200025704644_100010141302 [1,1,0,0,0,0|2,0,0]=4 9525 B10R1.245 Cc1cccc(c1S[13CH3])C 62a_100000033847_200025704644 [1,1,0,0,0,0|2,0,0]=4 9526 B10R1.245 Cc1cccc(c1S[13CH3])C 62a_200025704644_100000033847 [1,1,0,0,0,0|2,0,0]=4 9527 B10R1.245 Cc1cccc(c1S[13CH3])Cl 62a_100000043165_200025704644 [1,1,0,0,0,0|2,0,0]=4 9528 B10R1.245 Cc1cccc(c1S[13CH3])Cl 62a_200025704644_100000043165 [1,1,0,0,0,0|2,0,0]=4 9529 B10R1.245 Cc1cccc(c1S[13CH3])F 62a_100011218421_200025704644 [1,1,0,0,0,0|2,0,0]=4 9530 B10R1.245 Cc1cccc(c1S[13CH3])F 62a_200025704644_100011218421 [1,1,0,0,0,0|2,0,0]=4 9531 B10R1.245 Cc1cccc(c1S[13CH3])N 62a_100000684715_200025704644 [1,1,0,0,0,0|2,0,0]=4 9532 B10R1.245 Cc1cccc(c1S[13CH3])N 62a_200025704644_100000684715 [1,1,0,0,0,0|2,0,0]=4 9533 B10R1.245 Cc1cccc(c1S[13CH3])O 62a_100000686692_200025704644 [1,1,0,0,0,0|1,0,0]=3 9534 B10R1.245 Cc1cccc(c1S[13CH3])O 62a_200025704644_100000686692 [1,1,0,0,0,0|1,0,0]=3 9535 B10R1.245 Cc1ccnc(c1S[13CH3])O 62a_100012000493_200025704644 [1,1,0,0,0,0|2,0,0]=4 9536 B10R1.245 Cc1ccnc(c1S[13CH3])O 62a_200025704644_100012000493 [1,1,0,0,0,0|2,0,0]=4 9537 B10R1.245 N#Cc1c(cccc1Br)O 271570a_203496583355_100010071968 [1,1,0,0,0,0|1,0,1]=4 9538 B10R1.245 N#Cc1c(cccc1Cl)O 271570a_203496583355_200000049503 [1,1,0,0,0,0|1,0,1]=4 9539 B10R1.245 N#Cc1c(cccc1F)O 271570a_203496583355_100000699744 [1,1,0,0,0,0|1,0,1]=4 9540 B10R1.245 N#Cc1c(cccc1O)N 271570a_203496583355_100011935054 [1,1,0,0,0,0|1,0,1]=4 9541 B10R1.245 N#Cc1c(cccc1O)O 271570a_203496583355_100012180507 [1,1,0,0,0,0|1,0,1]=4 9542 B10R1.245 NCc1c(cccc1F)O 271570a_203496583355_100012349121 [1,1,0,0,0,0|1,0,0]=3 9543 B10R1.245 NNc1c(cccc1F)O 271570a_203496583355_100016994982 [1,1,0,0,0,0|2,0,0]=4 9544 B10R1.245 Nc1cccc(c1C=O)O 271570a_203496583355_100010232536 [1,1,0,0,0,0|1,0,1]=4 9545 B10R1.245 Nc1cccc(c1CO)O 271570a_203496583355_100000747656 [1,1,0,0,0,0|1,0,0]=3 9546 B10R1.245 O=Cc1c(cccc1Cl)O 271570a_203496583355_100010147682 [1,1,0,0,0,0|1,0,1]=4 9547 B10R1.245 O=Cc1c(cccc1F)O 271570a_203496583355_100000210083 [1,1,0,0,0,0|1,0,1]=4 9548 B10R1.245 O=Cc1c(cccc1O)O 271570a_203496583355_100009814793 [1,1,0,0,0,0|1,0,1]=4 9549 B10R1.245 OCc1c(cccc1F)O 271570a_203496583355_100012355691 [1,1,0,0,0,0|1,0,0]=3 9550 B10R1.245 OCc1c(ccnc1Cl)O 271570a_203496583355_100000047008 [1,1,0,0,0,0|2,0,0]=4 9551 B10R1.245 OCc1c(ccnc1F)O 271570a_203496583355_100000050056 [1,1,0,0,0,0|2,0,0]=4 9552 B10R1.245 [13CH3]Nc1c(cccc1Br)Br 34a_100000690995_200025704644 [1,1,0,0,0,0|2,0,0]=4 9553 B10R1.245 [13CH3]Nc1c(cccc1Br)Cl 34a_100102946385_200025704644 [1,1,0,0,0,0|2,0,0]=4 9554 B10R1.245 [13CH3]Nc1c(cccc1Br)F 34a_100000684712_200025704644 [1,1,0,0,0,0|2,0,0]=4 9555 B10R1.245 [13CH3]Nc1c(cccc1Br)O 34a_100011934926_200025704644 [1,1,0,0,0,0|1,0,0]=3 9556 B10R1.245 [13CH3]Nc1c(cccc1Cl)Cl 34a_100000210028_200025704644 [1,1,0,0,0,0|2,0,0]=4 9557 B10R1.245 [13CH3]Nc1c(cccc1Cl)F 34a_100000760031_200025704644 [1,1,0,0,0,0|2,0,0]=4 9558 B10R1.245 [13CH3]Nc1c(cccc1Cl)O 34a_100012022510_200025704644 [1,1,0,0,0,0|1,0,0]=3 9559 B10R1.245 [13CH3]Nc1c(cccc1F)F 2230a_100000210704_200025704644 [1,1,0,0,0,0|2,0,0]=4 9560 B10R1.245 [13CH3]Nc1c(cccc1F)F 34a_100000210704_200025704644 [1,1,0,0,0,0|2,0,0]=4 9561 B10R1.245 [13CH3]Nc1c(cccc1F)O 34a_100020591140_200025704644 [1,1,0,0,0,0|1,0,0]=3 9562 B10R1.245 [13CH3]Nc1c(cccc1I)F 34a_100000042321_200025704644 [1,1,0,0,0,0|2,0,0]=4 9563 B10R1.245 [13CH3]Oc1c(cccc1Br)Br 34a_100000736428_200025704644 [1,1,0,0,0,0|2,0,0]=4 9564 B10R1.245 [13CH3]Oc1c(cccc1Br)Br 7a_100000736428_200025704644 [1,1,0,0,0,0|2,0,0]=4 9565 B10R1.245 [13CH3]Oc1c(cccc1Br)Cl 34a_100010214474_200025704644 [1,1,0,0,0,0|2,0,0]=4 9566 B10R1.245 [13CH3]Oc1c(cccc1Br)Cl 7a_100010214474_200025704644 [1,1,0,0,0,0|2,0,0]=4 9567 B10R1.245 [13CH3]Oc1c(cccc1Br)F 34a_100009813666_200025704644 [1,1,0,0,0,0|2,0,0]=4 9568 B10R1.245 [13CH3]Oc1c(cccc1Br)F 7a_100009813666_200025704644 [1,1,0,0,0,0|2,0,0]=4 9569 B10R1.245 [13CH3]Oc1c(cccc1Br)N 34a_100011934915_200025704644 [1,1,0,0,0,0|2,0,0]=4 9570 B10R1.245 [13CH3]Oc1c(cccc1Cl)Cl 34a_100000211709_200025704644 [1,1,0,0,0,0|2,0,0]=4 9571 B10R1.245 [13CH3]Oc1c(cccc1Cl)Cl 7a_100000211709_200025704644 [1,1,0,0,0,0|2,0,0]=4 9572 B10R1.245 [13CH3]Oc1c(cccc1Cl)F 34a_100000694953_200025704644 [1,1,0,0,0,0|2,0,0]=4 9573 B10R1.245 [13CH3]Oc1c(cccc1Cl)F 7a_100000694953_200025704644 [1,1,0,0,0,0|2,0,0]=4 9574 B10R1.245 [13CH3]Oc1c(cccc1Cl)N 34a_100000754742_200025704644 [1,1,0,0,0,0|2,0,0]=4 9575 B10R1.245 [13CH3]Oc1c(cccc1F)F 34a_100000230165_200025704644 [1,1,0,0,0,0|2,0,0]=4 9576 B10R1.245 [13CH3]Oc1c(cccc1F)F 7a_100000230165_200025704644 [1,1,0,0,0,0|2,0,0]=4 9577 B10R1.245 [13CH3]Oc1c(cccc1F)N 34a_100011934987_200025704644 [1,1,0,0,0,0|2,0,0]=4 9578 B10R1.245 [13CH3]Oc1c(cccc1I)Br 34a_100010084509_200025704644 [1,1,0,0,0,0|2,0,0]=4 9579 B10R1.245 [13CH3]Oc1c(cccc1I)Br 7a_100010084509_200025704644 [1,1,0,0,0,0|2,0,0]=4 9580 B10R1.245 [13CH3]Oc1c(cccc1I)Cl 34a_100010202889_200025704644 [1,1,0,0,0,0|2,0,0]=4 9581 B10R1.245 [13CH3]Oc1c(cccc1I)Cl 7a_100010202889_200025704644 [1,1,0,0,0,0|2,0,0]=4 9582 B10R1.245 [13CH3]Oc1c(cccc1I)F 34a_100010186298_200025704644 [1,1,0,0,0,0|2,0,0]=4 9583 B10R1.245 [13CH3]Oc1c(cccc1I)F 7a_100010186298_200025704644 [1,1,0,0,0,0|2,0,0]=4 9584 B10R1.245 [13CH3]Oc1c(cccc1I)N 34a_100010084371_200025704644 [1,1,0,0,0,0|2,0,0]=4 9585 B10R1.245 [13CH3]Oc1c(cccc1N)N 34a_200016994477_200025704644 [1,1,0,0,0,0|2,0,0]=4 9586 B10R1.245 [13CH3]Sc1c(cccc1Br)Br 62a_100009994525_200025704644 [1,1,0,0,0,0|2,0,0]=4 9587 B10R1.245 [13CH3]Sc1c(cccc1Br)Br 62a_200025704644_100009994525 [1,1,0,0,0,0|2,0,0]=4 9588 B10R1.245 [13CH3]Sc1c(cccc1Br)Cl 62a_100010214488_200025704644 [1,1,0,0,0,0|2,0,0]=4 9589 B10R1.245 [13CH3]Sc1c(cccc1Br)Cl 62a_200025704644_100010214488 [1,1,0,0,0,0|2,0,0]=4 9590 B10R1.245 [13CH3]Sc1c(cccc1Br)F 62a_100011219512_200025704644 [1,1,0,0,0,0|2,0,0]=4 9591 B10R1.245 [13CH3]Sc1c(cccc1Br)F 62a_200025704644_100011219512 [1,1,0,0,0,0|2,0,0]=4 9592 B10R1.245 [13CH3]Sc1c(cccc1Br)N 62a_100020590159_200025704644 [1,1,0,0,0,0|2,0,0]=4 9593 B10R1.245 [13CH3]Sc1c(cccc1Br)N 62a_200025704644_100020590159 [1,1,0,0,0,0|2,0,0]=4 9594 B10R1.245 [13CH3]Sc1c(cccc1Br)O 62a_100010187912_200025704644 [1,1,0,0,0,0|1,0,0]=3 9595 B10R1.245 [13CH3]Sc1c(cccc1Br)O 62a_200025704644_100010187912 [1,1,0,0,0,0|1,0,0]=3 9596 B10R1.245 [13CH3]Sc1c(cccc1Cl)Cl 62a_100000034237_200025704644 [1,1,0,0,0,0|2,0,0]=4 9597 B10R1.245 [13CH3]Sc1c(cccc1Cl)Cl 62a_200025704644_100000034237 [1,1,0,0,0,0|2,0,0]=4 9598 B10R1.245 [13CH3]Sc1c(cccc1Cl)F 62a_100000050007_200025704644 [1,1,0,0,0,0|2,0,0]=4 9599 B10R1.245 [13CH3]Sc1c(cccc1Cl)F 62a_200025704644_100000050007 [1,1,0,0,0,0|2,0,0]=4 9600 B10R1.245 [13CH3]Sc1c(cccc1Cl)N 62a_100000049713_200025704644 [1,1,0,0,0,0|2,0,0]=4 9601 B10R1.245 [13CH3]Sc1c(cccc1Cl)N 62a_200025704644_100000049713 [1,1,0,0,0,0|2,0,0]=4 9602 B10R1.245 [13CH3]Sc1c(cccc1Cl)O 62a_200025704644_100000050174 [1,1,0,0,0,0|1,0,0]=3 9603 B10R1.245 [13CH3]Sc1c(cccc1F)F 62a_100000693133_200025704644 [1,1,0,0,0,0|2,0,0]=4 9604 B10R1.245 [13CH3]Sc1c(cccc1F)F 62a_200025704644_100000693133 [1,1,0,0,0,0|2,0,0]=4 9605 B10R1.245 [13CH3]Sc1c(cccc1F)N 62a_100000690935_200025704644 [1,1,0,0,0,0|2,0,0]=4 9606 B10R1.245 [13CH3]Sc1c(cccc1F)N 62a_200025704644_100000690935 [1,1,0,0,0,0|2,0,0]=4 9607 B10R1.245 [13CH3]Sc1c(cccc1F)O 62a_100009820682_200025704644 [1,1,0,0,0,0|1,0,0]=3 9608 B10R1.245 [13CH3]Sc1c(cccc1F)O 62a_200025704644_100009820682 [1,1,0,0,0,0|1,0,0]=3 9609 B10R1.245 [13CH3]Sc1c(cccc1O)N 62a_100012183704_200025704644 [1,1,0,0,0,0|1,0,0]=3 9610 B10R1.245 [13CH3]Sc1c(cccc1O)N 62a_200025704644_100012183704 [1,1,0,0,0,0|1,0,0]=3 9611 B10R1.245 [13CH3]Sc1c(cccc1O)O 62a_200025704644_100010205330 [1,1,0,0,0,0|1,0,0]=3 9612 B10R1.245 [13CH3]Sc1c(ccnc1O)O 62a_200025704644_200009817435 [1,1,0,0,0,0|2,0,0]=4 9613 B10R1.5 CCSc1ccsc1CO 62a_100000210202_100000702026 [0,1,0,0,1,0|2,0,0]=4 9614 B10R1.5 CCSc1ccsc1CO 62a_100000702026_100000210202 [0,1,0,0,1,0|2,0,0]=4 9615 B10R1.5 CCSc1cscc1CO 62a_100000210202_100000724555 [0,1,0,0,1,0|2,0,0]=4 9616 B10R1.5 CCSc1cscc1CO 62a_100000724555_100000210202 [0,1,0,0,1,0|2,0,0]=4 9617 B10R1.5 CCSc1sccc1CO 62a_100000210202_100009816922 [0,1,0,0,1,0|2,0,0]=4 9618 B10R1.5 CCSc1sccc1CO 62a_100009816922_100000210202 [0,1,0,0,1,0|2,0,0]=4 9619 B10R1.5 CNCc1occc1OC 207a_100102657272_200009856553 [0,1,0,0,1,0|2,0,0]=4 9620 B10R1.5 CNCc1occc1OC 270004a_106832991635_200009856553 [0,1,0,0,1,0|2,0,0]=4 9621 B10R1.5 CNCc1sccc1OC 207a_100102657272_100000689126 [0,1,0,0,1,0|2,0,0]=4 9622 B10R1.5 CNCc1sccc1OC 270004a_106832991635_100000689126 [0,1,0,0,1,0|2,0,0]=4 9623 B10R1.29 CCCCc1ccsc1C 271570a_100020621405_100000684487 [0,1,0,0,1,0|2,0,0]=4 9624 B10R1.29 CCCCc1ccsc1O 271570a_203496583355_100010071534 [0,1,0,0,1,0|1,0,0]=3 9625 B10R1.29 CCCCc1cscc1Br 271570a_100020621405_100010143727 [0,1,0,0,1,0|2,0,0]=4 9626 B10R1.29 CCCCc1cscc1C 271570a_100020621405_100000759966 [0,1,0,0,1,0|2,0,0]=4 9627 B10R1.29 CCCCc1sccc1Br 271570a_100020621405_100012361411 [0,1,0,0,1,0|2,0,0]=4 9628 B10R1.29 CCCCc1sccc1C 271570a_100020621405_100000742657 [0,1,0,0,1,0|2,0,0]=4 9629 B10R1.29 CCCCn1nccc1O 271570a_203496583355_200010264484 [0,1,0,0,1,0|2,0,0]=4 9630 B10R1.29 CCCSc1ccsc1C 62a_100000210303_100000684487 [0,1,0,0,1,0|2,0,0]=4 9631 B10R1.29 CCCSc1ccsc1C 62a_100000684487_100000210303 [0,1,0,0,1,0|2,0,0]=4 9632 B10R1.29 CCCSc1cscc1Br 62a_100000210303_100010143727 [0,1,0,0,1,0|2,0,0]=4 9633 B10R1.29 CCCSc1cscc1Br 62a_100010143727_100000210303 [0,1,0,0,1,0|2,0,0]=4 9634 B10R1.29 CCCSc1cscc1C 62a_100000210303_100000759966 [0,1,0,0,1,0|2,0,0]=4 9635 B10R1.29 CCCSc1cscc1C 62a_100000759966_100000210303 [0,1,0,0,1,0|2,0,0]=4 9636 B10R1.29 CCCSc1sccc1Br 62a_100000210303_100012361411 [0,1,0,0,1,0|2,0,0]=4 9637 B10R1.29 CCCSc1sccc1Br 62a_100012361411_100000210303 [0,1,0,0,1,0|2,0,0]=4 9638 B10R1.29 CCCSc1sccc1C 62a_100000210303_100010247149 [0,1,0,0,1,0|2,0,0]=4 9639 B10R1.29 CCCSc1sccc1C 62a_100010247149_100000210303 [0,1,0,0,1,0|2,0,0]=4 9640 B10R1.29 CCNCc1cccn1C 270004a_100015525214_100000211633 [0,1,0,0,1,0|2,0,0]=4 9641 B10R1.29 CCNCc1cccn1C 34a_100011219357_100000210202 [0,1,0,0,1,0|2,0,0]=4 9642 B10R1.29 CCNCc1ccsc1Br 207a_100015525214_100009816921 [0,1,0,0,1,0|2,0,0]=4 9643 B10R1.29 CCNCc1ccsc1Br 2230a_100000727803_100000210202 [0,1,0,0,1,0|2,0,0]=4 9644 B10R1.29 CCNCc1ccsc1Br 2230a_100015525214_100009814289 [0,1,0,0,1,0|2,0,0]=4 9645 B10R1.29 CCNCc1ccsc1Br 270004a_100015525214_100009816921 [0,1,0,0,1,0|2,0,0]=4 9646 B10R1.29 CCNCc1ccsc1Br 34a_100000727803_100000210202 [0,1,0,0,1,0|2,0,0]=4 9647 B10R1.29 CCNCc1ccsc1Cl 207a_100015525214_100000089901 [0,1,0,0,1,0|2,0,0]=4 9648 B10R1.29 CCNCc1ccsc1Cl 2230a_100015525214_100010167017 [0,1,0,0,1,0|2,0,0]=4 9649 B10R1.29 CCNCc1ccsc1Cl 270004a_100015525214_100000089901 [0,1,0,0,1,0|2,0,0]=4 9650 B10R1.29 CCNCc1cscc1Br 207a_100015525214_100000685484 [0,1,0,0,1,0|2,0,0]=4 9651 B10R1.29 CCNCc1cscc1Br 270004a_100015525214_100000685484 [0,1,0,0,1,0|2,0,0]=4 9652 B10R1.29 CCNCc1occc1Br 270004a_100015525214_100000756499 [0,1,0,0,1,0|2,0,0]=4 9653 B10R1.29 CCNCc1occc1C 207a_100015525214_100000763527 [0,1,0,0,1,0|2,0,0]=4 9654 B10R1.29 CCNCc1occc1C 270004a_100015525214_100000763527 [0,1,0,0,1,0|2,0,0]=4 9655 B10R1.29 CCNCc1sccc1Br 207a_100015525214_100000766043 [0,1,0,0,1,0|2,0,0]=4 9656 B10R1.29 CCNCc1sccc1Br 270004a_100015525214_100000766043 [0,1,0,0,1,0|2,0,0]=4 9657 B10R1.29 CCNCc1sccc1C 207a_100015525214_100000210881 [0,1,0,0,1,0|2,0,0]=4 9658 B10R1.29 CCNCc1sccc1C 2230a_100000238519_100000210202 [0,1,0,0,1,0|2,0,0]=4 9659 B10R1.29 CCNCc1sccc1C 270004a_100015525214_100000210881 [0,1,0,0,1,0|2,0,0]=4 9660 B10R1.29 CCNCc1sccc1C 34a_100000238519_100000210202 [0,1,0,0,1,0|2,0,0]=4 9661 B10R1.29 CCNCc1sccc1Cl 207a_100015525214_100000722334 [0,1,0,0,1,0|2,0,0]=4 9662 B10R1.29 CCNCc1sccc1Cl 2230a_100011934584_100000210202 [0,1,0,0,1,0|2,0,0]=4 9663 B10R1.29 CCNCc1sccc1Cl 270004a_100015525214_100000722334 [0,1,0,0,1,0|2,0,0]=4 9664 B10R1.29 CCNCc1sccc1Cl 34a_100011934584_100000210202 [0,1,0,0,1,0|2,0,0]=4 9665 B10R1.29 CCOCc1ccoc1C 34a_100011219433_100000210202 [0,1,0,0,1,0|2,0,0]=4 9666 B10R1.29 CCOCc1ccoc1C 7a_100011219433_100000210202 [0,1,0,0,1,0|2,0,0]=4 9667 B10R1.29 CCOCc1ccsc1Br 34a_100009816922_100000210202 [0,1,0,0,1,0|2,0,0]=4 9668 B10R1.29 CCOCc1ccsc1Br 34a_100121572206_100009814289 [0,1,0,0,1,0|2,0,0]=4 9669 B10R1.29 CCOCc1ccsc1Br 7a_100009816922_100000210202 [0,1,0,0,1,0|2,0,0]=4 9670 B10R1.29 CCOCc1ccsc1Cl 34a_100121572206_100010167017 [0,1,0,0,1,0|2,0,0]=4 9671 B10R1.29 CCOCc1cscc1Br 34a_100000724555_100000210202 [0,1,0,0,1,0|2,0,0]=4 9672 B10R1.29 CCOCc1occc1C 34a_100011273948_100000210202 [0,1,0,0,1,0|2,0,0]=4 9673 B10R1.29 CCOCc1occc1C 7a_100011273948_100000210202 [0,1,0,0,1,0|2,0,0]=4 9674 B10R1.29 CCOCc1sccc1Br 34a_100000702026_100000210202 [0,1,0,0,1,0|2,0,0]=4 9675 B10R1.29 CCOCc1sccc1C 34a_100000238368_100000210202 [0,1,0,0,1,0|2,0,0]=4 9676 B10R1.29 CCOCc1sccc1C 7a_100000238368_100000210202 [0,1,0,0,1,0|2,0,0]=4 9677 B10R1.29 CCOCc1sccc1Cl 34a_100000722387_100000210202 [0,1,0,0,1,0|2,0,0]=4 9678 B10R1.29 CCOCc1sccc1Cl 7a_100000722387_100000210202 [0,1,0,0,1,0|2,0,0]=4 9679 B10R1.29 CCOCn1ccnc1O 271570a_203496583355_100000040581 [0,1,0,0,1,0|2,0,0]=4 9680 B10R1.29 CCSCc1ccsc1Br 62a_100000210202_100009814289 [0,1,0,0,1,0|2,0,0]=4 9681 B10R1.29 CCSCc1ccsc1Br 62a_100009814289_100000210202 [0,1,0,0,1,0|2,0,0]=4 9682 B10R1.29 CCSCc1ccsc1Cl 62a_100000210202_100010167017 [0,1,0,0,1,0|2,0,0]=4 9683 B10R1.29 CCSCc1ccsc1Cl 62a_100010167017_100000210202 [0,1,0,0,1,0|2,0,0]=4 9684 B10R1.29 CNCCc1cccn1C 2230a_100011251756_200000210301 [0,1,0,0,1,0|2,0,0]=4 9685 B10R1.29 CNCCc1cccn1C 34a_100011251756_200000210301 [0,1,0,0,1,0|2,0,0]=4 9686 B10R1.29 Cn1cccc1CCN[13CH3] 2230a_100011251756_200025704644 [0,1,0,0,1,0|2,0,0]=4 9687 B10R1.29 Cn1cccc1CCN[13CH3] 34a_100011251756_200025704644 [0,1,0,0,1,0|2,0,0]=4 9688 B12R1.18 CCCOc1cccccc1=O 34a_100000036025_100000210303 [0,1,0,0,0,1|0,0,1]=3 9689 B12R1.18 CCCOc1cccccc1=O 7a_100000036025_100000210303 [0,1,0,0,0,1|0,0,1]=3 9690 B12R1.18 CSCOc1cccccc1=O 34a_100000036025_100011218213 [0,1,0,0,0,1|1,0,1]=4 9691 B12R1.18 O=c1cccccc1OCCF 34a_100000036025_100011217306 [0,1,0,0,0,1|1,0,1]=4 9692 B12R1.18 O=c1cccccc1OCCF 7a_100000036025_100011217306 [0,1,0,0,0,1|1,0,1]=4 9693 B12R1.18 O=c1cccccc1OCCO 34a_100000036025_100000211926 [0,1,0,0,0,1|1,0,1]=4 9694 B12R1.18 O=c1cccccc1OCCO 7a_100000036025_100000211926 [0,1,0,0,0,1|1,0,1]=4 9695 B12R1.210 CC(C)Oc1cccccc1=O 34a_100000036025_100000210206 [0,1,0,0,0,1|1,0,1]=4 9696 B12R1.210 CC(C)Oc1cccccc1=O 7a_100000036025_100000210206 [0,1,0,0,0,1|1,0,1]=4 9697 B12R1.24 CC(N[13CH3])c1cccc(c1Cl)Cl 2230a_100015335525_200025704644 [0,2,0,0,0,0|2,0,0]=4 9698 B12R1.24 CC(N[13CH3])c1cccc(c1Cl)Cl 34a_100015335525_200025704644 [0,2,0,0,0,0|2,0,0]=4 9699 B12R1.24 CC(N[13CH3])c1cccc(c1Cl)F 2230a_100103153465_200025704644 [0,2,0,0,0,0|2,0,0]=4 9700 B12R1.24 CC(N[13CH3])c1cccc(c1Cl)F 34a_100103153465_200025704644 [0,2,0,0,0,0|2,0,0]=4 9701 B12R1.24 CC(O[13CH3])c1cccc(c1F)Br 34a_200012356376_200025704644 [0,2,0,0,0,0|2,0,0]=4 9702 B12R1.24 CC(O[13CH3])c1cccc(c1F)Br 7a_200012356376_200025704644 [0,2,0,0,0,0|2,0,0]=4 9703 B12R1.24 CC(O[13CH3])c1cccc(c1F)F 34a_100011944069_200025704644 [0,2,0,0,0,0|2,0,0]=4 9704 B12R1.24 CC(O[13CH3])c1cccc(c1F)F 7a_100011944069_200025704644 [0,2,0,0,0,0|2,0,0]=4 9705 B12R1.24 CCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000210202 [0,2,0,0,0,0|1,0,1]=4 9706 B12R1.24 CCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000210202 [0,2,0,0,0,0|1,0,1]=4 9707 B12R1.24 CCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000210202 [0,2,0,0,0,0|1,0,1]=4 9708 B12R1.24 CCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000210202 [0,2,0,0,0,0|1,0,1]=4 9709 B12R1.24 CCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000210202 [0,2,0,0,0,0|1,0,1]=4 9710 B12R1.24 CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210202 [0,2,0,0,0,0|1,0,1]=4 9711 B12R1.24 CCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000210202 [0,2,0,0,0,0|1,0,1]=4 9712 B12R1.24 CCC(=O)c1cccc(c1C)C 1458a_100000183679_100000210202 [0,2,0,0,0,0|1,0,1]=4 9713 B12R1.24 CCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000210202 [0,2,0,0,0,0|1,0,1]=4 9714 B12R1.24 CCC(=O)c1cccc(c1C)F 1458a_100011218272_100000210202 [0,2,0,0,0,0|1,0,1]=4 9715 B12R1.24 CCC(=O)c1cccc(c1C)I 1458a_100000751865_100000210202 [0,2,0,0,0,0|1,0,1]=4 9716 B12R1.24 CCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210202 [0,2,0,0,0,0|1,0,1]=4 9717 B12R1.24 CCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000210202 [0,2,0,0,0,0|1,0,1]=4 9718 B12R1.24 CCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000210202 [0,2,0,0,0,0|1,0,1]=4 9719 B12R1.24 CCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000210202 [0,2,0,0,0,0|1,0,1]=4 9720 B12R1.24 CCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000210202 [0,2,0,0,0,0|1,0,1]=4 9721 B12R1.24 CCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210202 [0,2,0,0,0,0|1,0,1]=4 9722 B12R1.24 CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210202 [0,2,0,0,0,0|1,0,1]=4 9723 B12R1.24 CCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000210202 [0,2,0,0,0,0|1,0,1]=4 9724 B12R1.24 CCC(=O)c1cccc(c1F)C 1458a_100000766181_100000210202 [0,2,0,0,0,0|1,0,1]=4 9725 B12R1.24 CCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000210202 [0,2,0,0,0,0|1,0,1]=4 9726 B12R1.24 CCC(=O)c1cccc(c1F)F 1458a_100000748134_100000210202 [0,2,0,0,0,0|1,0,1]=4 9727 B12R1.24 CCC(=O)c1cccc(c1F)I 1458a_100010185205_100000210202 [0,2,0,0,0,0|1,0,1]=4 9728 B12R1.24 CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210202 [0,2,0,0,0,0|1,0,1]=4 9729 B12R1.24 CCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000210202 [0,2,0,0,0,0|1,0,1]=4 9730 B12R1.24 CCC(=O)c1cccc(c1I)C 1458a_100000739377_100000210202 [0,2,0,0,0,0|1,0,1]=4 9731 B12R1.24 CCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000210202 [0,2,0,0,0,0|1,0,1]=4 9732 B12R1.24 CCC(=O)c1cccc(c1I)F 1458a_100000690930_100000210202 [0,2,0,0,0,0|1,0,1]=4 9733 B12R1.24 CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210202 [0,2,0,0,0,0|1,0,1]=4 9734 B12R1.24 CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210202 [0,2,0,0,0,0|0,0,1]=3 9735 B12R1.24 CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210202 [0,2,0,0,0,0|0,0,1]=3 9736 B12R1.24 CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210202 [0,2,0,0,0,0|0,0,1]=3 9737 B12R1.24 CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210202 [0,2,0,0,0,0|0,0,1]=3 9738 B12R1.24 CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210202 [0,2,0,0,0,0|0,0,1]=3 9739 B12R1.24 CCN(C)c1cccc(c1C)C 2230a_100000219776_200000210301 [0,2,0,0,0,0|2,0,0]=4 9740 B12R1.24 CCN(C)c1cccc(c1C)C 269982a_100000219776_200000210301 [0,2,0,0,0,0|2,0,0]=4 9741 B12R1.24 CCN(C)c1cccc(c1C)C 34a_100000219776_200000210301 [0,2,0,0,0,0|2,0,0]=4 9742 B12R1.24 CCN(C)c1cccc(c1C)C 7a_100000219776_200000210301 [0,2,0,0,0,0|2,0,0]=4 9743 B12R1.24 CCN(C)c1cccc(c1C)Cl 2230a_100020606106_100000210202 [0,2,0,0,0,0|2,0,0]=4 9744 B12R1.24 CCN(C)c1cccc(c1C)Cl 269982a_100020606106_100000204670 [0,2,0,0,0,0|2,0,0]=4 9745 B12R1.24 CCN(C)c1cccc(c1C)Cl 34a_100020606106_100000210202 [0,2,0,0,0,0|2,0,0]=4 9746 B12R1.24 CCN(C)c1cccc(c1C)Cl 38a_100020606106_100000204670 [0,2,0,0,0,0|2,0,0]=4 9747 B12R1.24 CCN(C)c1cccc(c1Cl)Cl 2230a_100000742713_100000210202 [0,2,0,0,0,0|2,0,0]=4 9748 B12R1.24 CCN(C)c1cccc(c1Cl)Cl 269982a_100000742713_100000204670 [0,2,0,0,0,0|2,0,0]=4 9749 B12R1.24 CCN(C)c1cccc(c1Cl)Cl 34a_100000742713_100000210202 [0,2,0,0,0,0|2,0,0]=4 9750 B12R1.24 CCN(C)c1cccc(c1F)Cl 2230a_100020633735_100000210202 [0,2,0,0,0,0|2,0,0]=4 9751 B12R1.24 CCN(C)c1cccc(c1F)Cl 269982a_100020633735_100000204670 [0,2,0,0,0,0|2,0,0]=4 9752 B12R1.24 CCN(C)c1cccc(c1F)Cl 34a_100020633735_100000210202 [0,2,0,0,0,0|2,0,0]=4 9753 B12R1.24 CCN(C)c1cccc(c1F)Cl 38a_100020633735_100000204670 [0,2,0,0,0,0|2,0,0]=4 9754 B12R1.24 CCN([13CH3])c1cccc(c1C)C 2230a_100000219776_200025704644 [0,2,0,0,0,0|2,0,0]=4 9755 B12R1.24 CCN([13CH3])c1cccc(c1C)C 269982a_100000219776_200025704644 [0,2,0,0,0,0|2,0,0]=4 9756 B12R1.24 CCN([13CH3])c1cccc(c1C)C 34a_100000219776_200025704644 [0,2,0,0,0,0|2,0,0]=4 9757 B12R1.24 CCN([13CH3])c1cccc(c1C)C 7a_100000219776_200025704644 [0,2,0,0,0,0|2,0,0]=4 9758 B12R1.24 CNC(=O)c1cccc(c1O)Br 240690a_100102657272_100000752940 [0,2,0,0,0,0|1,0,1]=4 9759 B12R1.24 CNC(=O)c1cccc(c1O)Br 527a_100102657272_100000752940 [0,2,0,0,0,0|1,0,1]=4 9760 B12R1.24 CNC(=O)c1cccc(c1O)C 240690a_100102657272_100000183896 [0,2,0,0,0,0|1,0,1]=4 9761 B12R1.24 CNC(=O)c1cccc(c1O)C 527a_100102657272_100000183896 [0,2,0,0,0,0|1,0,1]=4 9762 B12R1.24 CNC(=O)c1cccc(c1O)Cl 240690a_100102657272_100000742801 [0,2,0,0,0,0|1,0,1]=4 9763 B12R1.24 CNC(=O)c1cccc(c1O)Cl 527a_100102657272_100000742801 [0,2,0,0,0,0|1,0,1]=4 9764 B12R1.24 CNC(=O)c1cccc(c1O)F 240690a_100102657272_100011217230 [0,2,0,0,0,0|1,0,1]=4 9765 B12R1.24 CNC(=O)c1cccc(c1O)F 527a_100102657272_100011217230 [0,2,0,0,0,0|1,0,1]=4 9766 B12R1.24 CNC(=O)c1cccc(c1O)O 527a_100102657272_100000690420 [0,2,0,0,0,0|1,0,1]=4 9767 B12R1.24 CNC(C)c1cccc(c1Br)Cl 269862a_106832991636_100010145520 [0,2,0,0,0,0|2,0,0]=4 9768 B12R1.24 CNC(C)c1cccc(c1Br)F 269862a_106832991636_100012362612 [0,2,0,0,0,0|2,0,0]=4 9769 B12R1.24 CNC(C)c1cccc(c1C)Br 269862a_106832991636_100012706834 [0,2,0,0,0,0|2,0,0]=4 9770 B12R1.24 CNC(C)c1cccc(c1C)C 2230a_106832991635_100012183177 [0,2,0,0,0,0|2,0,0]=4 9771 B12R1.24 CNC(C)c1cccc(c1C)C 269862a_106832991636_100000756305 [0,2,0,0,0,0|2,0,0]=4 9772 B12R1.24 CNC(C)c1cccc(c1C)C 34a_100102657272_100012183177 [0,2,0,0,0,0|2,0,0]=4 9773 B12R1.24 CNC(C)c1cccc(c1C)C 7a_106832991635_100012183177 [0,2,0,0,0,0|2,0,0]=4 9774 B12R1.24 CNC(C)c1cccc(c1C)Cl 269862a_106832991636_100012002460 [0,2,0,0,0,0|2,0,0]=4 9775 B12R1.24 CNC(C)c1cccc(c1C)F 269862a_106832991636_100000061526 [0,2,0,0,0,0|2,0,0]=4 9776 B12R1.24 CNC(C)c1cccc(c1C)I 269862a_106832991636_100010725598 [0,2,0,0,0,0|2,0,0]=4 9777 B12R1.24 CNC(C)c1cccc(c1Cl)Br 269862a_106832991636_100012349481 [0,2,0,0,0,0|2,0,0]=4 9778 B12R1.24 CNC(C)c1cccc(c1Cl)Cl 2230a_100015335525_200000210301 [0,2,0,0,0,0|2,0,0]=4 9779 B12R1.24 CNC(C)c1cccc(c1Cl)Cl 269862a_106832991636_100000756844 [0,2,0,0,0,0|2,0,0]=4 9780 B12R1.24 CNC(C)c1cccc(c1Cl)Cl 34a_100015335525_200000210301 [0,2,0,0,0,0|2,0,0]=4 9781 B12R1.24 CNC(C)c1cccc(c1Cl)F 2230a_100103153465_200000210301 [0,2,0,0,0,0|2,0,0]=4 9782 B12R1.24 CNC(C)c1cccc(c1Cl)F 269862a_106832991636_100000699253 [0,2,0,0,0,0|2,0,0]=4 9783 B12R1.24 CNC(C)c1cccc(c1Cl)F 34a_100103153465_200000210301 [0,2,0,0,0,0|2,0,0]=4 9784 B12R1.24 CNC(C)c1cccc(c1F)Br 269862a_106832991636_100012355707 [0,2,0,0,0,0|2,0,0]=4 9785 B12R1.24 CNC(C)c1cccc(c1F)C 269862a_106832991636_100012182731 [0,2,0,0,0,0|2,0,0]=4 9786 B12R1.24 CNC(C)c1cccc(c1F)Cl 269862a_106832991636_100011830330 [0,2,0,0,0,0|2,0,0]=4 9787 B12R1.24 CNC(C)c1cccc(c1F)F 269862a_106832991636_100000696358 [0,2,0,0,0,0|2,0,0]=4 9788 B12R1.24 CNC(C)c1cccc(c1O)Br 269862a_106832991636_100009815558 [0,2,0,0,0,0|1,0,0]=3 9789 B12R1.24 CNC(C)c1cccc(c1O)C 269862a_106832991636_100009847209 [0,2,0,0,0,0|1,0,0]=3 9790 B12R1.24 CNC(C)c1cccc(c1O)Cl 269862a_106832991636_100000043392 [0,2,0,0,0,0|1,0,0]=3 9791 B12R1.24 CNC(C)c1cccc(c1O)F 269862a_106832991636_100011246037 [0,2,0,0,0,0|1,0,0]=3 9792 B12R1.24 CN[C@@H](C)c1cccc(c1F)F 2230a_100020612118_200000210301 [0,2,0,0,0,0|2,0,0]=4 9793 B12R1.24 CN[C@@H](C)c1cccc(c1F)F 34a_100020612118_200000210301 [0,2,0,0,0,0|2,0,0]=4 9794 B12R1.24 CN[C@H](C)c1cccc(c1F)Cl 2230a_100016987989_200000210301 [0,2,0,0,0,0|2,0,0]=4 9795 B12R1.24 CN[C@H](C)c1cccc(c1F)Cl 34a_100016987989_200000210301 [0,2,0,0,0,0|2,0,0]=4 9796 B12R1.24 COC(=O)c1cccc(c1O)Br 271570a_203496583355_100010150843 [0,2,0,0,0,0|1,0,1]=4 9797 B12R1.24 COC(=O)c1cccc(c1O)C 271570a_203496583355_100012002529 [0,2,0,0,0,0|1,0,1]=4 9798 B12R1.24 COC(=O)c1cccc(c1O)F 271570a_203496583355_100012357630 [0,2,0,0,0,0|1,0,1]=4 9799 B12R1.24 COC(=O)c1cccc(c1O)N 271570a_203496583355_100000719424 [0,2,0,0,0,0|1,0,1]=4 9800 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_100009816214 [0,2,0,0,0,0|1,0,1]=4 9801 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_200010230364 [0,2,0,0,0,0|1,0,1]=4 9802 B12R1.24 COC(C)c1cccc(c1C)C 34a_100138415774_100012183177 [0,2,0,0,0,0|2,0,0]=4 9803 B12R1.24 COC(C)c1cccc(c1F)Br 34a_200012356376_200000210301 [0,2,0,0,0,0|2,0,0]=4 9804 B12R1.24 COC(C)c1cccc(c1F)Br 7a_200012356376_200000210301 [0,2,0,0,0,0|2,0,0]=4 9805 B12R1.24 COC(C)c1cccc(c1F)F 34a_100011944069_200000210301 [0,2,0,0,0,0|2,0,0]=4 9806 B12R1.24 COC(C)c1cccc(c1F)F 7a_100011944069_200000210301 [0,2,0,0,0,0|2,0,0]=4 9807 B12R1.24 COC(C)c1cccc(c1F)O 271570a_203496583355_200010365929 [0,2,0,0,0,0|2,0,0]=4 9808 B12R1.24 CSC(C)c1cccc(c1C)C 62a_100012183177_200000210301 [0,2,0,0,0,0|2,0,0]=4 9809 B12R1.24 CSC(C)c1cccc(c1C)C 62a_200000210301_100012183177 [0,2,0,0,0,0|2,0,0]=4 9810 B12R1.24 C[C@@H](N[13CH3])c1cccc(c1F)Cl 2230a_100016987989_200025704644 [0,2,0,0,0,0|2,0,0]=4 9811 B12R1.24 C[C@@H](N[13CH3])c1cccc(c1F)Cl 34a_100016987989_200025704644 [0,2,0,0,0,0|2,0,0]=4 9812 B12R1.24 C[C@H](N[13CH3])c1cccc(c1F)F 2230a_100020612118_200025704644 [0,2,0,0,0,0|2,0,0]=4 9813 B12R1.24 C[C@H](N[13CH3])c1cccc(c1F)F 34a_100020612118_200025704644 [0,2,0,0,0,0|2,0,0]=4 9814 B12R1.24 Cc1cccc(c1C)C(C)S[13CH3] 62a_100012183177_200025704644 [0,2,0,0,0,0|2,0,0]=4 9815 B12R1.24 Cc1cccc(c1C)C(C)S[13CH3] 62a_200025704644_100012183177 [0,2,0,0,0,0|2,0,0]=4 9816 B12R1.24 Cc1cccc(c1O)C(=O)CF 1458a_100000183896_100015361967 [0,2,0,0,0,0|1,0,1]=4 9817 B12R1.24 O=C(CF)c1cccc(c1O)Br 1458a_100000752940_100015361967 [0,2,0,0,0,0|1,0,1]=4 9818 B12R1.24 O=C(CF)c1cccc(c1O)Cl 1458a_100000742801_100015361967 [0,2,0,0,0,0|1,0,1]=4 9819 B12R1.24 O=C(CF)c1cccc(c1O)F 1458a_100011217230_100015361967 [0,2,0,0,0,0|1,0,1]=4 9820 B12R1.24 O=C(CF)c1cccc(c1O)O 1458a_100000690420_100015361967 [0,2,0,0,0,0|1,0,1]=4 9821 B12R1.25 C#CCNc1cccc(c1O)Br 34a_100011934915_100000184674 [0,2,0,0,0,0|0,0,2]=4 9822 B12R1.25 C#CCNc1cccc(c1O)C 34a_100000756359_100000184674 [0,2,0,0,0,0|0,0,2]=4 9823 B12R1.25 C#CCNc1cccc(c1O)Cl 34a_100000754742_100000184674 [0,2,0,0,0,0|0,0,2]=4 9824 B12R1.25 C#CCNc1cccc(c1O)F 34a_100011934987_100000184674 [0,2,0,0,0,0|0,0,2]=4 9825 B12R1.25 C#CCSc1cccc(c1O)Br 62a_100000038162_100010084509 [0,2,0,0,0,0|0,0,2]=4 9826 B12R1.25 C#CCSc1cccc(c1O)C 62a_100000038162_100009817157 [0,2,0,0,0,0|0,0,2]=4 9827 B12R1.25 C#CCSc1cccc(c1O)Cl 62a_100000038162_100010202889 [0,2,0,0,0,0|0,0,2]=4 9828 B12R1.25 C#CCSc1cccc(c1O)F 62a_100000038162_100009813666 [0,2,0,0,0,0|0,0,2]=4 9829 B12R1.25 C#CCSc1cccc(c1O)N 62a_100000038162_100010084371 [0,2,0,0,0,0|0,0,2]=4 9830 B12R1.25 C#CCSc1cccc(c1O)O 62a_100000038162_100009815950 [0,2,0,0,0,0|0,0,2]=4 9831 B12R1.25 C=CCNc1cccc(c1O)Br 34a_100011934915_100015514636 [0,2,0,0,0,0|0,0,2]=4 9832 B12R1.25 C=CCNc1cccc(c1O)C 34a_100000756359_100015514636 [0,2,0,0,0,0|0,0,2]=4 9833 B12R1.25 C=CCNc1cccc(c1O)Cl 34a_100000754742_100015514636 [0,2,0,0,0,0|0,0,2]=4 9834 B12R1.25 C=CCNc1cccc(c1O)F 34a_100011934987_100015514636 [0,2,0,0,0,0|0,0,2]=4 9835 B12R1.25 C=CCSc1cccc(c1O)Br 62a_100000210623_100010084509 [0,2,0,0,0,0|0,0,2]=4 9836 B12R1.25 C=CCSc1cccc(c1O)Br 62a_100010084509_100000210623 [0,2,0,0,0,0|0,0,2]=4 9837 B12R1.25 C=CCSc1cccc(c1O)C 62a_100000210623_100009817157 [0,2,0,0,0,0|0,0,2]=4 9838 B12R1.25 C=CCSc1cccc(c1O)C 62a_100009817157_100000210623 [0,2,0,0,0,0|0,0,2]=4 9839 B12R1.25 C=CCSc1cccc(c1O)Cl 62a_100000210623_100010202889 [0,2,0,0,0,0|0,0,2]=4 9840 B12R1.25 C=CCSc1cccc(c1O)Cl 62a_100010202889_100000210623 [0,2,0,0,0,0|0,0,2]=4 9841 B12R1.25 C=CCSc1cccc(c1O)F 62a_100000210623_100009813666 [0,2,0,0,0,0|0,0,2]=4 9842 B12R1.25 C=CCSc1cccc(c1O)F 62a_100009813666_100000210623 [0,2,0,0,0,0|0,0,2]=4 9843 B12R1.25 C=CCSc1cccc(c1O)N 62a_100000210623_100010084371 [0,2,0,0,0,0|0,0,2]=4 9844 B12R1.25 C=CCSc1cccc(c1O)N 62a_100011934915_100000210623 [0,2,0,0,0,0|0,0,2]=4 9845 B12R1.25 C=CCSc1cccc(c1O)O 62a_100000210623_100009815950 [0,2,0,0,0,0|0,0,2]=4 9846 B12R1.25 CCCCc1cccc(=O)n1C 271570a_100020621405_100000726605 [0,2,0,0,0,0|2,0,0]=4 9847 B12R1.25 CCCCc1cccc(c1Br)O 271570a_100020621405_100010187914 [0,2,0,0,0,0|1,0,0]=3 9848 B12R1.25 CCCCc1cccc(c1C)Br 271570a_100020621405_100012353703 [0,2,0,0,0,0|1,0,0]=3 9849 B12R1.25 CCCCc1cccc(c1C)C 271570a_100020621405_100011214922 [0,2,0,0,0,0|1,0,0]=3 9850 B12R1.25 CCCCc1cccc(c1C)Cl 271570a_100020621405_100000726075 [0,2,0,0,0,0|1,0,0]=3 9851 B12R1.25 CCCCc1cccc(c1C)F 271570a_100020621405_100011216893 [0,2,0,0,0,0|1,0,0]=3 9852 B12R1.25 CCCCc1cccc(c1C)N 271570a_100020621405_100000761887 [0,2,0,0,0,0|1,0,0]=3 9853 B12R1.25 CCCCc1cccc(c1C)O 271570a_100020621405_100012002258 [0,2,0,0,0,0|1,0,0]=3 9854 B12R1.25 CCCCc1cccc(c1Cl)Br 271570a_100020621405_100010142854 [0,2,0,0,0,0|1,0,0]=3 9855 B12R1.25 CCCCc1cccc(c1Cl)C 271570a_100020621405_200012352035 [0,2,0,0,0,0|1,0,0]=3 9856 B12R1.25 CCCCc1cccc(c1Cl)Cl 271570a_100020621405_100011215384 [0,2,0,0,0,0|1,0,0]=3 9857 B12R1.25 CCCCc1cccc(c1Cl)F 271570a_100020621405_200010234923 [0,2,0,0,0,0|1,0,0]=3 9858 B12R1.25 CCCCc1cccc(c1Cl)O 271570a_100020621405_100000049636 [0,2,0,0,0,0|1,0,0]=3 9859 B12R1.25 CCCCc1cccc(c1F)Br 271570a_100020621405_100000702267 [0,2,0,0,0,0|1,0,0]=3 9860 B12R1.25 CCCCc1cccc(c1F)C 271570a_100020621405_100000717567 [0,2,0,0,0,0|1,0,0]=3 9861 B12R1.25 CCCCc1cccc(c1F)Cl 271570a_100020621405_100011217346 [0,2,0,0,0,0|1,0,0]=3 9862 B12R1.25 CCCCc1cccc(c1F)F 271570a_100020621405_100000694657 [0,2,0,0,0,0|1,0,0]=3 9863 B12R1.25 CCCCc1cccc(c1F)N 271570a_100020621405_100011935091 [0,2,0,0,0,0|1,0,0]=3 9864 B12R1.25 CCCCc1cccc(c1F)O 271570a_100020621405_100009817021 [0,2,0,0,0,0|1,0,0]=3 9865 B12R1.25 CCCCc1cccc(c1N)Br 271570a_100020621405_100010146558 [0,2,0,0,0,0|1,0,0]=3 9866 B12R1.25 CCCCc1cccc(c1N)C 271570a_100020621405_100011834072 [0,2,0,0,0,0|1,0,0]=3 9867 B12R1.25 CCCCc1cccc(c1N)Cl 271570a_100020621405_100010190421 [0,2,0,0,0,0|1,0,0]=3 9868 B12R1.25 CCCCc1cccc(c1N)F 271570a_100020621405_100000042321 [0,2,0,0,0,0|1,0,0]=3 9869 B12R1.25 CCCCc1cccc(c1N)N 271570a_100020621405_100015191791 [0,2,0,0,0,0|1,0,0]=3 9870 B12R1.25 CCCCc1cccc(c1N)O 271570a_100020621405_100011934926 [0,2,0,0,0,0|1,0,0]=3 9871 B12R1.25 CCCCc1cccc(c1O)Br 271570a_100020621405_100010084509 [0,2,0,0,0,0|0,0,0]=2 9872 B12R1.25 CCCCc1cccc(c1O)C 271570a_100020621405_100009817157 [0,2,0,0,0,0|0,0,0]=2 9873 B12R1.25 CCCCc1cccc(c1O)Cl 271570a_100020621405_100010202889 [0,2,0,0,0,0|0,0,0]=2 9874 B12R1.25 CCCCc1cccc(c1O)F 271570a_100020621405_100009813666 [0,2,0,0,0,0|0,0,0]=2 9875 B12R1.25 CCCCc1cccc(c1O)N 271570a_100020621405_100011934915 [0,2,0,0,0,0|0,0,0]=2 9876 B12R1.25 CCCCc1cccc(c1O)O 271570a_100020621405_100009815950 [0,2,0,0,0,0|0,0,0]=2 9877 B12R1.25 CCCCc1cccn(c1=O)C 271570a_100020621405_100000687173 [0,2,0,0,0,0|1,0,1]=4 9878 B12R1.25 CCCCc1ccnc(c1C)C 271570a_100020621405_100009846815 [0,2,0,0,0,0|2,0,0]=4 9879 B12R1.25 CCCCc1ccnc(c1C)Cl 271570a_100020621405_100000047055 [0,2,0,0,0,0|2,0,0]=4 9880 B12R1.25 CCCCc1ccnc(c1C)F 271570a_100020621405_100010006593 [0,2,0,0,0,0|2,0,0]=4 9881 B12R1.25 CCCCc1ccnc(c1C)N 271570a_100020621405_100009865460 [0,2,0,0,0,0|2,0,0]=4 9882 B12R1.25 CCCCc1ccnc(c1C)O 271570a_100020621405_100009858498 [0,2,0,0,0,0|2,0,0]=4 9883 B12R1.25 CCCCc1ccnc(c1Cl)C 271570a_100020621405_100000698670 [0,2,0,0,0,0|2,0,0]=4 9884 B12R1.25 CCCCc1ccnc(c1Cl)Cl 271570a_100020621405_100010246212 [0,2,0,0,0,0|2,0,0]=4 9885 B12R1.25 CCCCc1ccnc(c1Cl)F 271570a_100020621405_100010067886 [0,2,0,0,0,0|2,0,0]=4 9886 B12R1.25 CCCCc1ccnc(c1Cl)N 271570a_100020621405_100010735111 [0,2,0,0,0,0|2,0,0]=4 9887 B12R1.25 CCCCc1ccnc(c1F)Br 271570a_100020621405_200015269031 [0,2,0,0,0,0|2,0,0]=4 9888 B12R1.25 CCCCc1ccnc(c1F)C 271570a_100020621405_100009849794 [0,2,0,0,0,0|2,0,0]=4 9889 B12R1.25 CCCCc1ccnc(c1F)Cl 271570a_100020621405_100010150473 [0,2,0,0,0,0|2,0,0]=4 9890 B12R1.25 CCCCc1ccnc(c1F)F 271570a_100020621405_100010214882 [0,2,0,0,0,0|2,0,0]=4 9891 B12R1.25 CCCCc1ccnc(c1F)N 271570a_100020621405_100010077785 [0,2,0,0,0,0|2,0,0]=4 9892 B12R1.25 CCCCc1ccnc(c1N)C 271570a_100020621405_100009885578 [0,2,0,0,0,0|2,0,0]=4 9893 B12R1.25 CCCCc1ccnc(c1N)N 271570a_100020621405_100000124095 [0,2,0,0,0,0|2,0,0]=4 9894 B12R1.25 CCCCc1cncc(c1C)Br 271570a_100020621405_100010109657 [0,2,0,0,0,0|2,0,0]=4 9895 B12R1.25 CCCCc1cncc(c1C)C 271570a_100020621405_100009864703 [0,2,0,0,0,0|2,0,0]=4 9896 B12R1.25 CCCCc1cncc(c1C)F 271570a_100020621405_100009881546 [0,2,0,0,0,0|2,0,0]=4 9897 B12R1.25 CCCCc1cncc(c1C)N 271570a_100020621405_100011998293 [0,2,0,0,0,0|2,0,0]=4 9898 B12R1.25 CCCCc1cncc(c1N)Br 271570a_100020621405_100011290786 [0,2,0,0,0,0|2,0,0]=4 9899 B12R1.25 CCCCc1cncc(c1N)C 271570a_100020621405_100009818025 [0,2,0,0,0,0|2,0,0]=4 9900 B12R1.25 CCCCc1cncc(c1N)Cl 271570a_100020621405_100000684942 [0,2,0,0,0,0|2,0,0]=4 9901 B12R1.25 CCCCc1cncc(c1N)F 271570a_100020621405_100009880649 [0,2,0,0,0,0|2,0,0]=4 9902 B12R1.25 CCCCc1cncc(c1N)N 271570a_100020621405_100000694774 [0,2,0,0,0,0|2,0,0]=4 9903 B12R1.25 CCCCc1nccc(c1C)C 271570a_100020621405_100009847204 [0,2,0,0,0,0|2,0,0]=4 9904 B12R1.25 CCCCc1nccc(c1C)F 271570a_100020621405_100009846374 [0,2,0,0,0,0|2,0,0]=4 9905 B12R1.25 CCCCc1nccc(c1C)N 271570a_100020621405_100009980296 [0,2,0,0,0,0|2,0,0]=4 9906 B12R1.25 CCCCc1nccc(c1F)C 271570a_100020621405_100009817629 [0,2,0,0,0,0|2,0,0]=4 9907 B12R1.25 CCCCc1nccc(c1F)N 271570a_100020621405_100015205195 [0,2,0,0,0,0|2,0,0]=4 9908 B12R1.25 CCCCc1nccc(c1F)O 271570a_100020621405_100009876375 [0,2,0,0,0,0|2,0,0]=4 9909 B12R1.25 CCCCc1nccc(c1N)C 271570a_100020621405_100000763560 [0,2,0,0,0,0|2,0,0]=4 9910 B12R1.25 CCCCc1nccc(c1N)N 271570a_100020621405_100000085203 [0,2,0,0,0,0|2,0,0]=4 9911 B12R1.25 CCCCc1nccc(c1N)O 271570a_100020621405_100000128729 [0,2,0,0,0,0|2,0,0]=4 9912 B12R1.25 CCCCc1nccc(c1O)C 271570a_100020621405_100000696282 [0,2,0,0,0,0|1,0,0]=3 9913 B12R1.25 CCCCc1nccc(c1O)F 271570a_100020621405_100009867227 [0,2,0,0,0,0|1,0,0]=3 9914 B12R1.25 CCCNc1cccc(c1Br)C 34a_100000684715_100000210303 [0,2,0,0,0,0|1,0,0]=3 9915 B12R1.25 CCCNc1cccc(c1Br)Cl 34a_100000687072_100000210303 [0,2,0,0,0,0|1,0,0]=3 9916 B12R1.25 CCCNc1cccc(c1Br)F 34a_100011934729_100000210303 [0,2,0,0,0,0|1,0,0]=3 9917 B12R1.25 CCCNc1cccc(c1Br)O 34a_100012183704_100000210303 [0,2,0,0,0,0|1,0,0]=3 9918 B12R1.25 CCCNc1cccc(c1Br)O 7a_100012183704_100000210303 [0,2,0,0,0,0|1,0,0]=3 9919 B12R1.25 CCCNc1cccc(c1C)Br 34a_100000750434_100000210303 [0,2,0,0,0,0|1,0,0]=3 9920 B12R1.25 CCCNc1cccc(c1C)C 2230a_100000210026_100000210303 [0,2,0,0,0,0|1,0,0]=3 9921 B12R1.25 CCCNc1cccc(c1C)C 34a_100000210026_100000210303 [0,2,0,0,0,0|1,0,0]=3 9922 B12R1.25 CCCNc1cccc(c1C)C 7a_100000210026_100000210303 [0,2,0,0,0,0|1,0,0]=3 9923 B12R1.25 CCCNc1cccc(c1C)Cl 2230a_100000210441_100000210303 [0,2,0,0,0,0|1,0,0]=3 9924 B12R1.25 CCCNc1cccc(c1C)Cl 34a_100000210441_100000210303 [0,2,0,0,0,0|1,0,0]=3 9925 B12R1.25 CCCNc1cccc(c1C)Cl 7a_100000210441_100000210303 [0,2,0,0,0,0|1,0,0]=3 9926 B12R1.25 CCCNc1cccc(c1C)F 34a_100000745574_100000210303 [0,2,0,0,0,0|1,0,0]=3 9927 B12R1.25 CCCNc1cccc(c1C)F 7a_100000745574_100000210303 [0,2,0,0,0,0|1,0,0]=3 9928 B12R1.25 CCCNc1cccc(c1C)I 34a_100000761887_100000210303 [0,2,0,0,0,0|1,0,0]=3 9929 B12R1.25 CCCNc1cccc(c1C)O 34a_100011216573_100000210303 [0,2,0,0,0,0|1,0,0]=3 9930 B12R1.25 CCCNc1cccc(c1C)O 7a_100011216573_100000210303 [0,2,0,0,0,0|1,0,0]=3 9931 B12R1.25 CCCNc1cccc(c1Cl)Br 34a_100000687075_100000210303 [0,2,0,0,0,0|1,0,0]=3 9932 B12R1.25 CCCNc1cccc(c1Cl)C 34a_100000765562_100000210303 [0,2,0,0,0,0|1,0,0]=3 9933 B12R1.25 CCCNc1cccc(c1Cl)C 7a_100000765562_100000210303 [0,2,0,0,0,0|1,0,0]=3 9934 B12R1.25 CCCNc1cccc(c1Cl)Cl 34a_100000185733_100000210303 [0,2,0,0,0,0|1,0,0]=3 9935 B12R1.25 CCCNc1cccc(c1Cl)F 34a_100000692321_100000210303 [0,2,0,0,0,0|1,0,0]=3 9936 B12R1.25 CCCNc1cccc(c1Cl)O 34a_100012002038_100000210303 [0,2,0,0,0,0|1,0,0]=3 9937 B12R1.25 CCCNc1cccc(c1Cl)O 7a_100012002038_100000210303 [0,2,0,0,0,0|1,0,0]=3 9938 B12R1.25 CCCNc1cccc(c1F)Br 2230a_100011935091_100000210303 [0,2,0,0,0,0|1,0,0]=3 9939 B12R1.25 CCCNc1cccc(c1F)Br 34a_100011935091_100000210303 [0,2,0,0,0,0|1,0,0]=3 9940 B12R1.25 CCCNc1cccc(c1F)C 2230a_100000697159_100000210303 [0,2,0,0,0,0|1,0,0]=3 9941 B12R1.25 CCCNc1cccc(c1F)C 34a_100000697159_100000210303 [0,2,0,0,0,0|1,0,0]=3 9942 B12R1.25 CCCNc1cccc(c1F)C 7a_100000697159_100000210303 [0,2,0,0,0,0|1,0,0]=3 9943 B12R1.25 CCCNc1cccc(c1F)Cl 2230a_100000199060_100000210303 [0,2,0,0,0,0|1,0,0]=3 9944 B12R1.25 CCCNc1cccc(c1F)Cl 34a_100000199060_100000210303 [0,2,0,0,0,0|1,0,0]=3 9945 B12R1.25 CCCNc1cccc(c1F)F 34a_100000743855_100000210303 [0,2,0,0,0,0|1,0,0]=3 9946 B12R1.25 CCCNc1cccc(c1I)Br 34a_100020590159_100000210303 [0,2,0,0,0,0|1,0,0]=3 9947 B12R1.25 CCCNc1cccc(c1I)C 34a_100000761888_100000210303 [0,2,0,0,0,0|1,0,0]=3 9948 B12R1.25 CCCNc1cccc(c1I)Cl 34a_100000049713_100000210303 [0,2,0,0,0,0|1,0,0]=3 9949 B12R1.25 CCCNc1cccc(c1I)F 34a_100000690935_100000210303 [0,2,0,0,0,0|1,0,0]=3 9950 B12R1.25 CCCNc1cccc(c1O)Br 34a_100011934915_100000210303 [0,2,0,0,0,0|0,0,0]=2 9951 B12R1.25 CCCNc1cccc(c1O)C 34a_100000756359_100000210303 [0,2,0,0,0,0|0,0,0]=2 9952 B12R1.25 CCCNc1cccc(c1O)Cl 34a_100000754742_100000210303 [0,2,0,0,0,0|0,0,0]=2 9953 B12R1.25 CCCNc1cccc(c1O)F 34a_100011934987_100000210303 [0,2,0,0,0,0|0,0,0]=2 9954 B12R1.25 CCCOc1cccc(c1Br)Br 34a_100010187966_100000210303 [0,2,0,0,0,0|1,0,0]=3 9955 B12R1.25 CCCOc1cccc(c1Br)Br 7a_100010187966_100000210303 [0,2,0,0,0,0|1,0,0]=3 9956 B12R1.25 CCCOc1cccc(c1Br)C 34a_100000686692_100000210303 [0,2,0,0,0,0|1,0,0]=3 9957 B12R1.25 CCCOc1cccc(c1Br)C 7a_100000686692_100000210303 [0,2,0,0,0,0|1,0,0]=3 9958 B12R1.25 CCCOc1cccc(c1Br)Cl 34a_100012348804_100000210303 [0,2,0,0,0,0|1,0,0]=3 9959 B12R1.25 CCCOc1cccc(c1Br)Cl 7a_100012348804_100000210303 [0,2,0,0,0,0|1,0,0]=3 9960 B12R1.25 CCCOc1cccc(c1Br)F 34a_100009820682_100000210303 [0,2,0,0,0,0|1,0,0]=3 9961 B12R1.25 CCCOc1cccc(c1Br)F 7a_100009820682_100000210303 [0,2,0,0,0,0|1,0,0]=3 9962 B12R1.25 CCCOc1cccc(c1Br)I 34a_100010187914_100000210303 [0,2,0,0,0,0|1,0,0]=3 9963 B12R1.25 CCCOc1cccc(c1Br)I 7a_100010187914_100000210303 [0,2,0,0,0,0|1,0,0]=3 9964 B12R1.25 CCCOc1cccc(c1Br)N 34a_100012183704_100000210303 [0,2,0,0,0,0|1,0,0]=3 9965 B12R1.25 CCCOc1cccc(c1Br)N 7a_100012183704_100000210303 [0,2,0,0,0,0|1,0,0]=3 9966 B12R1.25 CCCOc1cccc(c1C)Br 34a_100012002258_100000210303 [0,2,0,0,0,0|1,0,0]=3 9967 B12R1.25 CCCOc1cccc(c1C)Br 7a_100012002258_100000210303 [0,2,0,0,0,0|1,0,0]=3 9968 B12R1.25 CCCOc1cccc(c1C)C 34a_100000185855_100000210303 [0,2,0,0,0,0|1,0,0]=3 9969 B12R1.25 CCCOc1cccc(c1C)C 7a_100000185855_100000210303 [0,2,0,0,0,0|1,0,0]=3 9970 B12R1.25 CCCOc1cccc(c1C)Cl 34a_100011265684_100000210303 [0,2,0,0,0,0|1,0,0]=3 9971 B12R1.25 CCCOc1cccc(c1C)Cl 7a_100011265684_100000210303 [0,2,0,0,0,0|1,0,0]=3 9972 B12R1.25 CCCOc1cccc(c1C)F 34a_100011217231_100000210303 [0,2,0,0,0,0|1,0,0]=3 9973 B12R1.25 CCCOc1cccc(c1C)F 7a_100011217231_100000210303 [0,2,0,0,0,0|1,0,0]=3 9974 B12R1.25 CCCOc1cccc(c1C)N 34a_100011216573_100000210303 [0,2,0,0,0,0|1,0,0]=3 9975 B12R1.25 CCCOc1cccc(c1C)N 7a_100011216573_100000210303 [0,2,0,0,0,0|1,0,0]=3 9976 B12R1.25 CCCOc1cccc(c1Cl)Br 34a_100010187913_100000210303 [0,2,0,0,0,0|1,0,0]=3 9977 B12R1.25 CCCOc1cccc(c1Cl)Br 7a_100010187913_100000210303 [0,2,0,0,0,0|1,0,0]=3 9978 B12R1.25 CCCOc1cccc(c1Cl)C 34a_100000695629_100000210303 [0,2,0,0,0,0|1,0,0]=3 9979 B12R1.25 CCCOc1cccc(c1Cl)C 7a_100000695629_100000210303 [0,2,0,0,0,0|1,0,0]=3 9980 B12R1.25 CCCOc1cccc(c1Cl)Cl 34a_100000211076_100000210303 [0,2,0,0,0,0|1,0,0]=3 9981 B12R1.25 CCCOc1cccc(c1Cl)Cl 7a_100000211076_100000210303 [0,2,0,0,0,0|1,0,0]=3 9982 B12R1.25 CCCOc1cccc(c1Cl)F 34a_100000087408_100000210303 [0,2,0,0,0,0|1,0,0]=3 9983 B12R1.25 CCCOc1cccc(c1Cl)F 7a_100000087408_100000210303 [0,2,0,0,0,0|1,0,0]=3 9984 B12R1.25 CCCOc1cccc(c1Cl)I 34a_100000049636_100000210303 [0,2,0,0,0,0|1,0,0]=3 9985 B12R1.25 CCCOc1cccc(c1Cl)I 7a_100000049636_100000210303 [0,2,0,0,0,0|1,0,0]=3 9986 B12R1.25 CCCOc1cccc(c1Cl)N 34a_100012002038_100000210303 [0,2,0,0,0,0|1,0,0]=3 9987 B12R1.25 CCCOc1cccc(c1Cl)N 7a_100012002038_100000210303 [0,2,0,0,0,0|1,0,0]=3 9988 B12R1.25 CCCOc1cccc(c1F)Br 34a_100009817021_100000210303 [0,2,0,0,0,0|1,0,0]=3 9989 B12R1.25 CCCOc1cccc(c1F)Br 7a_100009817021_100000210303 [0,2,0,0,0,0|1,0,0]=3 9990 B12R1.25 CCCOc1cccc(c1F)C 34a_100000751311_100000210303 [0,2,0,0,0,0|1,0,0]=3 9991 B12R1.25 CCCOc1cccc(c1F)C 7a_100000751311_100000210303 [0,2,0,0,0,0|1,0,0]=3 9992 B12R1.25 CCCOc1cccc(c1F)Cl 34a_100000687438_100000210303 [0,2,0,0,0,0|1,0,0]=3 9993 B12R1.25 CCCOc1cccc(c1F)Cl 7a_100000687438_100000210303 [0,2,0,0,0,0|1,0,0]=3 9994 B12R1.25 CCCOc1cccc(c1F)F 34a_100000751161_100000210303 [0,2,0,0,0,0|1,0,0]=3 9995 B12R1.25 CCCOc1cccc(c1F)F 7a_100000751161_100000210303 [0,2,0,0,0,0|1,0,0]=3 9996 B12R1.25 CCCOc1cccc(c1I)Br 34a_100010187912_100000210303 [0,2,0,0,0,0|1,0,0]=3 9997 B12R1.25 CCCOc1cccc(c1I)Br 7a_100010187912_100000210303 [0,2,0,0,0,0|1,0,0]=3 9998 B12R1.25 CCCOc1cccc(c1I)C 34a_100010083724_100000210303 [0,2,0,0,0,0|1,0,0]=3 9999 B12R1.25 CCCOc1cccc(c1I)C 7a_100010083724_100000210303 [0,2,0,0,0,0|1,0,0]=3 10000 B12R1.25 CCCOc1cccc(c1I)Cl 34a_100000050174_100000210303 [0,2,0,0,0,0|1,0,0]=3 10001 B12R1.25 CCCOc1cccc(c1I)Cl 7a_100000050174_100000210303 [0,2,0,0,0,0|1,0,0]=3 10002 B12R1.25 CCCOc1cccc(c1I)F 34a_100000690913_100000210303 [0,2,0,0,0,0|1,0,0]=3 10003 B12R1.25 CCCOc1cccc(c1I)F 7a_100000690913_100000210303 [0,2,0,0,0,0|1,0,0]=3 10004 B12R1.25 CCCOc1cccc(c1N)Br 34a_100011934926_100000210303 [0,2,0,0,0,0|1,0,0]=3 10005 B12R1.25 CCCOc1cccc(c1N)Br 7a_100011934926_100000210303 [0,2,0,0,0,0|1,0,0]=3 10006 B12R1.25 CCCOc1cccc(c1N)C 34a_100000743429_100000210303 [0,2,0,0,0,0|1,0,0]=3 10007 B12R1.25 CCCOc1cccc(c1N)C 7a_100000743429_100000210303 [0,2,0,0,0,0|1,0,0]=3 10008 B12R1.25 CCCOc1cccc(c1N)Cl 34a_100012022510_100000210303 [0,2,0,0,0,0|1,0,0]=3 10009 B12R1.25 CCCOc1cccc(c1N)Cl 7a_100012022510_100000210303 [0,2,0,0,0,0|1,0,0]=3 10010 B12R1.25 CCCOc1cccc(c1N)F 34a_100020591140_100000210303 [0,2,0,0,0,0|1,0,0]=3 10011 B12R1.25 CCCOc1cccc(c1N)F 7a_100020591140_100000210303 [0,2,0,0,0,0|1,0,0]=3 10012 B12R1.25 CCCOc1cccc(c1N)I 34a_200000049512_100000210303 [0,2,0,0,0,0|1,0,0]=3 10013 B12R1.25 CCCOc1cccc(c1N)I 7a_200000049512_100000210303 [0,2,0,0,0,0|1,0,0]=3 10014 B12R1.25 CCCOc1cccc(c1N)N 34a_100000033209_100000210303 [0,2,0,0,0,0|1,0,0]=3 10015 B12R1.25 CCCOc1cccn(c1=O)C 34a_100000117616_100000210303 [0,2,0,0,0,0|1,0,1]=4 10016 B12R1.25 CCCOc1cccn(c1=O)C 7a_100000117616_100000210303 [0,2,0,0,0,0|1,0,1]=4 10017 B12R1.25 CCCOc1ccnc(c1Br)Cl 34a_100010136240_100000210303 [0,2,0,0,0,0|2,0,0]=4 10018 B12R1.25 CCCOc1ccnc(c1Cl)Cl 34a_100009860235_100000210303 [0,2,0,0,0,0|2,0,0]=4 10019 B12R1.25 CCCOc1ccnc(c1F)Br 34a_100009876375_100000210303 [0,2,0,0,0,0|2,0,0]=4 10020 B12R1.25 CCCOc1ccnc(c1F)Cl 34a_100009856406_100000210303 [0,2,0,0,0,0|2,0,0]=4 10021 B12R1.25 CCCOc1ccnc(c1N)Cl 34a_100000128729_100000210303 [0,2,0,0,0,0|2,0,0]=4 10022 B12R1.25 CCCOc1nccc(c1Br)C 34a_100012000493_100000210303 [0,2,0,0,0,0|2,0,0]=4 10023 B12R1.25 CCCOc1nccc(c1C)Br 34a_100009858498_100000210303 [0,2,0,0,0,0|2,0,0]=4 10024 B12R1.25 CCCOc1nccc(c1Cl)N 34a_200000093555_100000210303 [0,2,0,0,0,0|2,0,0]=4 10025 B12R1.25 CCCSc1cccc(=O)n1C 62a_100000210303_100000726605 [0,2,0,0,0,0|2,0,0]=4 10026 B12R1.25 CCCSc1cccc(=O)n1C 62a_100000726605_100000210303 [0,2,0,0,0,0|2,0,0]=4 10027 B12R1.25 CCCSc1cccc(c1Br)Br 62a_100000210303_100010175083 [0,2,0,0,0,0|1,0,0]=3 10028 B12R1.25 CCCSc1cccc(c1Br)Br 62a_100010175083_100000210303 [0,2,0,0,0,0|1,0,0]=3 10029 B12R1.25 CCCSc1cccc(c1Br)C 62a_100000210303_100012362457 [0,2,0,0,0,0|1,0,0]=3 10030 B12R1.25 CCCSc1cccc(c1Br)C 62a_100012362457_100000210303 [0,2,0,0,0,0|1,0,0]=3 10031 B12R1.25 CCCSc1cccc(c1Br)Cl 62a_100000210303_100014021842 [0,2,0,0,0,0|1,0,0]=3 10032 B12R1.25 CCCSc1cccc(c1Br)Cl 62a_100014021842_100000210303 [0,2,0,0,0,0|1,0,0]=3 10033 B12R1.25 CCCSc1cccc(c1Br)F 62a_100000210303_100010202630 [0,2,0,0,0,0|1,0,0]=3 10034 B12R1.25 CCCSc1cccc(c1Br)F 62a_100010202630_100000210303 [0,2,0,0,0,0|1,0,0]=3 10035 B12R1.25 CCCSc1cccc(c1Br)O 62a_100000210303_100010187914 [0,2,0,0,0,0|1,0,0]=3 10036 B12R1.25 CCCSc1cccc(c1Br)O 62a_100010187914_100000210303 [0,2,0,0,0,0|1,0,0]=3 10037 B12R1.25 CCCSc1cccc(c1C)Br 62a_100000210303_100012353703 [0,2,0,0,0,0|1,0,0]=3 10038 B12R1.25 CCCSc1cccc(c1C)Br 62a_100012353703_100000210303 [0,2,0,0,0,0|1,0,0]=3 10039 B12R1.25 CCCSc1cccc(c1C)C 62a_100000210303_100011214922 [0,2,0,0,0,0|1,0,0]=3 10040 B12R1.25 CCCSc1cccc(c1C)C 62a_100011214922_100000210303 [0,2,0,0,0,0|1,0,0]=3 10041 B12R1.25 CCCSc1cccc(c1C)Cl 62a_100000210303_100000726075 [0,2,0,0,0,0|1,0,0]=3 10042 B12R1.25 CCCSc1cccc(c1C)Cl 62a_100000726075_100000210303 [0,2,0,0,0,0|1,0,0]=3 10043 B12R1.25 CCCSc1cccc(c1C)F 62a_100000210303_100011216893 [0,2,0,0,0,0|1,0,0]=3 10044 B12R1.25 CCCSc1cccc(c1C)F 62a_100011216893_100000210303 [0,2,0,0,0,0|1,0,0]=3 10045 B12R1.25 CCCSc1cccc(c1C)N 62a_100000210303_100000761887 [0,2,0,0,0,0|1,0,0]=3 10046 B12R1.25 CCCSc1cccc(c1C)N 62a_100000761887_100000210303 [0,2,0,0,0,0|1,0,0]=3 10047 B12R1.25 CCCSc1cccc(c1C)O 62a_100000210303_100012002258 [0,2,0,0,0,0|1,0,0]=3 10048 B12R1.25 CCCSc1cccc(c1C)O 62a_100012002258_100000210303 [0,2,0,0,0,0|1,0,0]=3 10049 B12R1.25 CCCSc1cccc(c1Cl)Br 62a_100000210303_100010142854 [0,2,0,0,0,0|1,0,0]=3 10050 B12R1.25 CCCSc1cccc(c1Cl)Br 62a_100010142854_100000210303 [0,2,0,0,0,0|1,0,0]=3 10051 B12R1.25 CCCSc1cccc(c1Cl)C 62a_100000210303_200012352035 [0,2,0,0,0,0|1,0,0]=3 10052 B12R1.25 CCCSc1cccc(c1Cl)C 62a_200012352035_100000210303 [0,2,0,0,0,0|1,0,0]=3 10053 B12R1.25 CCCSc1cccc(c1Cl)Cl 62a_100000210303_100011215384 [0,2,0,0,0,0|1,0,0]=3 10054 B12R1.25 CCCSc1cccc(c1Cl)Cl 62a_100011215384_100000210303 [0,2,0,0,0,0|1,0,0]=3 10055 B12R1.25 CCCSc1cccc(c1Cl)F 62a_100000210303_200010234923 [0,2,0,0,0,0|1,0,0]=3 10056 B12R1.25 CCCSc1cccc(c1Cl)F 62a_200010234923_100000210303 [0,2,0,0,0,0|1,0,0]=3 10057 B12R1.25 CCCSc1cccc(c1Cl)O 62a_100000210303_100000049636 [0,2,0,0,0,0|1,0,0]=3 10058 B12R1.25 CCCSc1cccc(c1F)Br 62a_100000210303_100000702267 [0,2,0,0,0,0|1,0,0]=3 10059 B12R1.25 CCCSc1cccc(c1F)Br 62a_100000702267_100000210303 [0,2,0,0,0,0|1,0,0]=3 10060 B12R1.25 CCCSc1cccc(c1F)C 62a_100000210303_100000717567 [0,2,0,0,0,0|1,0,0]=3 10061 B12R1.25 CCCSc1cccc(c1F)C 62a_100000717567_100000210303 [0,2,0,0,0,0|1,0,0]=3 10062 B12R1.25 CCCSc1cccc(c1F)Cl 62a_100000210303_100011217346 [0,2,0,0,0,0|1,0,0]=3 10063 B12R1.25 CCCSc1cccc(c1F)Cl 62a_100011217346_100000210303 [0,2,0,0,0,0|1,0,0]=3 10064 B12R1.25 CCCSc1cccc(c1F)F 62a_100000210303_100000694657 [0,2,0,0,0,0|1,0,0]=3 10065 B12R1.25 CCCSc1cccc(c1F)F 62a_100000694657_100000210303 [0,2,0,0,0,0|1,0,0]=3 10066 B12R1.25 CCCSc1cccc(c1F)N 62a_100000210303_100011935091 [0,2,0,0,0,0|1,0,0]=3 10067 B12R1.25 CCCSc1cccc(c1F)N 62a_100011935091_100000210303 [0,2,0,0,0,0|1,0,0]=3 10068 B12R1.25 CCCSc1cccc(c1F)O 62a_100000210303_100009817021 [0,2,0,0,0,0|1,0,0]=3 10069 B12R1.25 CCCSc1cccc(c1F)O 62a_100009817021_100000210303 [0,2,0,0,0,0|1,0,0]=3 10070 B12R1.25 CCCSc1cccc(c1N)Br 62a_100000210303_100010146558 [0,2,0,0,0,0|1,0,0]=3 10071 B12R1.25 CCCSc1cccc(c1N)Br 62a_100010146558_100000210303 [0,2,0,0,0,0|1,0,0]=3 10072 B12R1.25 CCCSc1cccc(c1N)C 62a_100000210303_100011834072 [0,2,0,0,0,0|1,0,0]=3 10073 B12R1.25 CCCSc1cccc(c1N)C 62a_100011834072_100000210303 [0,2,0,0,0,0|1,0,0]=3 10074 B12R1.25 CCCSc1cccc(c1N)Cl 62a_100000210303_100010190421 [0,2,0,0,0,0|1,0,0]=3 10075 B12R1.25 CCCSc1cccc(c1N)Cl 62a_100010190421_100000210303 [0,2,0,0,0,0|1,0,0]=3 10076 B12R1.25 CCCSc1cccc(c1N)F 62a_100000042321_100000210303 [0,2,0,0,0,0|1,0,0]=3 10077 B12R1.25 CCCSc1cccc(c1N)F 62a_100000210303_100000042321 [0,2,0,0,0,0|1,0,0]=3 10078 B12R1.25 CCCSc1cccc(c1N)N 62a_100015191791_100000210303 [0,2,0,0,0,0|1,0,0]=3 10079 B12R1.25 CCCSc1cccc(c1N)O 62a_100000210303_100011934926 [0,2,0,0,0,0|1,0,0]=3 10080 B12R1.25 CCCSc1cccc(c1O)Br 62a_100000210303_100010084509 [0,2,0,0,0,0|0,0,0]=2 10081 B12R1.25 CCCSc1cccc(c1O)Br 62a_100010084509_100000210303 [0,2,0,0,0,0|0,0,0]=2 10082 B12R1.25 CCCSc1cccc(c1O)C 62a_100000210303_100009817157 [0,2,0,0,0,0|0,0,0]=2 10083 B12R1.25 CCCSc1cccc(c1O)C 62a_100009817157_100000210303 [0,2,0,0,0,0|0,0,0]=2 10084 B12R1.25 CCCSc1cccc(c1O)Cl 62a_100000210303_100010202889 [0,2,0,0,0,0|0,0,0]=2 10085 B12R1.25 CCCSc1cccc(c1O)Cl 62a_100010202889_100000210303 [0,2,0,0,0,0|0,0,0]=2 10086 B12R1.25 CCCSc1cccc(c1O)F 62a_100000210303_100009813666 [0,2,0,0,0,0|0,0,0]=2 10087 B12R1.25 CCCSc1cccc(c1O)F 62a_100009813666_100000210303 [0,2,0,0,0,0|0,0,0]=2 10088 B12R1.25 CCCSc1cccc(c1O)N 62a_100000210303_100010084371 [0,2,0,0,0,0|0,0,0]=2 10089 B12R1.25 CCCSc1cccc(c1O)N 62a_100011934915_100000210303 [0,2,0,0,0,0|0,0,0]=2 10090 B12R1.25 CCCSc1cccc(c1O)O 62a_100000210303_100009815950 [0,2,0,0,0,0|0,0,0]=2 10091 B12R1.25 CCCSc1cccn(c1=O)C 62a_100000210303_100000687173 [0,2,0,0,0,0|1,0,1]=4 10092 B12R1.25 CCCSc1cccn(c1=O)C 62a_100000687173_100000210303 [0,2,0,0,0,0|1,0,1]=4 10093 B12R1.25 CCCSc1ccnc(c1Br)F 62a_100000210303_100010006599 [0,2,0,0,0,0|2,0,0]=4 10094 B12R1.25 CCCSc1ccnc(c1Br)F 62a_100010006599_100000210303 [0,2,0,0,0,0|2,0,0]=4 10095 B12R1.25 CCCSc1ccnc(c1C)C 62a_100000210303_100009846815 [0,2,0,0,0,0|2,0,0]=4 10096 B12R1.25 CCCSc1ccnc(c1C)C 62a_100009846815_100000210303 [0,2,0,0,0,0|2,0,0]=4 10097 B12R1.25 CCCSc1ccnc(c1C)Cl 62a_100000047055_100000210303 [0,2,0,0,0,0|2,0,0]=4 10098 B12R1.25 CCCSc1ccnc(c1C)Cl 62a_100000210303_100000047055 [0,2,0,0,0,0|2,0,0]=4 10099 B12R1.25 CCCSc1ccnc(c1C)F 62a_100000210303_100010006593 [0,2,0,0,0,0|2,0,0]=4 10100 B12R1.25 CCCSc1ccnc(c1C)F 62a_100010006593_100000210303 [0,2,0,0,0,0|2,0,0]=4 10101 B12R1.25 CCCSc1ccnc(c1C)N 62a_100000210303_100009865460 [0,2,0,0,0,0|2,0,0]=4 10102 B12R1.25 CCCSc1ccnc(c1C)N 62a_100009865460_100000210303 [0,2,0,0,0,0|2,0,0]=4 10103 B12R1.25 CCCSc1ccnc(c1C)O 62a_100000210303_100009858498 [0,2,0,0,0,0|2,0,0]=4 10104 B12R1.25 CCCSc1ccnc(c1C)O 62a_100009858498_100000210303 [0,2,0,0,0,0|2,0,0]=4 10105 B12R1.25 CCCSc1ccnc(c1Cl)C 62a_100000210303_100000698670 [0,2,0,0,0,0|2,0,0]=4 10106 B12R1.25 CCCSc1ccnc(c1Cl)C 62a_100000698670_100000210303 [0,2,0,0,0,0|2,0,0]=4 10107 B12R1.25 CCCSc1ccnc(c1Cl)Cl 62a_100000210303_100010246212 [0,2,0,0,0,0|2,0,0]=4 10108 B12R1.25 CCCSc1ccnc(c1Cl)Cl 62a_100010246212_100000210303 [0,2,0,0,0,0|2,0,0]=4 10109 B12R1.25 CCCSc1ccnc(c1Cl)F 62a_100000210303_100010067886 [0,2,0,0,0,0|2,0,0]=4 10110 B12R1.25 CCCSc1ccnc(c1Cl)F 62a_100010067886_100000210303 [0,2,0,0,0,0|2,0,0]=4 10111 B12R1.25 CCCSc1ccnc(c1Cl)N 62a_100000210303_100010735111 [0,2,0,0,0,0|2,0,0]=4 10112 B12R1.25 CCCSc1ccnc(c1Cl)N 62a_100010735111_100000210303 [0,2,0,0,0,0|2,0,0]=4 10113 B12R1.25 CCCSc1ccnc(c1F)Br 62a_100000210303_200015269031 [0,2,0,0,0,0|2,0,0]=4 10114 B12R1.25 CCCSc1ccnc(c1F)Br 62a_200015269031_100000210303 [0,2,0,0,0,0|2,0,0]=4 10115 B12R1.25 CCCSc1ccnc(c1F)C 62a_100000210303_100009849794 [0,2,0,0,0,0|2,0,0]=4 10116 B12R1.25 CCCSc1ccnc(c1F)C 62a_100009849794_100000210303 [0,2,0,0,0,0|2,0,0]=4 10117 B12R1.25 CCCSc1ccnc(c1F)Cl 62a_100000210303_100010150473 [0,2,0,0,0,0|2,0,0]=4 10118 B12R1.25 CCCSc1ccnc(c1F)Cl 62a_100010150473_100000210303 [0,2,0,0,0,0|2,0,0]=4 10119 B12R1.25 CCCSc1ccnc(c1F)F 62a_100000210303_100010214882 [0,2,0,0,0,0|2,0,0]=4 10120 B12R1.25 CCCSc1ccnc(c1F)F 62a_100010214882_100000210303 [0,2,0,0,0,0|2,0,0]=4 10121 B12R1.25 CCCSc1ccnc(c1F)N 62a_100000210303_100010077785 [0,2,0,0,0,0|2,0,0]=4 10122 B12R1.25 CCCSc1ccnc(c1F)N 62a_100010077785_100000210303 [0,2,0,0,0,0|2,0,0]=4 10123 B12R1.25 CCCSc1ccnc(c1N)C 62a_100000210303_100009885578 [0,2,0,0,0,0|2,0,0]=4 10124 B12R1.25 CCCSc1ccnc(c1N)C 62a_100009885578_100000210303 [0,2,0,0,0,0|2,0,0]=4 10125 B12R1.25 CCCSc1ccnc(c1N)N 62a_100000124095_100000210303 [0,2,0,0,0,0|2,0,0]=4 10126 B12R1.25 CCCSc1ccnc(c1O)Cl 62a_100000210303_100010067911 [0,2,0,0,0,0|1,0,0]=3 10127 B12R1.25 CCCSc1cncc(c1C)Br 62a_100000210303_100010109657 [0,2,0,0,0,0|2,0,0]=4 10128 B12R1.25 CCCSc1cncc(c1C)Br 62a_100010109657_100000210303 [0,2,0,0,0,0|2,0,0]=4 10129 B12R1.25 CCCSc1cncc(c1C)C 62a_100000210303_100009864703 [0,2,0,0,0,0|2,0,0]=4 10130 B12R1.25 CCCSc1cncc(c1C)C 62a_100009864703_100000210303 [0,2,0,0,0,0|2,0,0]=4 10131 B12R1.25 CCCSc1cncc(c1C)F 62a_100000210303_100009881546 [0,2,0,0,0,0|2,0,0]=4 10132 B12R1.25 CCCSc1cncc(c1C)F 62a_100009881546_100000210303 [0,2,0,0,0,0|2,0,0]=4 10133 B12R1.25 CCCSc1cncc(c1C)N 62a_100000210303_100011998293 [0,2,0,0,0,0|2,0,0]=4 10134 B12R1.25 CCCSc1cncc(c1C)N 62a_100011998293_100000210303 [0,2,0,0,0,0|2,0,0]=4 10135 B12R1.25 CCCSc1cncc(c1N)Br 62a_100000210303_100011290786 [0,2,0,0,0,0|2,0,0]=4 10136 B12R1.25 CCCSc1cncc(c1N)Br 62a_100011290786_100000210303 [0,2,0,0,0,0|2,0,0]=4 10137 B12R1.25 CCCSc1cncc(c1N)C 62a_100000210303_100009818025 [0,2,0,0,0,0|2,0,0]=4 10138 B12R1.25 CCCSc1cncc(c1N)C 62a_100009818025_100000210303 [0,2,0,0,0,0|2,0,0]=4 10139 B12R1.25 CCCSc1cncc(c1N)Cl 62a_100000210303_100000684942 [0,2,0,0,0,0|2,0,0]=4 10140 B12R1.25 CCCSc1cncc(c1N)Cl 62a_100000684942_100000210303 [0,2,0,0,0,0|2,0,0]=4 10141 B12R1.25 CCCSc1cncc(c1N)F 62a_100000210303_100009880649 [0,2,0,0,0,0|2,0,0]=4 10142 B12R1.25 CCCSc1cncc(c1N)F 62a_100009880649_100000210303 [0,2,0,0,0,0|2,0,0]=4 10143 B12R1.25 CCCSc1cncc(c1N)N 62a_100000210303_100000694774 [0,2,0,0,0,0|2,0,0]=4 10144 B12R1.25 CCCSc1cncc(c1N)N 62a_100000694774_100000210303 [0,2,0,0,0,0|2,0,0]=4 10145 B12R1.25 CCCSc1cncc(c1O)N 62a_100000210303_100000694263 [0,2,0,0,0,0|1,0,0]=3 10146 B12R1.25 CCCSc1cncc(c1O)N 62a_100000694263_100000210303 [0,2,0,0,0,0|1,0,0]=3 10147 B12R1.25 CCCSc1nccc(c1C)C 62a_100000210303_100009847204 [0,2,0,0,0,0|2,0,0]=4 10148 B12R1.25 CCCSc1nccc(c1C)C 62a_100009847204_100000210303 [0,2,0,0,0,0|2,0,0]=4 10149 B12R1.25 CCCSc1nccc(c1C)F 62a_100000210303_100009846374 [0,2,0,0,0,0|2,0,0]=4 10150 B12R1.25 CCCSc1nccc(c1C)F 62a_100009846374_100000210303 [0,2,0,0,0,0|2,0,0]=4 10151 B12R1.25 CCCSc1nccc(c1C)N 62a_100000210303_100000690622 [0,2,0,0,0,0|2,0,0]=4 10152 B12R1.25 CCCSc1nccc(c1C)N 62a_100000690622_100000210303 [0,2,0,0,0,0|2,0,0]=4 10153 B12R1.25 CCCSc1nccc(c1F)C 62a_100000210303_100009817629 [0,2,0,0,0,0|2,0,0]=4 10154 B12R1.25 CCCSc1nccc(c1F)C 62a_100009817629_100000210303 [0,2,0,0,0,0|2,0,0]=4 10155 B12R1.25 CCCSc1nccc(c1F)N 62a_100000210303_100015205195 [0,2,0,0,0,0|2,0,0]=4 10156 B12R1.25 CCCSc1nccc(c1F)N 62a_100015205195_100000210303 [0,2,0,0,0,0|2,0,0]=4 10157 B12R1.25 CCCSc1nccc(c1F)O 62a_100000210303_100009876375 [0,2,0,0,0,0|2,0,0]=4 10158 B12R1.25 CCCSc1nccc(c1F)O 62a_100009876375_100000210303 [0,2,0,0,0,0|2,0,0]=4 10159 B12R1.25 CCCSc1nccc(c1N)C 62a_100000210303_100000763560 [0,2,0,0,0,0|2,0,0]=4 10160 B12R1.25 CCCSc1nccc(c1N)C 62a_100000763560_100000210303 [0,2,0,0,0,0|2,0,0]=4 10161 B12R1.25 CCCSc1nccc(c1N)N 62a_100000085203_100000210303 [0,2,0,0,0,0|2,0,0]=4 10162 B12R1.25 CCCSc1nccc(c1N)N 62a_100000210303_100000085203 [0,2,0,0,0,0|2,0,0]=4 10163 B12R1.25 CCCSc1nccc(c1O)C 62a_100000210303_100000696282 [0,2,0,0,0,0|1,0,0]=3 10164 B12R1.25 CCCSc1nccc(c1O)F 62a_100000210303_100009867227 [0,2,0,0,0,0|1,0,0]=3 10165 B12R1.25 CCCSc1nccc(c1O)N 62a_100000210303_100009844647 [0,2,0,0,0,0|1,0,0]=3 10166 B12R1.25 CCCSc1ncnc(c1O)N 62a_100000210303_100000124137 [0,2,0,0,0,0|2,0,0]=4 10167 B12R1.25 CCNCc1cccc(c1Br)Br 207a_100015525214_100010240334 [0,2,0,0,0,0|1,0,0]=3 10168 B12R1.25 CCNCc1cccc(c1Br)Br 270004a_100015525214_100010240334 [0,2,0,0,0,0|1,0,0]=3 10169 B12R1.25 CCNCc1cccc(c1Br)C 207a_100015525214_100012186367 [0,2,0,0,0,0|1,0,0]=3 10170 B12R1.25 CCNCc1cccc(c1Br)C 2230a_100015525214_200012349612 [0,2,0,0,0,0|1,0,0]=3 10171 B12R1.25 CCNCc1cccc(c1Br)C 270004a_100015525214_100012186367 [0,2,0,0,0,0|1,0,0]=3 10172 B12R1.25 CCNCc1cccc(c1Br)Cl 207a_100015525214_100010232083 [0,2,0,0,0,0|1,0,0]=3 10173 B12R1.25 CCNCc1cccc(c1Br)Cl 2230a_100015525214_100010145525 [0,2,0,0,0,0|1,0,0]=3 10174 B12R1.25 CCNCc1cccc(c1Br)Cl 270004a_100015525214_100010232083 [0,2,0,0,0,0|1,0,0]=3 10175 B12R1.25 CCNCc1cccc(c1Br)F 207a_100015525214_100011934749 [0,2,0,0,0,0|1,0,0]=3 10176 B12R1.25 CCNCc1cccc(c1Br)F 2230a_100015525214_100012351116 [0,2,0,0,0,0|1,0,0]=3 10177 B12R1.25 CCNCc1cccc(c1Br)F 2230a_100020638964_100000210202 [0,2,0,0,0,0|1,0,0]=3 10178 B12R1.25 CCNCc1cccc(c1Br)F 270004a_100015525214_100011934749 [0,2,0,0,0,0|1,0,0]=3 10179 B12R1.25 CCNCc1cccc(c1Br)F 34a_100020638964_100000210202 [0,2,0,0,0,0|1,0,0]=3 10180 B12R1.25 CCNCc1cccc(c1Br)I 2230a_100015525214_100010254545 [0,2,0,0,0,0|1,0,0]=3 10181 B12R1.25 CCNCc1cccc(c1C)Br 207a_100015525214_100012179384 [0,2,0,0,0,0|1,0,0]=3 10182 B12R1.25 CCNCc1cccc(c1C)Br 2230a_100015525214_100000694682 [0,2,0,0,0,0|1,0,0]=3 10183 B12R1.25 CCNCc1cccc(c1C)Br 270004a_100015525214_100012179384 [0,2,0,0,0,0|1,0,0]=3 10184 B12R1.25 CCNCc1cccc(c1C)Br 34a_100000724210_100000210202 [0,2,0,0,0,0|1,0,0]=3 10185 B12R1.25 CCNCc1cccc(c1C)C 207a_100015525214_100000229941 [0,2,0,0,0,0|1,0,0]=3 10186 B12R1.25 CCNCc1cccc(c1C)C 2230a_100011211637_100000210202 [0,2,0,0,0,0|1,0,0]=3 10187 B12R1.25 CCNCc1cccc(c1C)C 2230a_100015525214_100011515928 [0,2,0,0,0,0|1,0,0]=3 10188 B12R1.25 CCNCc1cccc(c1C)C 270004a_100015525214_100000229941 [0,2,0,0,0,0|1,0,0]=3 10189 B12R1.25 CCNCc1cccc(c1C)C 34a_100011211637_100000210202 [0,2,0,0,0,0|1,0,0]=3 10190 B12R1.25 CCNCc1cccc(c1C)Cl 207a_100015525214_100012002129 [0,2,0,0,0,0|1,0,0]=3 10191 B12R1.25 CCNCc1cccc(c1C)Cl 2230a_100015525214_100012186920 [0,2,0,0,0,0|1,0,0]=3 10192 B12R1.25 CCNCc1cccc(c1C)Cl 2230a_100020639605_100000210202 [0,2,0,0,0,0|1,0,0]=3 10193 B12R1.25 CCNCc1cccc(c1C)Cl 270004a_100015525214_100012002129 [0,2,0,0,0,0|1,0,0]=3 10194 B12R1.25 CCNCc1cccc(c1C)Cl 34a_100020639605_100000210202 [0,2,0,0,0,0|1,0,0]=3 10195 B12R1.25 CCNCc1cccc(c1C)F 207a_100015525214_100000037668 [0,2,0,0,0,0|1,0,0]=3 10196 B12R1.25 CCNCc1cccc(c1C)F 2230a_100015525214_100009813626 [0,2,0,0,0,0|1,0,0]=3 10197 B12R1.25 CCNCc1cccc(c1C)F 2230a_100132306986_100000210202 [0,2,0,0,0,0|1,0,0]=3 10198 B12R1.25 CCNCc1cccc(c1C)F 270004a_100015525214_100000037668 [0,2,0,0,0,0|1,0,0]=3 10199 B12R1.25 CCNCc1cccc(c1C)F 34a_100132306986_100000210202 [0,2,0,0,0,0|1,0,0]=3 10200 B12R1.25 CCNCc1cccc(c1C)I 2230a_100015525214_100010150147 [0,2,0,0,0,0|1,0,0]=3 10201 B12R1.25 CCNCc1cccc(c1C)O 270004a_100015525214_100009868165 [0,2,0,0,0,0|1,0,0]=3 10202 B12R1.25 CCNCc1cccc(c1Cl)Br 207a_100015525214_100012362481 [0,2,0,0,0,0|1,0,0]=3 10203 B12R1.25 CCNCc1cccc(c1Cl)Br 2230a_100015525214_100012349491 [0,2,0,0,0,0|1,0,0]=3 10204 B12R1.25 CCNCc1cccc(c1Cl)Br 270004a_100015525214_100012362481 [0,2,0,0,0,0|1,0,0]=3 10205 B12R1.25 CCNCc1cccc(c1Cl)C 207a_100015525214_100012017286 [0,2,0,0,0,0|1,0,0]=3 10206 B12R1.25 CCNCc1cccc(c1Cl)C 2230a_100025705714_100000210202 [0,2,0,0,0,0|1,0,0]=3 10207 B12R1.25 CCNCc1cccc(c1Cl)C 270004a_100015525214_100012017286 [0,2,0,0,0,0|1,0,0]=3 10208 B12R1.25 CCNCc1cccc(c1Cl)C 34a_100025705714_100000210202 [0,2,0,0,0,0|1,0,0]=3 10209 B12R1.25 CCNCc1cccc(c1Cl)Cl 207a_100015525214_100000210504 [0,2,0,0,0,0|1,0,0]=3 10210 B12R1.25 CCNCc1cccc(c1Cl)Cl 2230a_100011211633_100000210202 [0,2,0,0,0,0|1,0,0]=3 10211 B12R1.25 CCNCc1cccc(c1Cl)Cl 2230a_100015525214_100000723366 [0,2,0,0,0,0|1,0,0]=3 10212 B12R1.25 CCNCc1cccc(c1Cl)Cl 270004a_100015525214_100000210504 [0,2,0,0,0,0|1,0,0]=3 10213 B12R1.25 CCNCc1cccc(c1Cl)Cl 34a_100011211633_100000210202 [0,2,0,0,0,0|1,0,0]=3 10214 B12R1.25 CCNCc1cccc(c1Cl)F 207a_100015525214_100011998484 [0,2,0,0,0,0|1,0,0]=3 10215 B12R1.25 CCNCc1cccc(c1Cl)F 2230a_100012001614_100000210202 [0,2,0,0,0,0|1,0,0]=3 10216 B12R1.25 CCNCc1cccc(c1Cl)F 2230a_100015525214_100000696688 [0,2,0,0,0,0|1,0,0]=3 10217 B12R1.25 CCNCc1cccc(c1Cl)F 270004a_100015525214_100011998484 [0,2,0,0,0,0|1,0,0]=3 10218 B12R1.25 CCNCc1cccc(c1Cl)F 34a_100012001614_100000210202 [0,2,0,0,0,0|1,0,0]=3 10219 B12R1.25 CCNCc1cccc(c1Cl)O 270004a_100015525214_100000050521 [0,2,0,0,0,0|1,0,0]=3 10220 B12R1.25 CCNCc1cccc(c1F)Br 207a_100015525214_100011361543 [0,2,0,0,0,0|1,0,0]=3 10221 B12R1.25 CCNCc1cccc(c1F)Br 2230a_100015189953_100000210202 [0,2,0,0,0,0|1,0,0]=3 10222 B12R1.25 CCNCc1cccc(c1F)Br 2230a_100015525214_100012356506 [0,2,0,0,0,0|1,0,0]=3 10223 B12R1.25 CCNCc1cccc(c1F)Br 270004a_100015525214_100011361543 [0,2,0,0,0,0|1,0,0]=3 10224 B12R1.25 CCNCc1cccc(c1F)Br 34a_100015189953_100000210202 [0,2,0,0,0,0|1,0,0]=3 10225 B12R1.25 CCNCc1cccc(c1F)C 207a_100015525214_100011219516 [0,2,0,0,0,0|1,0,0]=3 10226 B12R1.25 CCNCc1cccc(c1F)C 2230a_100012002060_100000210202 [0,2,0,0,0,0|1,0,0]=3 10227 B12R1.25 CCNCc1cccc(c1F)C 2230a_100015525214_100011216058 [0,2,0,0,0,0|1,0,0]=3 10228 B12R1.25 CCNCc1cccc(c1F)C 270004a_100015525214_100011219516 [0,2,0,0,0,0|1,0,0]=3 10229 B12R1.25 CCNCc1cccc(c1F)C 34a_100012002060_100000210202 [0,2,0,0,0,0|1,0,0]=3 10230 B12R1.25 CCNCc1cccc(c1F)Cl 207a_100015525214_100000766533 [0,2,0,0,0,0|1,0,0]=3 10231 B12R1.25 CCNCc1cccc(c1F)Cl 2230a_100000764326_100000210202 [0,2,0,0,0,0|1,0,0]=3 10232 B12R1.25 CCNCc1cccc(c1F)Cl 2230a_100015525214_100000716733 [0,2,0,0,0,0|1,0,0]=3 10233 B12R1.25 CCNCc1cccc(c1F)Cl 270004a_100015525214_100000766533 [0,2,0,0,0,0|1,0,0]=3 10234 B12R1.25 CCNCc1cccc(c1F)Cl 34a_100000764326_100000210202 [0,2,0,0,0,0|1,0,0]=3 10235 B12R1.25 CCNCc1cccc(c1F)F 207a_100015525214_100000753312 [0,2,0,0,0,0|1,0,0]=3 10236 B12R1.25 CCNCc1cccc(c1F)F 2230a_100011199105_100000210202 [0,2,0,0,0,0|1,0,0]=3 10237 B12R1.25 CCNCc1cccc(c1F)F 2230a_100015525214_100000217499 [0,2,0,0,0,0|1,0,0]=3 10238 B12R1.25 CCNCc1cccc(c1F)F 270004a_100015525214_100000753312 [0,2,0,0,0,0|1,0,0]=3 10239 B12R1.25 CCNCc1cccc(c1F)F 34a_100011199105_100000210202 [0,2,0,0,0,0|1,0,0]=3 10240 B12R1.25 CCNCc1cccc(c1F)I 207a_100015525214_100010202174 [0,2,0,0,0,0|1,0,0]=3 10241 B12R1.25 CCNCc1cccc(c1F)I 270004a_100015525214_100010202174 [0,2,0,0,0,0|1,0,0]=3 10242 B12R1.25 CCNCc1cccc(c1F)O 34a_100025773512_100000210202 [0,2,0,0,0,0|1,0,0]=3 10243 B12R1.25 CCNCc1cccc(c1I)F 207a_100015525214_100010186293 [0,2,0,0,0,0|1,0,0]=3 10244 B12R1.25 CCNCc1cccc(c1I)F 2230a_100015525214_100010149603 [0,2,0,0,0,0|1,0,0]=3 10245 B12R1.25 CCNCc1cccc(c1I)F 270004a_100015525214_100010186293 [0,2,0,0,0,0|1,0,0]=3 10246 B12R1.25 CCNCc1cccc(c1O)C 34a_100020639391_100000210202 [0,2,0,0,0,0|0,0,0]=2 10247 B12R1.25 CCNCc1cccn(c1=O)C 207a_100015525214_100010354164 [0,2,0,0,0,0|1,0,1]=4 10248 B12R1.25 CCNCc1cccn(c1=O)C 270004a_100015525214_100010354164 [0,2,0,0,0,0|1,0,1]=4 10249 B12R1.25 CCNCc1ccnc(c1Br)Cl 207a_100015525214_200010064870 [0,2,0,0,0,0|2,0,0]=4 10250 B12R1.25 CCNCc1ccnc(c1C)Cl 207a_100015525214_100000096011 [0,2,0,0,0,0|2,0,0]=4 10251 B12R1.25 CCNCc1ccnc(c1C)Cl 270004a_100015525214_100000096011 [0,2,0,0,0,0|2,0,0]=4 10252 B12R1.25 CCNCc1ccnc(c1Cl)Br 270004a_100015525214_100010171661 [0,2,0,0,0,0|2,0,0]=4 10253 B12R1.25 CCNCc1ccnc(c1Cl)F 270004a_100015525214_100009856171 [0,2,0,0,0,0|2,0,0]=4 10254 B12R1.25 CCNCc1cncc(c1C)Br 207a_100015525214_100010214934 [0,2,0,0,0,0|2,0,0]=4 10255 B12R1.25 CCNCc1cncc(c1C)Br 270004a_100015525214_100010214934 [0,2,0,0,0,0|2,0,0]=4 10256 B12R1.25 CCNCc1cncc(c1Cl)Br 207a_100015525214_100010173560 [0,2,0,0,0,0|2,0,0]=4 10257 B12R1.25 CCNCc1nccc(c1C)Cl 2230a_100015525214_100020614443 [0,2,0,0,0,0|2,0,0]=4 10258 B12R1.25 CCNCc1nccc(c1F)Br 270004a_100015525214_100015713984 [0,2,0,0,0,0|2,0,0]=4 10259 B12R1.25 CCOCc1cccc(c1Br)C 34a_100011659289_100000210202 [0,2,0,0,0,0|1,0,0]=3 10260 B12R1.25 CCOCc1cccc(c1Br)C 34a_100121572206_200012349612 [0,2,0,0,0,0|1,0,0]=3 10261 B12R1.25 CCOCc1cccc(c1Br)C 7a_100011659289_100000210202 [0,2,0,0,0,0|1,0,0]=3 10262 B12R1.25 CCOCc1cccc(c1Br)Cl 34a_100010168166_100000210202 [0,2,0,0,0,0|1,0,0]=3 10263 B12R1.25 CCOCc1cccc(c1Br)Cl 34a_100121572206_100010145525 [0,2,0,0,0,0|1,0,0]=3 10264 B12R1.25 CCOCc1cccc(c1Br)Cl 7a_100010168166_100000210202 [0,2,0,0,0,0|1,0,0]=3 10265 B12R1.25 CCOCc1cccc(c1Br)F 34a_100012351117_100000210202 [0,2,0,0,0,0|1,0,0]=3 10266 B12R1.25 CCOCc1cccc(c1Br)F 34a_100121572206_100012351116 [0,2,0,0,0,0|1,0,0]=3 10267 B12R1.25 CCOCc1cccc(c1Br)F 7a_100012351117_100000210202 [0,2,0,0,0,0|1,0,0]=3 10268 B12R1.25 CCOCc1cccc(c1Br)I 34a_100010240205_100000210202 [0,2,0,0,0,0|1,0,0]=3 10269 B12R1.25 CCOCc1cccc(c1Br)I 34a_100121572206_100010254545 [0,2,0,0,0,0|1,0,0]=3 10270 B12R1.25 CCOCc1cccc(c1Br)I 7a_100010240205_100000210202 [0,2,0,0,0,0|1,0,0]=3 10271 B12R1.25 CCOCc1cccc(c1C)Br 34a_100000694458_100000210202 [0,2,0,0,0,0|1,0,0]=3 10272 B12R1.25 CCOCc1cccc(c1C)Br 34a_100121572206_100000694682 [0,2,0,0,0,0|1,0,0]=3 10273 B12R1.25 CCOCc1cccc(c1C)Br 7a_100000694458_100000210202 [0,2,0,0,0,0|1,0,0]=3 10274 B12R1.25 CCOCc1cccc(c1C)C 34a_100011219135_100000210202 [0,2,0,0,0,0|1,0,0]=3 10275 B12R1.25 CCOCc1cccc(c1C)C 34a_100121572206_100011273979 [0,2,0,0,0,0|1,0,0]=3 10276 B12R1.25 CCOCc1cccc(c1C)C 7a_100011219135_100000210202 [0,2,0,0,0,0|1,0,0]=3 10277 B12R1.25 CCOCc1cccc(c1C)Cl 34a_100012000165_100000210202 [0,2,0,0,0,0|1,0,0]=3 10278 B12R1.25 CCOCc1cccc(c1C)Cl 34a_100121572206_100012186920 [0,2,0,0,0,0|1,0,0]=3 10279 B12R1.25 CCOCc1cccc(c1C)Cl 7a_100012000165_100000210202 [0,2,0,0,0,0|1,0,0]=3 10280 B12R1.25 CCOCc1cccc(c1C)F 34a_100000042775_100000210202 [0,2,0,0,0,0|1,0,0]=3 10281 B12R1.25 CCOCc1cccc(c1C)F 34a_100121572206_100009813626 [0,2,0,0,0,0|1,0,0]=3 10282 B12R1.25 CCOCc1cccc(c1C)F 7a_100000042775_100000210202 [0,2,0,0,0,0|1,0,0]=3 10283 B12R1.25 CCOCc1cccc(c1C)I 34a_100010150139_100000210202 [0,2,0,0,0,0|1,0,0]=3 10284 B12R1.25 CCOCc1cccc(c1C)I 34a_100121572206_100010150147 [0,2,0,0,0,0|1,0,0]=3 10285 B12R1.25 CCOCc1cccc(c1C)I 7a_100010150139_100000210202 [0,2,0,0,0,0|1,0,0]=3 10286 B12R1.25 CCOCc1cccc(c1C)N 34a_102495339961_100000210202 [0,2,0,0,0,0|1,0,0]=3 10287 B12R1.25 CCOCc1cccc(c1C)N 7a_102495339961_100000210202 [0,2,0,0,0,0|1,0,0]=3 10288 B12R1.25 CCOCc1cccc(c1Cl)Br 34a_100012351182_100000210202 [0,2,0,0,0,0|1,0,0]=3 10289 B12R1.25 CCOCc1cccc(c1Cl)Br 34a_100121572206_100012349491 [0,2,0,0,0,0|1,0,0]=3 10290 B12R1.25 CCOCc1cccc(c1Cl)Br 7a_100012351182_100000210202 [0,2,0,0,0,0|1,0,0]=3 10291 B12R1.25 CCOCc1cccc(c1Cl)C 34a_100000710031_100000210202 [0,2,0,0,0,0|1,0,0]=3 10292 B12R1.25 CCOCc1cccc(c1Cl)C 7a_100000710031_100000210202 [0,2,0,0,0,0|1,0,0]=3 10293 B12R1.25 CCOCc1cccc(c1Cl)Cl 34a_100000720469_100000210202 [0,2,0,0,0,0|1,0,0]=3 10294 B12R1.25 CCOCc1cccc(c1Cl)Cl 34a_100121572206_100000723366 [0,2,0,0,0,0|1,0,0]=3 10295 B12R1.25 CCOCc1cccc(c1Cl)Cl 7a_100000720469_100000210202 [0,2,0,0,0,0|1,0,0]=3 10296 B12R1.25 CCOCc1cccc(c1Cl)F 34a_100000696319_100000210202 [0,2,0,0,0,0|1,0,0]=3 10297 B12R1.25 CCOCc1cccc(c1Cl)F 34a_100121572206_100000696688 [0,2,0,0,0,0|1,0,0]=3 10298 B12R1.25 CCOCc1cccc(c1Cl)F 7a_100000696319_100000210202 [0,2,0,0,0,0|1,0,0]=3 10299 B12R1.25 CCOCc1cccc(c1F)Br 34a_100011935076_100000210202 [0,2,0,0,0,0|1,0,0]=3 10300 B12R1.25 CCOCc1cccc(c1F)Br 34a_100121572206_100012356506 [0,2,0,0,0,0|1,0,0]=3 10301 B12R1.25 CCOCc1cccc(c1F)Br 7a_100011935076_100000210202 [0,2,0,0,0,0|1,0,0]=3 10302 B12R1.25 CCOCc1cccc(c1F)C 34a_100121572206_100011216058 [0,2,0,0,0,0|1,0,0]=3 10303 B12R1.25 CCOCc1cccc(c1F)C 34a_200011219517_100000210202 [0,2,0,0,0,0|1,0,0]=3 10304 B12R1.25 CCOCc1cccc(c1F)C 7a_200011219517_100000210202 [0,2,0,0,0,0|1,0,0]=3 10305 B12R1.25 CCOCc1cccc(c1F)Cl 34a_100011216988_100000210202 [0,2,0,0,0,0|1,0,0]=3 10306 B12R1.25 CCOCc1cccc(c1F)Cl 34a_100121572206_100000716733 [0,2,0,0,0,0|1,0,0]=3 10307 B12R1.25 CCOCc1cccc(c1F)Cl 7a_100011216988_100000210202 [0,2,0,0,0,0|1,0,0]=3 10308 B12R1.25 CCOCc1cccc(c1F)F 34a_100011218644_100000210202 [0,2,0,0,0,0|1,0,0]=3 10309 B12R1.25 CCOCc1cccc(c1F)F 34a_100121572206_100000217499 [0,2,0,0,0,0|1,0,0]=3 10310 B12R1.25 CCOCc1cccc(c1F)F 7a_100011218644_100000210202 [0,2,0,0,0,0|1,0,0]=3 10311 B12R1.25 CCOCc1cccc(c1F)I 34a_200010235739_100000210202 [0,2,0,0,0,0|1,0,0]=3 10312 B12R1.25 CCOCc1cccc(c1F)I 7a_200010235739_100000210202 [0,2,0,0,0,0|1,0,0]=3 10313 B12R1.25 CCOCc1cccc(c1F)N 34a_100012023829_100000210202 [0,2,0,0,0,0|1,0,0]=3 10314 B12R1.25 CCOCc1cccc(c1I)Br 34a_100010146604_100000210202 [0,2,0,0,0,0|1,0,0]=3 10315 B12R1.25 CCOCc1cccc(c1I)Br 7a_100010146604_100000210202 [0,2,0,0,0,0|1,0,0]=3 10316 B12R1.25 CCOCc1cccc(c1I)C 34a_100012349780_100000210202 [0,2,0,0,0,0|1,0,0]=3 10317 B12R1.25 CCOCc1cccc(c1I)C 7a_100012349780_100000210202 [0,2,0,0,0,0|1,0,0]=3 10318 B12R1.25 CCOCc1cccc(c1I)F 34a_100000692438_100000210202 [0,2,0,0,0,0|1,0,0]=3 10319 B12R1.25 CCOCc1cccc(c1I)F 34a_100121572206_100010149603 [0,2,0,0,0,0|1,0,0]=3 10320 B12R1.25 CCOCc1cccc(c1I)F 7a_100000692438_100000210202 [0,2,0,0,0,0|1,0,0]=3 10321 B12R1.25 CCOCc1cccc(c1N)Br 34a_100012349457_100000210202 [0,2,0,0,0,0|1,0,0]=3 10322 B12R1.25 CCOCc1cccc(c1N)C 34a_100011215590_100000210202 [0,2,0,0,0,0|1,0,0]=3 10323 B12R1.25 CCOCc1cccc(c1N)Cl 34a_100012182729_100000210202 [0,2,0,0,0,0|1,0,0]=3 10324 B12R1.25 CCOCc1cccc(c1N)F 34a_100000692437_100000210202 [0,2,0,0,0,0|1,0,0]=3 10325 B12R1.25 CCOCc1ccnc(c1F)Br 34a_100010065242_100000210202 [0,2,0,0,0,0|2,0,0]=4 10326 B12R1.25 CCOCc1ccnc(c1F)Br 7a_100010065242_100000210202 [0,2,0,0,0,0|2,0,0]=4 10327 B12R1.25 CCOCc1ccnc(c1F)Cl 34a_100000101314_100000210202 [0,2,0,0,0,0|2,0,0]=4 10328 B12R1.25 CCOCc1ccnc(c1F)Cl 7a_100000101314_100000210202 [0,2,0,0,0,0|2,0,0]=4 10329 B12R1.25 CCOCc1nccc(c1C)Cl 34a_100121572206_100020614443 [0,2,0,0,0,0|2,0,0]=4 10330 B12R1.25 CCSCc1cccc(c1Br)C 62a_100000210202_200012349612 [0,2,0,0,0,0|1,0,0]=3 10331 B12R1.25 CCSCc1cccc(c1Br)C 62a_200012349612_100000210202 [0,2,0,0,0,0|1,0,0]=3 10332 B12R1.25 CCSCc1cccc(c1Br)Cl 62a_100000210202_100010145525 [0,2,0,0,0,0|1,0,0]=3 10333 B12R1.25 CCSCc1cccc(c1Br)Cl 62a_100010145525_100000210202 [0,2,0,0,0,0|1,0,0]=3 10334 B12R1.25 CCSCc1cccc(c1Br)F 62a_100000210202_100012351116 [0,2,0,0,0,0|1,0,0]=3 10335 B12R1.25 CCSCc1cccc(c1Br)F 62a_100012351116_100000210202 [0,2,0,0,0,0|1,0,0]=3 10336 B12R1.25 CCSCc1cccc(c1Br)I 62a_100000210202_100010254545 [0,2,0,0,0,0|1,0,0]=3 10337 B12R1.25 CCSCc1cccc(c1Br)I 62a_100010254545_100000210202 [0,2,0,0,0,0|1,0,0]=3 10338 B12R1.25 CCSCc1cccc(c1C)Br 62a_100000210202_100000694682 [0,2,0,0,0,0|1,0,0]=3 10339 B12R1.25 CCSCc1cccc(c1C)Br 62a_100000694682_100000210202 [0,2,0,0,0,0|1,0,0]=3 10340 B12R1.25 CCSCc1cccc(c1C)C 62a_100000210202_100011515928 [0,2,0,0,0,0|1,0,0]=3 10341 B12R1.25 CCSCc1cccc(c1C)C 62a_100011515928_100000210202 [0,2,0,0,0,0|1,0,0]=3 10342 B12R1.25 CCSCc1cccc(c1C)Cl 62a_100000210202_100012186920 [0,2,0,0,0,0|1,0,0]=3 10343 B12R1.25 CCSCc1cccc(c1C)Cl 62a_100012186920_100000210202 [0,2,0,0,0,0|1,0,0]=3 10344 B12R1.25 CCSCc1cccc(c1C)F 62a_100000210202_100009813626 [0,2,0,0,0,0|1,0,0]=3 10345 B12R1.25 CCSCc1cccc(c1C)F 62a_100009813626_100000210202 [0,2,0,0,0,0|1,0,0]=3 10346 B12R1.25 CCSCc1cccc(c1C)I 62a_100000210202_100010150147 [0,2,0,0,0,0|1,0,0]=3 10347 B12R1.25 CCSCc1cccc(c1C)I 62a_100010150147_100000210202 [0,2,0,0,0,0|1,0,0]=3 10348 B12R1.25 CCSCc1cccc(c1Cl)Br 62a_100000210202_100012349491 [0,2,0,0,0,0|1,0,0]=3 10349 B12R1.25 CCSCc1cccc(c1Cl)Br 62a_100012349491_100000210202 [0,2,0,0,0,0|1,0,0]=3 10350 B12R1.25 CCSCc1cccc(c1Cl)Cl 62a_100000210202_100000723366 [0,2,0,0,0,0|1,0,0]=3 10351 B12R1.25 CCSCc1cccc(c1Cl)Cl 62a_100000720918_100000210202 [0,2,0,0,0,0|1,0,0]=3 10352 B12R1.25 CCSCc1cccc(c1Cl)F 62a_100000210202_100000696688 [0,2,0,0,0,0|1,0,0]=3 10353 B12R1.25 CCSCc1cccc(c1Cl)F 62a_100000696688_100000210202 [0,2,0,0,0,0|1,0,0]=3 10354 B12R1.25 CCSCc1cccc(c1F)Br 62a_100000210202_100012356506 [0,2,0,0,0,0|1,0,0]=3 10355 B12R1.25 CCSCc1cccc(c1F)Br 62a_100012356506_100000210202 [0,2,0,0,0,0|1,0,0]=3 10356 B12R1.25 CCSCc1cccc(c1F)C 62a_100000210202_100011216058 [0,2,0,0,0,0|1,0,0]=3 10357 B12R1.25 CCSCc1cccc(c1F)C 62a_100011216058_100000210202 [0,2,0,0,0,0|1,0,0]=3 10358 B12R1.25 CCSCc1cccc(c1F)Cl 62a_100000210202_100000716733 [0,2,0,0,0,0|1,0,0]=3 10359 B12R1.25 CCSCc1cccc(c1F)Cl 62a_100000716733_100000210202 [0,2,0,0,0,0|1,0,0]=3 10360 B12R1.25 CCSCc1cccc(c1F)F 62a_100000210202_100000217499 [0,2,0,0,0,0|1,0,0]=3 10361 B12R1.25 CCSCc1cccc(c1F)F 62a_100000217499_100000210202 [0,2,0,0,0,0|1,0,0]=3 10362 B12R1.25 CCSCc1cccc(c1I)F 62a_100000210202_100010149603 [0,2,0,0,0,0|1,0,0]=3 10363 B12R1.25 CCSCc1cccc(c1I)F 62a_100010149603_100000210202 [0,2,0,0,0,0|1,0,0]=3 10364 B12R1.25 CCSCc1nccc(c1C)Cl 62a_100000210202_100020614443 [0,2,0,0,0,0|2,0,0]=4 10365 B12R1.25 CCSCc1nccc(c1C)Cl 62a_100020614443_100000210202 [0,2,0,0,0,0|2,0,0]=4 10366 B12R1.25 CNCCc1cccc(c1C)Br 2230a_100161000114_200000210301 [0,2,0,0,0,0|1,0,0]=3 10367 B12R1.25 CNCCc1cccc(c1C)Br 34a_100161000114_200000210301 [0,2,0,0,0,0|1,0,0]=3 10368 B12R1.25 CNCCc1cccc(c1Cl)Cl 2230a_100000741019_200000210301 [0,2,0,0,0,0|1,0,0]=3 10369 B12R1.25 CNCCc1cccc(c1Cl)Cl 2230a_106832991635_100000723033 [0,2,0,0,0,0|1,0,0]=3 10370 B12R1.25 CNCCc1cccc(c1Cl)Cl 34a_100000741019_200000210301 [0,2,0,0,0,0|1,0,0]=3 10371 B12R1.25 CNCCc1cccc(c1Cl)Cl 34a_100102657272_100000723033 [0,2,0,0,0,0|1,0,0]=3 10372 B12R1.25 CNCCc1cccc(c1Cl)Cl 7a_106832991635_100000723033 [0,2,0,0,0,0|1,0,0]=3 10373 B12R1.25 COCCc1cccc(c1Cl)Cl 34a_100011754357_200000210301 [0,2,0,0,0,0|1,0,0]=3 10374 B12R1.25 COCCc1cccc(c1Cl)Cl 34a_100138415774_100000723033 [0,2,0,0,0,0|1,0,0]=3 10375 B12R1.25 COCCc1cccc(c1Cl)Cl 7a_100011754357_200000210301 [0,2,0,0,0,0|1,0,0]=3 10376 B12R1.25 COCCc1cccc(c1F)Cl 34a_100011830271_200000210301 [0,2,0,0,0,0|1,0,0]=3 10377 B12R1.25 COCCc1cccc(c1F)Cl 7a_100011830271_200000210301 [0,2,0,0,0,0|1,0,0]=3 10378 B12R1.25 COCCc1cccc(c1F)F 34a_100000698707_200000210301 [0,2,0,0,0,0|1,0,0]=3 10379 B12R1.25 COCCc1cccc(c1F)F 7a_100000698707_200000210301 [0,2,0,0,0,0|1,0,0]=3 10380 B12R1.25 COCNc1cccc(c1C)C 2230a_100000210026_100000766300 [0,2,0,0,0,0|2,0,0]=4 10381 B12R1.25 COCNc1cccc(c1C)Cl 2230a_100000210441_100000766300 [0,2,0,0,0,0|2,0,0]=4 10382 B12R1.25 COCNc1cccc(c1F)Br 2230a_100011935091_100000766300 [0,2,0,0,0,0|2,0,0]=4 10383 B12R1.25 COCNc1cccc(c1F)C 2230a_100000697159_100000766300 [0,2,0,0,0,0|2,0,0]=4 10384 B12R1.25 COCNc1cccc(c1F)Cl 2230a_100000199060_100000766300 [0,2,0,0,0,0|2,0,0]=4 10385 B12R1.25 COCSc1cccc(c1Br)Br 62a_100000766300_100010175083 [0,2,0,0,0,0|2,0,0]=4 10386 B12R1.25 COCSc1cccc(c1Br)Br 62a_100010175083_100000766300 [0,2,0,0,0,0|2,0,0]=4 10387 B12R1.25 COCSc1cccc(c1Br)C 62a_100000766300_100012362457 [0,2,0,0,0,0|2,0,0]=4 10388 B12R1.25 COCSc1cccc(c1Br)C 62a_100012362457_100000766300 [0,2,0,0,0,0|2,0,0]=4 10389 B12R1.25 COCSc1cccc(c1Br)Cl 62a_100000766300_100014021842 [0,2,0,0,0,0|2,0,0]=4 10390 B12R1.25 COCSc1cccc(c1Br)Cl 62a_100014021842_100000766300 [0,2,0,0,0,0|2,0,0]=4 10391 B12R1.25 COCSc1cccc(c1Br)F 62a_100000766300_100010202630 [0,2,0,0,0,0|2,0,0]=4 10392 B12R1.25 COCSc1cccc(c1Br)F 62a_100010202630_100000766300 [0,2,0,0,0,0|2,0,0]=4 10393 B12R1.25 COCSc1cccc(c1Br)O 62a_100000766300_100010187914 [0,2,0,0,0,0|2,0,0]=4 10394 B12R1.25 COCSc1cccc(c1Br)O 62a_100010187914_100000766300 [0,2,0,0,0,0|2,0,0]=4 10395 B12R1.25 COCSc1cccc(c1C)Br 62a_100000766300_100012353703 [0,2,0,0,0,0|2,0,0]=4 10396 B12R1.25 COCSc1cccc(c1C)Br 62a_100012353703_100000766300 [0,2,0,0,0,0|2,0,0]=4 10397 B12R1.25 COCSc1cccc(c1C)C 62a_100000766300_100011214922 [0,2,0,0,0,0|2,0,0]=4 10398 B12R1.25 COCSc1cccc(c1C)C 62a_100011214922_100000766300 [0,2,0,0,0,0|2,0,0]=4 10399 B12R1.25 COCSc1cccc(c1C)Cl 62a_100000726075_100000766300 [0,2,0,0,0,0|2,0,0]=4 10400 B12R1.25 COCSc1cccc(c1C)Cl 62a_100000766300_100000726075 [0,2,0,0,0,0|2,0,0]=4 10401 B12R1.25 COCSc1cccc(c1C)F 62a_100000766300_100011216893 [0,2,0,0,0,0|2,0,0]=4 10402 B12R1.25 COCSc1cccc(c1C)F 62a_100011216893_100000766300 [0,2,0,0,0,0|2,0,0]=4 10403 B12R1.25 COCSc1cccc(c1C)N 62a_100000761887_100000766300 [0,2,0,0,0,0|2,0,0]=4 10404 B12R1.25 COCSc1cccc(c1C)N 62a_100000766300_100000761887 [0,2,0,0,0,0|2,0,0]=4 10405 B12R1.25 COCSc1cccc(c1C)O 62a_100000766300_100012002258 [0,2,0,0,0,0|2,0,0]=4 10406 B12R1.25 COCSc1cccc(c1C)O 62a_100012002258_100000766300 [0,2,0,0,0,0|2,0,0]=4 10407 B12R1.25 COCSc1cccc(c1Cl)Br 62a_100000766300_100010142854 [0,2,0,0,0,0|2,0,0]=4 10408 B12R1.25 COCSc1cccc(c1Cl)Br 62a_100010142854_100000766300 [0,2,0,0,0,0|2,0,0]=4 10409 B12R1.25 COCSc1cccc(c1Cl)C 62a_100000766300_200012352035 [0,2,0,0,0,0|2,0,0]=4 10410 B12R1.25 COCSc1cccc(c1Cl)C 62a_200012352035_100000766300 [0,2,0,0,0,0|2,0,0]=4 10411 B12R1.25 COCSc1cccc(c1Cl)Cl 62a_100000766300_100011215384 [0,2,0,0,0,0|2,0,0]=4 10412 B12R1.25 COCSc1cccc(c1Cl)Cl 62a_100011215384_100000766300 [0,2,0,0,0,0|2,0,0]=4 10413 B12R1.25 COCSc1cccc(c1Cl)F 62a_100000766300_200010234923 [0,2,0,0,0,0|2,0,0]=4 10414 B12R1.25 COCSc1cccc(c1Cl)F 62a_200010234923_100000766300 [0,2,0,0,0,0|2,0,0]=4 10415 B12R1.25 COCSc1cccc(c1Cl)O 62a_100000766300_100000049636 [0,2,0,0,0,0|2,0,0]=4 10416 B12R1.25 COCSc1cccc(c1F)Br 62a_100000702267_100000766300 [0,2,0,0,0,0|2,0,0]=4 10417 B12R1.25 COCSc1cccc(c1F)Br 62a_100000766300_100000702267 [0,2,0,0,0,0|2,0,0]=4 10418 B12R1.25 COCSc1cccc(c1F)C 62a_100000717567_100000766300 [0,2,0,0,0,0|2,0,0]=4 10419 B12R1.25 COCSc1cccc(c1F)C 62a_100000766300_100000717567 [0,2,0,0,0,0|2,0,0]=4 10420 B12R1.25 COCSc1cccc(c1F)Cl 62a_100000766300_100011217346 [0,2,0,0,0,0|2,0,0]=4 10421 B12R1.25 COCSc1cccc(c1F)Cl 62a_100011217346_100000766300 [0,2,0,0,0,0|2,0,0]=4 10422 B12R1.25 COCSc1cccc(c1F)F 62a_100000694657_100000766300 [0,2,0,0,0,0|2,0,0]=4 10423 B12R1.25 COCSc1cccc(c1F)F 62a_100000766300_100000694657 [0,2,0,0,0,0|2,0,0]=4 10424 B12R1.25 COCSc1cccc(c1F)N 62a_100000766300_100011935091 [0,2,0,0,0,0|2,0,0]=4 10425 B12R1.25 COCSc1cccc(c1F)N 62a_100011935091_100000766300 [0,2,0,0,0,0|2,0,0]=4 10426 B12R1.25 COCSc1cccc(c1F)O 62a_100000766300_100009817021 [0,2,0,0,0,0|2,0,0]=4 10427 B12R1.25 COCSc1cccc(c1F)O 62a_100009817021_100000766300 [0,2,0,0,0,0|2,0,0]=4 10428 B12R1.25 COCSc1cccc(c1N)Br 62a_100000766300_100010146558 [0,2,0,0,0,0|2,0,0]=4 10429 B12R1.25 COCSc1cccc(c1N)Br 62a_100010146558_100000766300 [0,2,0,0,0,0|2,0,0]=4 10430 B12R1.25 COCSc1cccc(c1N)C 62a_100000766300_100011834072 [0,2,0,0,0,0|2,0,0]=4 10431 B12R1.25 COCSc1cccc(c1N)C 62a_100011834072_100000766300 [0,2,0,0,0,0|2,0,0]=4 10432 B12R1.25 COCSc1cccc(c1N)Cl 62a_100000766300_100010190421 [0,2,0,0,0,0|2,0,0]=4 10433 B12R1.25 COCSc1cccc(c1N)Cl 62a_100010190421_100000766300 [0,2,0,0,0,0|2,0,0]=4 10434 B12R1.25 COCSc1cccc(c1N)F 62a_100000042321_100000766300 [0,2,0,0,0,0|2,0,0]=4 10435 B12R1.25 COCSc1cccc(c1N)F 62a_100000766300_100000042321 [0,2,0,0,0,0|2,0,0]=4 10436 B12R1.25 COCSc1cccc(c1N)N 62a_100015191791_100000766300 [0,2,0,0,0,0|2,0,0]=4 10437 B12R1.25 COCSc1cccc(c1N)O 62a_100000766300_100011934926 [0,2,0,0,0,0|2,0,0]=4 10438 B12R1.25 COCSc1cccc(c1O)Br 62a_100000766300_100010084509 [0,2,0,0,0,0|1,0,0]=3 10439 B12R1.25 COCSc1cccc(c1O)Br 62a_100010084509_100000766300 [0,2,0,0,0,0|1,0,0]=3 10440 B12R1.25 COCSc1cccc(c1O)C 62a_100000766300_100009817157 [0,2,0,0,0,0|1,0,0]=3 10441 B12R1.25 COCSc1cccc(c1O)C 62a_100009817157_100000766300 [0,2,0,0,0,0|1,0,0]=3 10442 B12R1.25 COCSc1cccc(c1O)Cl 62a_100000766300_100010202889 [0,2,0,0,0,0|1,0,0]=3 10443 B12R1.25 COCSc1cccc(c1O)Cl 62a_100010202889_100000766300 [0,2,0,0,0,0|1,0,0]=3 10444 B12R1.25 COCSc1cccc(c1O)F 62a_100000766300_100009813666 [0,2,0,0,0,0|1,0,0]=3 10445 B12R1.25 COCSc1cccc(c1O)F 62a_100009813666_100000766300 [0,2,0,0,0,0|1,0,0]=3 10446 B12R1.25 COCSc1cccc(c1O)N 62a_100000766300_100010084371 [0,2,0,0,0,0|1,0,0]=3 10447 B12R1.25 COCSc1cccc(c1O)N 62a_100011934915_100000766300 [0,2,0,0,0,0|1,0,0]=3 10448 B12R1.25 COCSc1cccc(c1O)O 62a_100000766300_100009815950 [0,2,0,0,0,0|1,0,0]=3 10449 B12R1.25 COCSc1ccnc(c1O)Cl 62a_100000766300_100010067911 [0,2,0,0,0,0|2,0,0]=4 10450 B12R1.25 COCSc1cncc(c1O)N 62a_100000694263_100000766300 [0,2,0,0,0,0|2,0,0]=4 10451 B12R1.25 COCSc1cncc(c1O)N 62a_100000766300_100000694263 [0,2,0,0,0,0|2,0,0]=4 10452 B12R1.25 COCSc1nccc(c1O)C 62a_100000766300_100000696282 [0,2,0,0,0,0|2,0,0]=4 10453 B12R1.25 COCSc1nccc(c1O)F 62a_100000766300_100009867227 [0,2,0,0,0,0|2,0,0]=4 10454 B12R1.25 COCSc1nccc(c1O)N 62a_100000766300_100009844647 [0,2,0,0,0,0|2,0,0]=4 10455 B12R1.25 CSCCc1cccc(c1Cl)Cl 62a_100000723033_200000210301 [0,2,0,0,0,0|1,0,0]=3 10456 B12R1.25 CSCCc1cccc(c1Cl)Cl 62a_200000210301_100000723033 [0,2,0,0,0,0|1,0,0]=3 10457 B12R1.25 CSCNc1cccc(c1Br)C 34a_100000684715_100011218213 [0,2,0,0,0,0|2,0,0]=4 10458 B12R1.25 CSCNc1cccc(c1Br)Cl 34a_100000687072_100011218213 [0,2,0,0,0,0|2,0,0]=4 10459 B12R1.25 CSCNc1cccc(c1Br)F 34a_100011934729_100011218213 [0,2,0,0,0,0|2,0,0]=4 10460 B12R1.25 CSCNc1cccc(c1Br)O 34a_100012183704_100011218213 [0,2,0,0,0,0|2,0,0]=4 10461 B12R1.25 CSCNc1cccc(c1C)Br 34a_100000750434_100011218213 [0,2,0,0,0,0|2,0,0]=4 10462 B12R1.25 CSCNc1cccc(c1C)C 2230a_100000210026_100011218213 [0,2,0,0,0,0|2,0,0]=4 10463 B12R1.25 CSCNc1cccc(c1C)C 34a_100000210026_100011218213 [0,2,0,0,0,0|2,0,0]=4 10464 B12R1.25 CSCNc1cccc(c1C)Cl 2230a_100000210441_100011218213 [0,2,0,0,0,0|2,0,0]=4 10465 B12R1.25 CSCNc1cccc(c1C)Cl 34a_100000210441_100011218213 [0,2,0,0,0,0|2,0,0]=4 10466 B12R1.25 CSCNc1cccc(c1C)F 34a_100000745574_100011218213 [0,2,0,0,0,0|2,0,0]=4 10467 B12R1.25 CSCNc1cccc(c1C)I 34a_100000761887_100011218213 [0,2,0,0,0,0|2,0,0]=4 10468 B12R1.25 CSCNc1cccc(c1C)O 34a_100011216573_100011218213 [0,2,0,0,0,0|2,0,0]=4 10469 B12R1.25 CSCNc1cccc(c1Cl)Br 34a_100000687075_100011218213 [0,2,0,0,0,0|2,0,0]=4 10470 B12R1.25 CSCNc1cccc(c1Cl)C 34a_100000765562_100011218213 [0,2,0,0,0,0|2,0,0]=4 10471 B12R1.25 CSCNc1cccc(c1Cl)Cl 34a_100000185733_100011218213 [0,2,0,0,0,0|2,0,0]=4 10472 B12R1.25 CSCNc1cccc(c1Cl)F 34a_100000692321_100011218213 [0,2,0,0,0,0|2,0,0]=4 10473 B12R1.25 CSCNc1cccc(c1Cl)O 34a_100012002038_100011218213 [0,2,0,0,0,0|2,0,0]=4 10474 B12R1.25 CSCNc1cccc(c1F)Br 2230a_100011935091_100011218213 [0,2,0,0,0,0|2,0,0]=4 10475 B12R1.25 CSCNc1cccc(c1F)Br 34a_100011935091_100011218213 [0,2,0,0,0,0|2,0,0]=4 10476 B12R1.25 CSCNc1cccc(c1F)C 2230a_100000697159_100011218213 [0,2,0,0,0,0|2,0,0]=4 10477 B12R1.25 CSCNc1cccc(c1F)C 34a_100000697159_100011218213 [0,2,0,0,0,0|2,0,0]=4 10478 B12R1.25 CSCNc1cccc(c1F)Cl 2230a_100000199060_100011218213 [0,2,0,0,0,0|2,0,0]=4 10479 B12R1.25 CSCNc1cccc(c1F)Cl 34a_100000199060_100011218213 [0,2,0,0,0,0|2,0,0]=4 10480 B12R1.25 CSCNc1cccc(c1F)F 34a_100000743855_100011218213 [0,2,0,0,0,0|2,0,0]=4 10481 B12R1.25 CSCNc1cccc(c1I)Br 34a_100020590159_100011218213 [0,2,0,0,0,0|2,0,0]=4 10482 B12R1.25 CSCNc1cccc(c1I)C 34a_100000761888_100011218213 [0,2,0,0,0,0|2,0,0]=4 10483 B12R1.25 CSCNc1cccc(c1I)Cl 34a_100000049713_100011218213 [0,2,0,0,0,0|2,0,0]=4 10484 B12R1.25 CSCNc1cccc(c1I)F 34a_100000690935_100011218213 [0,2,0,0,0,0|2,0,0]=4 10485 B12R1.25 CSCNc1cccc(c1O)Br 34a_100011934915_100011218213 [0,2,0,0,0,0|1,0,0]=3 10486 B12R1.25 CSCNc1cccc(c1O)C 34a_100000756359_100011218213 [0,2,0,0,0,0|1,0,0]=3 10487 B12R1.25 CSCNc1cccc(c1O)Cl 34a_100000754742_100011218213 [0,2,0,0,0,0|1,0,0]=3 10488 B12R1.25 CSCNc1cccc(c1O)F 34a_100011934987_100011218213 [0,2,0,0,0,0|1,0,0]=3 10489 B12R1.25 CSCOc1cccc(c1Br)Br 34a_100010187966_100011218213 [0,2,0,0,0,0|2,0,0]=4 10490 B12R1.25 CSCOc1cccc(c1Br)C 34a_100000686692_100011218213 [0,2,0,0,0,0|2,0,0]=4 10491 B12R1.25 CSCOc1cccc(c1Br)Cl 34a_100012348804_100011218213 [0,2,0,0,0,0|2,0,0]=4 10492 B12R1.25 CSCOc1cccc(c1Br)F 34a_100009820682_100011218213 [0,2,0,0,0,0|2,0,0]=4 10493 B12R1.25 CSCOc1cccc(c1Br)I 34a_100010187914_100011218213 [0,2,0,0,0,0|2,0,0]=4 10494 B12R1.25 CSCOc1cccc(c1Br)N 34a_100012183704_100011218213 [0,2,0,0,0,0|2,0,0]=4 10495 B12R1.25 CSCOc1cccc(c1C)Br 34a_100012002258_100011218213 [0,2,0,0,0,0|2,0,0]=4 10496 B12R1.25 CSCOc1cccc(c1C)C 34a_100000185855_100011218213 [0,2,0,0,0,0|2,0,0]=4 10497 B12R1.25 CSCOc1cccc(c1C)Cl 34a_100011265684_100011218213 [0,2,0,0,0,0|2,0,0]=4 10498 B12R1.25 CSCOc1cccc(c1C)F 34a_100011217231_100011218213 [0,2,0,0,0,0|2,0,0]=4 10499 B12R1.25 CSCOc1cccc(c1C)N 34a_100011216573_100011218213 [0,2,0,0,0,0|2,0,0]=4 10500 B12R1.25 CSCOc1cccc(c1Cl)Br 34a_100010187913_100011218213 [0,2,0,0,0,0|2,0,0]=4 10501 B12R1.25 CSCOc1cccc(c1Cl)C 34a_100000695629_100011218213 [0,2,0,0,0,0|2,0,0]=4 10502 B12R1.25 CSCOc1cccc(c1Cl)Cl 34a_100000211076_100011218213 [0,2,0,0,0,0|2,0,0]=4 10503 B12R1.25 CSCOc1cccc(c1Cl)F 34a_100000087408_100011218213 [0,2,0,0,0,0|2,0,0]=4 10504 B12R1.25 CSCOc1cccc(c1Cl)I 34a_100000049636_100011218213 [0,2,0,0,0,0|2,0,0]=4 10505 B12R1.25 CSCOc1cccc(c1Cl)N 34a_100012002038_100011218213 [0,2,0,0,0,0|2,0,0]=4 10506 B12R1.25 CSCOc1cccc(c1F)Br 34a_100009817021_100011218213 [0,2,0,0,0,0|2,0,0]=4 10507 B12R1.25 CSCOc1cccc(c1F)C 34a_100000751311_100011218213 [0,2,0,0,0,0|2,0,0]=4 10508 B12R1.25 CSCOc1cccc(c1F)Cl 34a_100000687438_100011218213 [0,2,0,0,0,0|2,0,0]=4 10509 B12R1.25 CSCOc1cccc(c1F)F 34a_100000751161_100011218213 [0,2,0,0,0,0|2,0,0]=4 10510 B12R1.25 CSCOc1cccc(c1I)Br 34a_100010187912_100011218213 [0,2,0,0,0,0|2,0,0]=4 10511 B12R1.25 CSCOc1cccc(c1I)C 34a_100010083724_100011218213 [0,2,0,0,0,0|2,0,0]=4 10512 B12R1.25 CSCOc1cccc(c1I)Cl 34a_100000050174_100011218213 [0,2,0,0,0,0|2,0,0]=4 10513 B12R1.25 CSCOc1cccc(c1I)F 34a_100000690913_100011218213 [0,2,0,0,0,0|2,0,0]=4 10514 B12R1.25 CSCOc1cccc(c1N)Br 34a_100011934926_100011218213 [0,2,0,0,0,0|2,0,0]=4 10515 B12R1.25 CSCOc1cccc(c1N)C 34a_100000743429_100011218213 [0,2,0,0,0,0|2,0,0]=4 10516 B12R1.25 CSCOc1cccc(c1N)Cl 34a_100012022510_100011218213 [0,2,0,0,0,0|2,0,0]=4 10517 B12R1.25 CSCOc1cccc(c1N)F 34a_100020591140_100011218213 [0,2,0,0,0,0|2,0,0]=4 10518 B12R1.25 CSCOc1cccc(c1N)I 34a_200000049512_100011218213 [0,2,0,0,0,0|2,0,0]=4 10519 B12R1.25 CSCOc1cccc(c1N)N 34a_100000033209_100011218213 [0,2,0,0,0,0|2,0,0]=4 10520 B12R1.25 CSCSc1cccc(c1Br)Br 62a_100010175083_100011218213 [0,2,0,0,0,0|2,0,0]=4 10521 B12R1.25 CSCSc1cccc(c1Br)Br 62a_100011218213_100010175083 [0,2,0,0,0,0|2,0,0]=4 10522 B12R1.25 CSCSc1cccc(c1Br)C 62a_100011218213_100012362457 [0,2,0,0,0,0|2,0,0]=4 10523 B12R1.25 CSCSc1cccc(c1Br)C 62a_100012362457_100011218213 [0,2,0,0,0,0|2,0,0]=4 10524 B12R1.25 CSCSc1cccc(c1Br)Cl 62a_100011218213_100014021842 [0,2,0,0,0,0|2,0,0]=4 10525 B12R1.25 CSCSc1cccc(c1Br)Cl 62a_100014021842_100011218213 [0,2,0,0,0,0|2,0,0]=4 10526 B12R1.25 CSCSc1cccc(c1Br)F 62a_100010202630_100011218213 [0,2,0,0,0,0|2,0,0]=4 10527 B12R1.25 CSCSc1cccc(c1Br)F 62a_100011218213_100010202630 [0,2,0,0,0,0|2,0,0]=4 10528 B12R1.25 CSCSc1cccc(c1Br)O 62a_100010187914_100011218213 [0,2,0,0,0,0|2,0,0]=4 10529 B12R1.25 CSCSc1cccc(c1Br)O 62a_100011218213_100010187914 [0,2,0,0,0,0|2,0,0]=4 10530 B12R1.25 CSCSc1cccc(c1C)Br 62a_100011218213_100012353703 [0,2,0,0,0,0|2,0,0]=4 10531 B12R1.25 CSCSc1cccc(c1C)Br 62a_100012353703_100011218213 [0,2,0,0,0,0|2,0,0]=4 10532 B12R1.25 CSCSc1cccc(c1C)C 62a_100011214922_100011218213 [0,2,0,0,0,0|2,0,0]=4 10533 B12R1.25 CSCSc1cccc(c1C)C 62a_100011218213_100011214922 [0,2,0,0,0,0|2,0,0]=4 10534 B12R1.25 CSCSc1cccc(c1C)Cl 62a_100000726075_100011218213 [0,2,0,0,0,0|2,0,0]=4 10535 B12R1.25 CSCSc1cccc(c1C)Cl 62a_100011218213_100000726075 [0,2,0,0,0,0|2,0,0]=4 10536 B12R1.25 CSCSc1cccc(c1C)F 62a_100011216893_100011218213 [0,2,0,0,0,0|2,0,0]=4 10537 B12R1.25 CSCSc1cccc(c1C)F 62a_100011218213_100011216893 [0,2,0,0,0,0|2,0,0]=4 10538 B12R1.25 CSCSc1cccc(c1C)N 62a_100000761887_100011218213 [0,2,0,0,0,0|2,0,0]=4 10539 B12R1.25 CSCSc1cccc(c1C)N 62a_100011218213_100000761887 [0,2,0,0,0,0|2,0,0]=4 10540 B12R1.25 CSCSc1cccc(c1C)O 62a_100011218213_100012002258 [0,2,0,0,0,0|2,0,0]=4 10541 B12R1.25 CSCSc1cccc(c1C)O 62a_100012002258_100011218213 [0,2,0,0,0,0|2,0,0]=4 10542 B12R1.25 CSCSc1cccc(c1Cl)Br 62a_100010142854_100011218213 [0,2,0,0,0,0|2,0,0]=4 10543 B12R1.25 CSCSc1cccc(c1Cl)Br 62a_100011218213_100010142854 [0,2,0,0,0,0|2,0,0]=4 10544 B12R1.25 CSCSc1cccc(c1Cl)C 62a_100011218213_200012352035 [0,2,0,0,0,0|2,0,0]=4 10545 B12R1.25 CSCSc1cccc(c1Cl)C 62a_200012352035_100011218213 [0,2,0,0,0,0|2,0,0]=4 10546 B12R1.25 CSCSc1cccc(c1Cl)Cl 62a_100011215384_100011218213 [0,2,0,0,0,0|2,0,0]=4 10547 B12R1.25 CSCSc1cccc(c1Cl)Cl 62a_100011218213_100011215384 [0,2,0,0,0,0|2,0,0]=4 10548 B12R1.25 CSCSc1cccc(c1Cl)F 62a_100011218213_200010234923 [0,2,0,0,0,0|2,0,0]=4 10549 B12R1.25 CSCSc1cccc(c1Cl)F 62a_200010234923_100011218213 [0,2,0,0,0,0|2,0,0]=4 10550 B12R1.25 CSCSc1cccc(c1Cl)O 62a_100011218213_100000049636 [0,2,0,0,0,0|2,0,0]=4 10551 B12R1.25 CSCSc1cccc(c1F)Br 62a_100000702267_100011218213 [0,2,0,0,0,0|2,0,0]=4 10552 B12R1.25 CSCSc1cccc(c1F)Br 62a_100011218213_100000702267 [0,2,0,0,0,0|2,0,0]=4 10553 B12R1.25 CSCSc1cccc(c1F)C 62a_100000717567_100011218213 [0,2,0,0,0,0|2,0,0]=4 10554 B12R1.25 CSCSc1cccc(c1F)C 62a_100011218213_100000717567 [0,2,0,0,0,0|2,0,0]=4 10555 B12R1.25 CSCSc1cccc(c1F)Cl 62a_100011217346_100011218213 [0,2,0,0,0,0|2,0,0]=4 10556 B12R1.25 CSCSc1cccc(c1F)Cl 62a_100011218213_100011217346 [0,2,0,0,0,0|2,0,0]=4 10557 B12R1.25 CSCSc1cccc(c1F)F 62a_100000694657_100011218213 [0,2,0,0,0,0|2,0,0]=4 10558 B12R1.25 CSCSc1cccc(c1F)F 62a_100011218213_100000694657 [0,2,0,0,0,0|2,0,0]=4 10559 B12R1.25 CSCSc1cccc(c1F)N 62a_100011218213_100011935091 [0,2,0,0,0,0|2,0,0]=4 10560 B12R1.25 CSCSc1cccc(c1F)N 62a_100011935091_100011218213 [0,2,0,0,0,0|2,0,0]=4 10561 B12R1.25 CSCSc1cccc(c1F)O 62a_100009817021_100011218213 [0,2,0,0,0,0|2,0,0]=4 10562 B12R1.25 CSCSc1cccc(c1F)O 62a_100011218213_100009817021 [0,2,0,0,0,0|2,0,0]=4 10563 B12R1.25 CSCSc1cccc(c1N)Br 62a_100010146558_100011218213 [0,2,0,0,0,0|2,0,0]=4 10564 B12R1.25 CSCSc1cccc(c1N)Br 62a_100011218213_100010146558 [0,2,0,0,0,0|2,0,0]=4 10565 B12R1.25 CSCSc1cccc(c1N)C 62a_100011218213_100011834072 [0,2,0,0,0,0|2,0,0]=4 10566 B12R1.25 CSCSc1cccc(c1N)C 62a_100011834072_100011218213 [0,2,0,0,0,0|2,0,0]=4 10567 B12R1.25 CSCSc1cccc(c1N)Cl 62a_100010190421_100011218213 [0,2,0,0,0,0|2,0,0]=4 10568 B12R1.25 CSCSc1cccc(c1N)Cl 62a_100011218213_100010190421 [0,2,0,0,0,0|2,0,0]=4 10569 B12R1.25 CSCSc1cccc(c1N)F 62a_100000042321_100011218213 [0,2,0,0,0,0|2,0,0]=4 10570 B12R1.25 CSCSc1cccc(c1N)F 62a_100011218213_100000042321 [0,2,0,0,0,0|2,0,0]=4 10571 B12R1.25 CSCSc1cccc(c1N)N 62a_100015191791_100011218213 [0,2,0,0,0,0|2,0,0]=4 10572 B12R1.25 CSCSc1cccc(c1N)O 62a_100011218213_100011934926 [0,2,0,0,0,0|2,0,0]=4 10573 B12R1.25 CSCSc1cccc(c1O)Br 62a_100010084509_100011218213 [0,2,0,0,0,0|1,0,0]=3 10574 B12R1.25 CSCSc1cccc(c1O)Br 62a_100011218213_100010084509 [0,2,0,0,0,0|1,0,0]=3 10575 B12R1.25 CSCSc1cccc(c1O)C 62a_100009817157_100011218213 [0,2,0,0,0,0|1,0,0]=3 10576 B12R1.25 CSCSc1cccc(c1O)C 62a_100011218213_100009817157 [0,2,0,0,0,0|1,0,0]=3 10577 B12R1.25 CSCSc1cccc(c1O)Cl 62a_100010202889_100011218213 [0,2,0,0,0,0|1,0,0]=3 10578 B12R1.25 CSCSc1cccc(c1O)Cl 62a_100011218213_100010202889 [0,2,0,0,0,0|1,0,0]=3 10579 B12R1.25 CSCSc1cccc(c1O)F 62a_100009813666_100011218213 [0,2,0,0,0,0|1,0,0]=3 10580 B12R1.25 CSCSc1cccc(c1O)F 62a_100011218213_100009813666 [0,2,0,0,0,0|1,0,0]=3 10581 B12R1.25 CSCSc1cccc(c1O)N 62a_100011218213_100010084371 [0,2,0,0,0,0|1,0,0]=3 10582 B12R1.25 CSCSc1cccc(c1O)N 62a_100011934915_100011218213 [0,2,0,0,0,0|1,0,0]=3 10583 B12R1.25 CSCSc1cccc(c1O)O 62a_100011218213_100009815950 [0,2,0,0,0,0|1,0,0]=3 10584 B12R1.25 CSCSc1ccnc(c1O)Cl 62a_100011218213_100010067911 [0,2,0,0,0,0|2,0,0]=4 10585 B12R1.25 CSCSc1cncc(c1O)N 62a_100000694263_100011218213 [0,2,0,0,0,0|2,0,0]=4 10586 B12R1.25 CSCSc1cncc(c1O)N 62a_100011218213_100000694263 [0,2,0,0,0,0|2,0,0]=4 10587 B12R1.25 CSCSc1nccc(c1O)C 62a_100011218213_100000696282 [0,2,0,0,0,0|2,0,0]=4 10588 B12R1.25 CSCSc1nccc(c1O)F 62a_100011218213_100009867227 [0,2,0,0,0,0|2,0,0]=4 10589 B12R1.25 CSCSc1nccc(c1O)N 62a_100011218213_100009844647 [0,2,0,0,0,0|2,0,0]=4 10590 B12R1.25 Cc1c(cccc1CCN[13CH3])Br 2230a_100161000114_200025704644 [0,2,0,0,0,0|1,0,0]=3 10591 B12R1.25 Cc1c(cccc1CCN[13CH3])Br 34a_100161000114_200025704644 [0,2,0,0,0,0|1,0,0]=3 10592 B12R1.25 Cc1c(cccc1CNCF)Br 34a_100000724210_100015361967 [0,2,0,0,0,0|2,0,0]=4 10593 B12R1.25 Cc1c(cccc1CNCF)Cl 34a_100020639605_100015361967 [0,2,0,0,0,0|2,0,0]=4 10594 B12R1.25 Cc1c(cccc1CNCF)F 34a_100132306986_100015361967 [0,2,0,0,0,0|2,0,0]=4 10595 B12R1.25 Cc1c(cccc1COCF)Br 34a_100000694458_100015361967 [0,2,0,0,0,0|2,0,0]=4 10596 B12R1.25 Cc1c(cccc1COCF)Br 7a_100000694458_100015361967 [0,2,0,0,0,0|2,0,0]=4 10597 B12R1.25 Cc1c(cccc1COCF)Cl 34a_100012000165_100015361967 [0,2,0,0,0,0|2,0,0]=4 10598 B12R1.25 Cc1c(cccc1COCF)Cl 7a_100012000165_100015361967 [0,2,0,0,0,0|2,0,0]=4 10599 B12R1.25 Cc1c(cccc1COCF)F 34a_100000042775_100015361967 [0,2,0,0,0,0|2,0,0]=4 10600 B12R1.25 Cc1c(cccc1COCF)F 7a_100000042775_100015361967 [0,2,0,0,0,0|2,0,0]=4 10601 B12R1.25 Cc1c(cccc1COCF)I 34a_100010150139_100015361967 [0,2,0,0,0,0|2,0,0]=4 10602 B12R1.25 Cc1c(cccc1COCF)I 7a_100010150139_100015361967 [0,2,0,0,0,0|2,0,0]=4 10603 B12R1.25 Cc1c(cccc1COCF)N 34a_102495339961_100015361967 [0,2,0,0,0,0|2,0,0]=4 10604 B12R1.25 Cc1c(cccc1COCF)N 7a_102495339961_100015361967 [0,2,0,0,0,0|2,0,0]=4 10605 B12R1.25 Cc1c(cccc1CSCF)Br 62a_100000694682_100015361967 [0,2,0,0,0,0|2,0,0]=4 10606 B12R1.25 Cc1c(cccc1CSCF)Br 62a_100015361967_100000694682 [0,2,0,0,0,0|2,0,0]=4 10607 B12R1.25 Cc1c(cccc1CSCF)Cl 62a_100012186920_100015361967 [0,2,0,0,0,0|2,0,0]=4 10608 B12R1.25 Cc1c(cccc1CSCF)Cl 62a_100015361967_100012186920 [0,2,0,0,0,0|2,0,0]=4 10609 B12R1.25 Cc1c(cccc1CSCF)F 62a_100009813626_100015361967 [0,2,0,0,0,0|2,0,0]=4 10610 B12R1.25 Cc1c(cccc1CSCF)F 62a_100015361967_100009813626 [0,2,0,0,0,0|2,0,0]=4 10611 B12R1.25 Cc1c(cccc1CSCF)I 62a_100010150147_100015361967 [0,2,0,0,0,0|2,0,0]=4 10612 B12R1.25 Cc1c(cccc1CSCF)I 62a_100015361967_100010150147 [0,2,0,0,0,0|2,0,0]=4 10613 B12R1.25 Cc1c(cccc1NCCF)Br 34a_100000750434_100011217306 [0,2,0,0,0,0|2,0,0]=4 10614 B12R1.25 Cc1c(cccc1NCCF)Cl 2230a_100000210441_100011217306 [0,2,0,0,0,0|2,0,0]=4 10615 B12R1.25 Cc1c(cccc1NCCF)Cl 34a_100000210441_100011217306 [0,2,0,0,0,0|2,0,0]=4 10616 B12R1.25 Cc1c(cccc1NCCF)Cl 7a_100000210441_100011217306 [0,2,0,0,0,0|2,0,0]=4 10617 B12R1.25 Cc1c(cccc1NCCF)F 34a_100000745574_100011217306 [0,2,0,0,0,0|2,0,0]=4 10618 B12R1.25 Cc1c(cccc1NCCF)F 7a_100000745574_100011217306 [0,2,0,0,0,0|2,0,0]=4 10619 B12R1.25 Cc1c(cccc1NCCF)I 34a_100000761887_100011217306 [0,2,0,0,0,0|2,0,0]=4 10620 B12R1.25 Cc1c(cccc1NCCF)O 34a_100011216573_100011217306 [0,2,0,0,0,0|2,0,0]=4 10621 B12R1.25 Cc1c(cccc1NCCF)O 7a_100011216573_100011217306 [0,2,0,0,0,0|2,0,0]=4 10622 B12R1.25 Cc1c(cccc1NCCO)Br 34a_100000750434_100000211926 [0,2,0,0,0,0|2,0,0]=4 10623 B12R1.25 Cc1c(cccc1NCCO)Cl 2230a_100000210441_100000211926 [0,2,0,0,0,0|2,0,0]=4 10624 B12R1.25 Cc1c(cccc1NCCO)Cl 34a_100000210441_100000211926 [0,2,0,0,0,0|2,0,0]=4 10625 B12R1.25 Cc1c(cccc1NCCO)Cl 7a_100000210441_100000211926 [0,2,0,0,0,0|2,0,0]=4 10626 B12R1.25 Cc1c(cccc1NCCO)F 34a_100000745574_100000211926 [0,2,0,0,0,0|2,0,0]=4 10627 B12R1.25 Cc1c(cccc1NCCO)F 7a_100000745574_100000211926 [0,2,0,0,0,0|2,0,0]=4 10628 B12R1.25 Cc1c(cccc1NCCO)I 34a_100000761887_100000211926 [0,2,0,0,0,0|2,0,0]=4 10629 B12R1.25 Cc1c(cccc1NCCO)O 34a_100011216573_100000211926 [0,2,0,0,0,0|2,0,0]=4 10630 B12R1.25 Cc1c(cccc1NCCO)O 7a_100011216573_100000211926 [0,2,0,0,0,0|2,0,0]=4 10631 B12R1.25 Cc1c(cccc1OCCF)Br 34a_100012002258_100011217306 [0,2,0,0,0,0|2,0,0]=4 10632 B12R1.25 Cc1c(cccc1OCCF)Br 7a_100012002258_100011217306 [0,2,0,0,0,0|2,0,0]=4 10633 B12R1.25 Cc1c(cccc1OCCF)Cl 34a_100011265684_100011217306 [0,2,0,0,0,0|2,0,0]=4 10634 B12R1.25 Cc1c(cccc1OCCF)Cl 7a_100011265684_100011217306 [0,2,0,0,0,0|2,0,0]=4 10635 B12R1.25 Cc1c(cccc1OCCF)F 34a_100011217231_100011217306 [0,2,0,0,0,0|2,0,0]=4 10636 B12R1.25 Cc1c(cccc1OCCF)F 7a_100011217231_100011217306 [0,2,0,0,0,0|2,0,0]=4 10637 B12R1.25 Cc1c(cccc1OCCF)N 34a_100011216573_100011217306 [0,2,0,0,0,0|2,0,0]=4 10638 B12R1.25 Cc1c(cccc1OCCF)N 7a_100011216573_100011217306 [0,2,0,0,0,0|2,0,0]=4 10639 B12R1.25 Cc1c(cccc1OCCO)Br 34a_100012002258_100000211926 [0,2,0,0,0,0|2,0,0]=4 10640 B12R1.25 Cc1c(cccc1OCCO)Br 7a_100012002258_100000211926 [0,2,0,0,0,0|2,0,0]=4 10641 B12R1.25 Cc1c(cccc1OCCO)Cl 34a_100011265684_100000211926 [0,2,0,0,0,0|2,0,0]=4 10642 B12R1.25 Cc1c(cccc1OCCO)Cl 7a_100011265684_100000211926 [0,2,0,0,0,0|2,0,0]=4 10643 B12R1.25 Cc1c(cccc1OCCO)F 34a_100011217231_100000211926 [0,2,0,0,0,0|2,0,0]=4 10644 B12R1.25 Cc1c(cccc1OCCO)F 7a_100011217231_100000211926 [0,2,0,0,0,0|2,0,0]=4 10645 B12R1.25 Cc1c(cccc1OCCO)N 34a_100011216573_100000211926 [0,2,0,0,0,0|2,0,0]=4 10646 B12R1.25 Cc1c(cccc1OCCO)N 7a_100011216573_100000211926 [0,2,0,0,0,0|2,0,0]=4 10647 B12R1.25 Cc1c(cccc1SCCF)Br 62a_100011217306_100012353703 [0,2,0,0,0,0|2,0,0]=4 10648 B12R1.25 Cc1c(cccc1SCCF)Br 62a_100012353703_100011217306 [0,2,0,0,0,0|2,0,0]=4 10649 B12R1.25 Cc1c(cccc1SCCF)Cl 62a_100000726075_100011217306 [0,2,0,0,0,0|2,0,0]=4 10650 B12R1.25 Cc1c(cccc1SCCF)Cl 62a_100011217306_100000726075 [0,2,0,0,0,0|2,0,0]=4 10651 B12R1.25 Cc1c(cccc1SCCF)F 62a_100011216893_100011217306 [0,2,0,0,0,0|2,0,0]=4 10652 B12R1.25 Cc1c(cccc1SCCF)F 62a_100011217306_100011216893 [0,2,0,0,0,0|2,0,0]=4 10653 B12R1.25 Cc1c(cccc1SCCF)N 62a_100000761887_100011217306 [0,2,0,0,0,0|2,0,0]=4 10654 B12R1.25 Cc1c(cccc1SCCF)N 62a_100011217306_100000761887 [0,2,0,0,0,0|2,0,0]=4 10655 B12R1.25 Cc1c(cccc1SCCF)O 62a_100011217306_100012002258 [0,2,0,0,0,0|2,0,0]=4 10656 B12R1.25 Cc1c(cccc1SCCF)O 62a_100012002258_100011217306 [0,2,0,0,0,0|2,0,0]=4 10657 B12R1.25 Cc1c(cccc1SCCO)Br 62a_100000211926_100012353703 [0,2,0,0,0,0|2,0,0]=4 10658 B12R1.25 Cc1c(cccc1SCCO)Br 62a_100012353703_100000211926 [0,2,0,0,0,0|2,0,0]=4 10659 B12R1.25 Cc1c(cccc1SCCO)Cl 62a_100000211926_100000726075 [0,2,0,0,0,0|2,0,0]=4 10660 B12R1.25 Cc1c(cccc1SCCO)Cl 62a_100000726075_100000211926 [0,2,0,0,0,0|2,0,0]=4 10661 B12R1.25 Cc1c(cccc1SCCO)F 62a_100000211926_100011216893 [0,2,0,0,0,0|2,0,0]=4 10662 B12R1.25 Cc1c(cccc1SCCO)F 62a_100011216893_100000211926 [0,2,0,0,0,0|2,0,0]=4 10663 B12R1.25 Cc1c(cccc1SCCO)N 62a_100000211926_100000761887 [0,2,0,0,0,0|2,0,0]=4 10664 B12R1.25 Cc1c(cccc1SCCO)N 62a_100000761887_100000211926 [0,2,0,0,0,0|2,0,0]=4 10665 B12R1.25 Cc1c(cccc1SCCO)O 62a_100000211926_100012002258 [0,2,0,0,0,0|2,0,0]=4 10666 B12R1.25 Cc1c(cccc1SCCO)O 62a_100012002258_100000211926 [0,2,0,0,0,0|2,0,0]=4 10667 B12R1.25 Cc1cccc(c1Br)COCF 34a_100011659289_100015361967 [0,2,0,0,0,0|2,0,0]=4 10668 B12R1.25 Cc1cccc(c1Br)COCF 7a_100011659289_100015361967 [0,2,0,0,0,0|2,0,0]=4 10669 B12R1.25 Cc1cccc(c1Br)CSCF 62a_100015361967_200012349612 [0,2,0,0,0,0|2,0,0]=4 10670 B12R1.25 Cc1cccc(c1Br)CSCF 62a_200012349612_100015361967 [0,2,0,0,0,0|2,0,0]=4 10671 B12R1.25 Cc1cccc(c1Br)NCCF 34a_100000684715_100011217306 [0,2,0,0,0,0|2,0,0]=4 10672 B12R1.25 Cc1cccc(c1Br)NCCO 34a_100000684715_100000211926 [0,2,0,0,0,0|2,0,0]=4 10673 B12R1.25 Cc1cccc(c1Br)OCCF 34a_100000686692_100011217306 [0,2,0,0,0,0|2,0,0]=4 10674 B12R1.25 Cc1cccc(c1Br)OCCF 7a_100000686692_100011217306 [0,2,0,0,0,0|2,0,0]=4 10675 B12R1.25 Cc1cccc(c1Br)OCCO 34a_100000686692_100000211926 [0,2,0,0,0,0|2,0,0]=4 10676 B12R1.25 Cc1cccc(c1Br)OCCO 7a_100000686692_100000211926 [0,2,0,0,0,0|2,0,0]=4 10677 B12R1.25 Cc1cccc(c1Br)SCCF 62a_100011217306_100012362457 [0,2,0,0,0,0|2,0,0]=4 10678 B12R1.25 Cc1cccc(c1Br)SCCF 62a_100012362457_100011217306 [0,2,0,0,0,0|2,0,0]=4 10679 B12R1.25 Cc1cccc(c1Br)SCCO 62a_100000211926_100012362457 [0,2,0,0,0,0|2,0,0]=4 10680 B12R1.25 Cc1cccc(c1Br)SCCO 62a_100012362457_100000211926 [0,2,0,0,0,0|2,0,0]=4 10681 B12R1.25 Cc1cccc(c1C)CNCF 34a_100011211637_100015361967 [0,2,0,0,0,0|2,0,0]=4 10682 B12R1.25 Cc1cccc(c1C)COCF 34a_100011219135_100015361967 [0,2,0,0,0,0|2,0,0]=4 10683 B12R1.25 Cc1cccc(c1C)COCF 7a_100011219135_100015361967 [0,2,0,0,0,0|2,0,0]=4 10684 B12R1.25 Cc1cccc(c1C)CSCF 62a_100011515928_100015361967 [0,2,0,0,0,0|2,0,0]=4 10685 B12R1.25 Cc1cccc(c1C)CSCF 62a_100015361967_100011515928 [0,2,0,0,0,0|2,0,0]=4 10686 B12R1.25 Cc1cccc(c1C)NCCF 2230a_100000210026_100011217306 [0,2,0,0,0,0|2,0,0]=4 10687 B12R1.25 Cc1cccc(c1C)NCCF 34a_100000210026_100011217306 [0,2,0,0,0,0|2,0,0]=4 10688 B12R1.25 Cc1cccc(c1C)NCCF 7a_100000210026_100011217306 [0,2,0,0,0,0|2,0,0]=4 10689 B12R1.25 Cc1cccc(c1C)NCCO 2230a_100000210026_100000211926 [0,2,0,0,0,0|2,0,0]=4 10690 B12R1.25 Cc1cccc(c1C)NCCO 34a_100000210026_100000211926 [0,2,0,0,0,0|2,0,0]=4 10691 B12R1.25 Cc1cccc(c1C)NCCO 7a_100000210026_100000211926 [0,2,0,0,0,0|2,0,0]=4 10692 B12R1.25 Cc1cccc(c1C)OCCF 34a_100000185855_100011217306 [0,2,0,0,0,0|2,0,0]=4 10693 B12R1.25 Cc1cccc(c1C)OCCF 7a_100000185855_100011217306 [0,2,0,0,0,0|2,0,0]=4 10694 B12R1.25 Cc1cccc(c1C)OCCO 34a_100000185855_100000211926 [0,2,0,0,0,0|2,0,0]=4 10695 B12R1.25 Cc1cccc(c1C)OCCO 7a_100000185855_100000211926 [0,2,0,0,0,0|2,0,0]=4 10696 B12R1.25 Cc1cccc(c1C)SCCF 62a_100011214922_100011217306 [0,2,0,0,0,0|2,0,0]=4 10697 B12R1.25 Cc1cccc(c1C)SCCF 62a_100011217306_100011214922 [0,2,0,0,0,0|2,0,0]=4 10698 B12R1.25 Cc1cccc(c1C)SCCO 62a_100000211926_100011214922 [0,2,0,0,0,0|2,0,0]=4 10699 B12R1.25 Cc1cccc(c1C)SCCO 62a_100011214922_100000211926 [0,2,0,0,0,0|2,0,0]=4 10700 B12R1.25 Cc1cccc(c1Cl)CNCF 34a_100025705714_100015361967 [0,2,0,0,0,0|2,0,0]=4 10701 B12R1.25 Cc1cccc(c1Cl)COCF 34a_100000710031_100015361967 [0,2,0,0,0,0|2,0,0]=4 10702 B12R1.25 Cc1cccc(c1Cl)COCF 7a_100000710031_100015361967 [0,2,0,0,0,0|2,0,0]=4 10703 B12R1.25 Cc1cccc(c1Cl)NCCF 34a_100000765562_100011217306 [0,2,0,0,0,0|2,0,0]=4 10704 B12R1.25 Cc1cccc(c1Cl)NCCF 7a_100000765562_100011217306 [0,2,0,0,0,0|2,0,0]=4 10705 B12R1.25 Cc1cccc(c1Cl)NCCO 34a_100000765562_100000211926 [0,2,0,0,0,0|2,0,0]=4 10706 B12R1.25 Cc1cccc(c1Cl)NCCO 7a_100000765562_100000211926 [0,2,0,0,0,0|2,0,0]=4 10707 B12R1.25 Cc1cccc(c1Cl)OCCF 34a_100000695629_100011217306 [0,2,0,0,0,0|2,0,0]=4 10708 B12R1.25 Cc1cccc(c1Cl)OCCF 7a_100000695629_100011217306 [0,2,0,0,0,0|2,0,0]=4 10709 B12R1.25 Cc1cccc(c1Cl)OCCO 34a_100000695629_100000211926 [0,2,0,0,0,0|2,0,0]=4 10710 B12R1.25 Cc1cccc(c1Cl)OCCO 7a_100000695629_100000211926 [0,2,0,0,0,0|2,0,0]=4 10711 B12R1.25 Cc1cccc(c1Cl)SCCF 62a_100011217306_200012352035 [0,2,0,0,0,0|2,0,0]=4 10712 B12R1.25 Cc1cccc(c1Cl)SCCF 62a_200012352035_100011217306 [0,2,0,0,0,0|2,0,0]=4 10713 B12R1.25 Cc1cccc(c1Cl)SCCO 62a_100000211926_200012352035 [0,2,0,0,0,0|2,0,0]=4 10714 B12R1.25 Cc1cccc(c1Cl)SCCO 62a_200012352035_100000211926 [0,2,0,0,0,0|2,0,0]=4 10715 B12R1.25 Cc1cccc(c1F)CNCF 34a_100012002060_100015361967 [0,2,0,0,0,0|2,0,0]=4 10716 B12R1.25 Cc1cccc(c1F)COCF 34a_200011219517_100015361967 [0,2,0,0,0,0|2,0,0]=4 10717 B12R1.25 Cc1cccc(c1F)COCF 7a_200011219517_100015361967 [0,2,0,0,0,0|2,0,0]=4 10718 B12R1.25 Cc1cccc(c1F)CSCF 62a_100011216058_100015361967 [0,2,0,0,0,0|2,0,0]=4 10719 B12R1.25 Cc1cccc(c1F)CSCF 62a_100015361967_100011216058 [0,2,0,0,0,0|2,0,0]=4 10720 B12R1.25 Cc1cccc(c1F)NCCF 2230a_100000697159_100011217306 [0,2,0,0,0,0|2,0,0]=4 10721 B12R1.25 Cc1cccc(c1F)NCCF 34a_100000697159_100011217306 [0,2,0,0,0,0|2,0,0]=4 10722 B12R1.25 Cc1cccc(c1F)NCCF 7a_100000697159_100011217306 [0,2,0,0,0,0|2,0,0]=4 10723 B12R1.25 Cc1cccc(c1F)NCCO 2230a_100000697159_100000211926 [0,2,0,0,0,0|2,0,0]=4 10724 B12R1.25 Cc1cccc(c1F)NCCO 34a_100000697159_100000211926 [0,2,0,0,0,0|2,0,0]=4 10725 B12R1.25 Cc1cccc(c1F)NCCO 7a_100000697159_100000211926 [0,2,0,0,0,0|2,0,0]=4 10726 B12R1.25 Cc1cccc(c1F)OCCF 34a_100000751311_100011217306 [0,2,0,0,0,0|2,0,0]=4 10727 B12R1.25 Cc1cccc(c1F)OCCF 7a_100000751311_100011217306 [0,2,0,0,0,0|2,0,0]=4 10728 B12R1.25 Cc1cccc(c1F)OCCO 34a_100000751311_100000211926 [0,2,0,0,0,0|2,0,0]=4 10729 B12R1.25 Cc1cccc(c1F)OCCO 7a_100000751311_100000211926 [0,2,0,0,0,0|2,0,0]=4 10730 B12R1.25 Cc1cccc(c1F)SCCF 62a_100000717567_100011217306 [0,2,0,0,0,0|2,0,0]=4 10731 B12R1.25 Cc1cccc(c1F)SCCF 62a_100011217306_100000717567 [0,2,0,0,0,0|2,0,0]=4 10732 B12R1.25 Cc1cccc(c1F)SCCO 62a_100000211926_100000717567 [0,2,0,0,0,0|2,0,0]=4 10733 B12R1.25 Cc1cccc(c1F)SCCO 62a_100000717567_100000211926 [0,2,0,0,0,0|2,0,0]=4 10734 B12R1.25 Cc1cccc(c1I)COCF 34a_100012349780_100015361967 [0,2,0,0,0,0|2,0,0]=4 10735 B12R1.25 Cc1cccc(c1I)COCF 7a_100012349780_100015361967 [0,2,0,0,0,0|2,0,0]=4 10736 B12R1.25 Cc1cccc(c1I)NCCF 34a_100000761888_100011217306 [0,2,0,0,0,0|2,0,0]=4 10737 B12R1.25 Cc1cccc(c1I)NCCO 34a_100000761888_100000211926 [0,2,0,0,0,0|2,0,0]=4 10738 B12R1.25 Cc1cccc(c1I)OCCF 34a_100010083724_100011217306 [0,2,0,0,0,0|2,0,0]=4 10739 B12R1.25 Cc1cccc(c1I)OCCF 7a_100010083724_100011217306 [0,2,0,0,0,0|2,0,0]=4 10740 B12R1.25 Cc1cccc(c1I)OCCO 34a_100010083724_100000211926 [0,2,0,0,0,0|2,0,0]=4 10741 B12R1.25 Cc1cccc(c1I)OCCO 7a_100010083724_100000211926 [0,2,0,0,0,0|2,0,0]=4 10742 B12R1.25 Cc1cccc(c1N)COCF 34a_100011215590_100015361967 [0,2,0,0,0,0|2,0,0]=4 10743 B12R1.25 Cc1cccc(c1N)OCCF 34a_100000743429_100011217306 [0,2,0,0,0,0|2,0,0]=4 10744 B12R1.25 Cc1cccc(c1N)OCCF 7a_100000743429_100011217306 [0,2,0,0,0,0|2,0,0]=4 10745 B12R1.25 Cc1cccc(c1N)OCCO 34a_100000743429_100000211926 [0,2,0,0,0,0|2,0,0]=4 10746 B12R1.25 Cc1cccc(c1N)OCCO 7a_100000743429_100000211926 [0,2,0,0,0,0|2,0,0]=4 10747 B12R1.25 Cc1cccc(c1N)SCCF 62a_100011217306_100011834072 [0,2,0,0,0,0|2,0,0]=4 10748 B12R1.25 Cc1cccc(c1N)SCCF 62a_100011834072_100011217306 [0,2,0,0,0,0|2,0,0]=4 10749 B12R1.25 Cc1cccc(c1N)SCCO 62a_100000211926_100011834072 [0,2,0,0,0,0|2,0,0]=4 10750 B12R1.25 Cc1cccc(c1N)SCCO 62a_100011834072_100000211926 [0,2,0,0,0,0|2,0,0]=4 10751 B12R1.25 Cc1cccc(c1O)CNCF 34a_100020639391_100015361967 [0,2,0,0,0,0|1,0,0]=3 10752 B12R1.25 Cc1cccc(c1O)NCC=O 34a_100000756359_200009817547 [0,2,0,0,0,0|1,0,1]=4 10753 B12R1.25 Cc1cccc(c1O)NCCF 34a_100000756359_100011217306 [0,2,0,0,0,0|1,0,0]=3 10754 B12R1.25 Cc1cccc(c1O)NCCO 34a_100000756359_100000211926 [0,2,0,0,0,0|1,0,0]=3 10755 B12R1.25 Cc1cccc(c1O)SCC#N 62a_100009817157_100011215382 [0,2,0,0,0,0|1,0,1]=4 10756 B12R1.25 Cc1cccc(c1O)SCC#N 62a_100011215382_100009817157 [0,2,0,0,0,0|1,0,1]=4 10757 B12R1.25 Cc1cccc(c1O)SCC=O 62a_100009817157_200015260668 [0,2,0,0,0,0|1,0,1]=4 10758 B12R1.25 Cc1cccc(c1O)SCC=O 62a_200015260668_100009817157 [0,2,0,0,0,0|1,0,1]=4 10759 B12R1.25 Cc1cccc(c1O)SCCF 62a_100009817157_100011217306 [0,2,0,0,0,0|1,0,0]=3 10760 B12R1.25 Cc1cccc(c1O)SCCF 62a_100011217306_100009817157 [0,2,0,0,0,0|1,0,0]=3 10761 B12R1.25 Cc1cccc(c1O)SCCO 62a_100000211926_100009817157 [0,2,0,0,0,0|1,0,0]=3 10762 B12R1.25 Cc1cccc(c1O)SCCO 62a_100009817157_100000211926 [0,2,0,0,0,0|1,0,0]=3 10763 B12R1.25 Cc1ccnc(c1O)SCCF 62a_100011217306_100000696282 [0,2,0,0,0,0|2,0,0]=4 10764 B12R1.25 Cc1ccnc(c1O)SCCO 62a_100000211926_100000696282 [0,2,0,0,0,0|2,0,0]=4 10765 B12R1.25 FCCNc1cccc(c1Br)Cl 34a_100000687072_100011217306 [0,2,0,0,0,0|2,0,0]=4 10766 B12R1.25 FCCNc1cccc(c1Br)F 34a_100011934729_100011217306 [0,2,0,0,0,0|2,0,0]=4 10767 B12R1.25 FCCNc1cccc(c1Cl)Br 34a_100000687075_100011217306 [0,2,0,0,0,0|2,0,0]=4 10768 B12R1.25 FCCNc1cccc(c1Cl)Cl 34a_100000185733_100011217306 [0,2,0,0,0,0|2,0,0]=4 10769 B12R1.25 FCCNc1cccc(c1Cl)F 34a_100000692321_100011217306 [0,2,0,0,0,0|2,0,0]=4 10770 B12R1.25 FCCNc1cccc(c1F)Br 2230a_100011935091_100011217306 [0,2,0,0,0,0|2,0,0]=4 10771 B12R1.25 FCCNc1cccc(c1F)Br 34a_100011935091_100011217306 [0,2,0,0,0,0|2,0,0]=4 10772 B12R1.25 FCCNc1cccc(c1F)Cl 2230a_100000199060_100011217306 [0,2,0,0,0,0|2,0,0]=4 10773 B12R1.25 FCCNc1cccc(c1F)Cl 34a_100000199060_100011217306 [0,2,0,0,0,0|2,0,0]=4 10774 B12R1.25 FCCNc1cccc(c1F)F 34a_100000743855_100011217306 [0,2,0,0,0,0|2,0,0]=4 10775 B12R1.25 FCCNc1cccc(c1I)Br 34a_100020590159_100011217306 [0,2,0,0,0,0|2,0,0]=4 10776 B12R1.25 FCCNc1cccc(c1I)Cl 34a_100000049713_100011217306 [0,2,0,0,0,0|2,0,0]=4 10777 B12R1.25 FCCNc1cccc(c1I)F 34a_100000690935_100011217306 [0,2,0,0,0,0|2,0,0]=4 10778 B12R1.25 FCCOc1cccc(c1Br)Br 34a_100010187966_100011217306 [0,2,0,0,0,0|2,0,0]=4 10779 B12R1.25 FCCOc1cccc(c1Br)Br 7a_100010187966_100011217306 [0,2,0,0,0,0|2,0,0]=4 10780 B12R1.25 FCCOc1cccc(c1Br)Cl 34a_100012348804_100011217306 [0,2,0,0,0,0|2,0,0]=4 10781 B12R1.25 FCCOc1cccc(c1Br)Cl 7a_100012348804_100011217306 [0,2,0,0,0,0|2,0,0]=4 10782 B12R1.25 FCCOc1cccc(c1Br)F 34a_100009820682_100011217306 [0,2,0,0,0,0|2,0,0]=4 10783 B12R1.25 FCCOc1cccc(c1Br)F 7a_100009820682_100011217306 [0,2,0,0,0,0|2,0,0]=4 10784 B12R1.25 FCCOc1cccc(c1Br)I 34a_100010187914_100011217306 [0,2,0,0,0,0|2,0,0]=4 10785 B12R1.25 FCCOc1cccc(c1Br)I 7a_100010187914_100011217306 [0,2,0,0,0,0|2,0,0]=4 10786 B12R1.25 FCCOc1cccc(c1Cl)Br 34a_100010187913_100011217306 [0,2,0,0,0,0|2,0,0]=4 10787 B12R1.25 FCCOc1cccc(c1Cl)Br 7a_100010187913_100011217306 [0,2,0,0,0,0|2,0,0]=4 10788 B12R1.25 FCCOc1cccc(c1Cl)Cl 34a_100000211076_100011217306 [0,2,0,0,0,0|2,0,0]=4 10789 B12R1.25 FCCOc1cccc(c1Cl)Cl 7a_100000211076_100011217306 [0,2,0,0,0,0|2,0,0]=4 10790 B12R1.25 FCCOc1cccc(c1Cl)F 34a_100000087408_100011217306 [0,2,0,0,0,0|2,0,0]=4 10791 B12R1.25 FCCOc1cccc(c1Cl)F 7a_100000087408_100011217306 [0,2,0,0,0,0|2,0,0]=4 10792 B12R1.25 FCCOc1cccc(c1Cl)I 34a_100000049636_100011217306 [0,2,0,0,0,0|2,0,0]=4 10793 B12R1.25 FCCOc1cccc(c1Cl)I 7a_100000049636_100011217306 [0,2,0,0,0,0|2,0,0]=4 10794 B12R1.25 FCCOc1cccc(c1F)Br 34a_100009817021_100011217306 [0,2,0,0,0,0|2,0,0]=4 10795 B12R1.25 FCCOc1cccc(c1F)Br 7a_100009817021_100011217306 [0,2,0,0,0,0|2,0,0]=4 10796 B12R1.25 FCCOc1cccc(c1F)Cl 34a_100000687438_100011217306 [0,2,0,0,0,0|2,0,0]=4 10797 B12R1.25 FCCOc1cccc(c1F)Cl 7a_100000687438_100011217306 [0,2,0,0,0,0|2,0,0]=4 10798 B12R1.25 FCCOc1cccc(c1F)F 34a_100000751161_100011217306 [0,2,0,0,0,0|2,0,0]=4 10799 B12R1.25 FCCOc1cccc(c1F)F 7a_100000751161_100011217306 [0,2,0,0,0,0|2,0,0]=4 10800 B12R1.25 FCCOc1cccc(c1I)Br 34a_100010187912_100011217306 [0,2,0,0,0,0|2,0,0]=4 10801 B12R1.25 FCCOc1cccc(c1I)Br 7a_100010187912_100011217306 [0,2,0,0,0,0|2,0,0]=4 10802 B12R1.25 FCCOc1cccc(c1I)Cl 34a_100000050174_100011217306 [0,2,0,0,0,0|2,0,0]=4 10803 B12R1.25 FCCOc1cccc(c1I)Cl 7a_100000050174_100011217306 [0,2,0,0,0,0|2,0,0]=4 10804 B12R1.25 FCCOc1cccc(c1I)F 34a_100000690913_100011217306 [0,2,0,0,0,0|2,0,0]=4 10805 B12R1.25 FCCOc1cccc(c1I)F 7a_100000690913_100011217306 [0,2,0,0,0,0|2,0,0]=4 10806 B12R1.25 FCCSc1cccc(c1Br)Br 62a_100010175083_100011217306 [0,2,0,0,0,0|2,0,0]=4 10807 B12R1.25 FCCSc1cccc(c1Br)Br 62a_100011217306_100010175083 [0,2,0,0,0,0|2,0,0]=4 10808 B12R1.25 FCCSc1cccc(c1Br)Cl 62a_100011217306_100014021842 [0,2,0,0,0,0|2,0,0]=4 10809 B12R1.25 FCCSc1cccc(c1Br)Cl 62a_100014021842_100011217306 [0,2,0,0,0,0|2,0,0]=4 10810 B12R1.25 FCCSc1cccc(c1Br)F 62a_100010202630_100011217306 [0,2,0,0,0,0|2,0,0]=4 10811 B12R1.25 FCCSc1cccc(c1Br)F 62a_100011217306_100010202630 [0,2,0,0,0,0|2,0,0]=4 10812 B12R1.25 FCCSc1cccc(c1Cl)Br 62a_100010142854_100011217306 [0,2,0,0,0,0|2,0,0]=4 10813 B12R1.25 FCCSc1cccc(c1Cl)Br 62a_100011217306_100010142854 [0,2,0,0,0,0|2,0,0]=4 10814 B12R1.25 FCCSc1cccc(c1Cl)Cl 62a_100011215384_100011217306 [0,2,0,0,0,0|2,0,0]=4 10815 B12R1.25 FCCSc1cccc(c1Cl)Cl 62a_100011217306_100011215384 [0,2,0,0,0,0|2,0,0]=4 10816 B12R1.25 FCCSc1cccc(c1Cl)F 62a_100011217306_200010234923 [0,2,0,0,0,0|2,0,0]=4 10817 B12R1.25 FCCSc1cccc(c1Cl)F 62a_200010234923_100011217306 [0,2,0,0,0,0|2,0,0]=4 10818 B12R1.25 FCCSc1cccc(c1F)Br 62a_100000702267_100011217306 [0,2,0,0,0,0|2,0,0]=4 10819 B12R1.25 FCCSc1cccc(c1F)Br 62a_100011217306_100000702267 [0,2,0,0,0,0|2,0,0]=4 10820 B12R1.25 FCCSc1cccc(c1F)Cl 62a_100011217306_100011217346 [0,2,0,0,0,0|2,0,0]=4 10821 B12R1.25 FCCSc1cccc(c1F)Cl 62a_100011217346_100011217306 [0,2,0,0,0,0|2,0,0]=4 10822 B12R1.25 FCCSc1cccc(c1F)F 62a_100000694657_100011217306 [0,2,0,0,0,0|2,0,0]=4 10823 B12R1.25 FCCSc1cccc(c1F)F 62a_100011217306_100000694657 [0,2,0,0,0,0|2,0,0]=4 10824 B12R1.25 FCNCc1cccc(c1Br)F 34a_100020638964_100015361967 [0,2,0,0,0,0|2,0,0]=4 10825 B12R1.25 FCNCc1cccc(c1Cl)Cl 34a_100011211633_100015361967 [0,2,0,0,0,0|2,0,0]=4 10826 B12R1.25 FCNCc1cccc(c1Cl)F 34a_100012001614_100015361967 [0,2,0,0,0,0|2,0,0]=4 10827 B12R1.25 FCNCc1cccc(c1F)Br 34a_100015189953_100015361967 [0,2,0,0,0,0|2,0,0]=4 10828 B12R1.25 FCNCc1cccc(c1F)Cl 34a_100000764326_100015361967 [0,2,0,0,0,0|2,0,0]=4 10829 B12R1.25 FCNCc1cccc(c1F)F 34a_100011199105_100015361967 [0,2,0,0,0,0|2,0,0]=4 10830 B12R1.25 FCOCc1cccc(c1Br)Cl 34a_100010168166_100015361967 [0,2,0,0,0,0|2,0,0]=4 10831 B12R1.25 FCOCc1cccc(c1Br)Cl 7a_100010168166_100015361967 [0,2,0,0,0,0|2,0,0]=4 10832 B12R1.25 FCOCc1cccc(c1Br)F 34a_100012351117_100015361967 [0,2,0,0,0,0|2,0,0]=4 10833 B12R1.25 FCOCc1cccc(c1Br)F 7a_100012351117_100015361967 [0,2,0,0,0,0|2,0,0]=4 10834 B12R1.25 FCOCc1cccc(c1Br)I 34a_100010240205_100015361967 [0,2,0,0,0,0|2,0,0]=4 10835 B12R1.25 FCOCc1cccc(c1Br)I 7a_100010240205_100015361967 [0,2,0,0,0,0|2,0,0]=4 10836 B12R1.25 FCOCc1cccc(c1Cl)Br 34a_100012351182_100015361967 [0,2,0,0,0,0|2,0,0]=4 10837 B12R1.25 FCOCc1cccc(c1Cl)Br 7a_100012351182_100015361967 [0,2,0,0,0,0|2,0,0]=4 10838 B12R1.25 FCOCc1cccc(c1Cl)Cl 34a_100000720469_100015361967 [0,2,0,0,0,0|2,0,0]=4 10839 B12R1.25 FCOCc1cccc(c1Cl)Cl 7a_100000720469_100015361967 [0,2,0,0,0,0|2,0,0]=4 10840 B12R1.25 FCOCc1cccc(c1Cl)F 34a_100000696319_100015361967 [0,2,0,0,0,0|2,0,0]=4 10841 B12R1.25 FCOCc1cccc(c1Cl)F 7a_100000696319_100015361967 [0,2,0,0,0,0|2,0,0]=4 10842 B12R1.25 FCOCc1cccc(c1F)Br 34a_100011935076_100015361967 [0,2,0,0,0,0|2,0,0]=4 10843 B12R1.25 FCOCc1cccc(c1F)Br 7a_100011935076_100015361967 [0,2,0,0,0,0|2,0,0]=4 10844 B12R1.25 FCOCc1cccc(c1F)Cl 34a_100011216988_100015361967 [0,2,0,0,0,0|2,0,0]=4 10845 B12R1.25 FCOCc1cccc(c1F)Cl 7a_100011216988_100015361967 [0,2,0,0,0,0|2,0,0]=4 10846 B12R1.25 FCOCc1cccc(c1F)F 34a_100011218644_100015361967 [0,2,0,0,0,0|2,0,0]=4 10847 B12R1.25 FCOCc1cccc(c1F)F 7a_100011218644_100015361967 [0,2,0,0,0,0|2,0,0]=4 10848 B12R1.25 FCOCc1cccc(c1F)I 34a_200010235739_100015361967 [0,2,0,0,0,0|2,0,0]=4 10849 B12R1.25 FCOCc1cccc(c1F)I 7a_200010235739_100015361967 [0,2,0,0,0,0|2,0,0]=4 10850 B12R1.25 FCOCc1cccc(c1I)Br 34a_100010146604_100015361967 [0,2,0,0,0,0|2,0,0]=4 10851 B12R1.25 FCOCc1cccc(c1I)Br 7a_100010146604_100015361967 [0,2,0,0,0,0|2,0,0]=4 10852 B12R1.25 FCOCc1cccc(c1I)F 34a_100000692438_100015361967 [0,2,0,0,0,0|2,0,0]=4 10853 B12R1.25 FCOCc1cccc(c1I)F 7a_100000692438_100015361967 [0,2,0,0,0,0|2,0,0]=4 10854 B12R1.25 FCSCc1cccc(c1Br)Cl 62a_100010145525_100015361967 [0,2,0,0,0,0|2,0,0]=4 10855 B12R1.25 FCSCc1cccc(c1Br)Cl 62a_100015361967_100010145525 [0,2,0,0,0,0|2,0,0]=4 10856 B12R1.25 FCSCc1cccc(c1Br)F 62a_100012351116_100015361967 [0,2,0,0,0,0|2,0,0]=4 10857 B12R1.25 FCSCc1cccc(c1Br)F 62a_100015361967_100012351116 [0,2,0,0,0,0|2,0,0]=4 10858 B12R1.25 FCSCc1cccc(c1Br)I 62a_100010254545_100015361967 [0,2,0,0,0,0|2,0,0]=4 10859 B12R1.25 FCSCc1cccc(c1Br)I 62a_100015361967_100010254545 [0,2,0,0,0,0|2,0,0]=4 10860 B12R1.25 FCSCc1cccc(c1Cl)Br 62a_100012349491_100015361967 [0,2,0,0,0,0|2,0,0]=4 10861 B12R1.25 FCSCc1cccc(c1Cl)Br 62a_100015361967_100012349491 [0,2,0,0,0,0|2,0,0]=4 10862 B12R1.25 FCSCc1cccc(c1Cl)Cl 62a_100000720918_100015361967 [0,2,0,0,0,0|2,0,0]=4 10863 B12R1.25 FCSCc1cccc(c1Cl)Cl 62a_100015361967_100000723366 [0,2,0,0,0,0|2,0,0]=4 10864 B12R1.25 FCSCc1cccc(c1Cl)F 62a_100000696688_100015361967 [0,2,0,0,0,0|2,0,0]=4 10865 B12R1.25 FCSCc1cccc(c1Cl)F 62a_100015361967_100000696688 [0,2,0,0,0,0|2,0,0]=4 10866 B12R1.25 FCSCc1cccc(c1F)Br 62a_100012356506_100015361967 [0,2,0,0,0,0|2,0,0]=4 10867 B12R1.25 FCSCc1cccc(c1F)Br 62a_100015361967_100012356506 [0,2,0,0,0,0|2,0,0]=4 10868 B12R1.25 FCSCc1cccc(c1F)Cl 62a_100000716733_100015361967 [0,2,0,0,0,0|2,0,0]=4 10869 B12R1.25 FCSCc1cccc(c1F)Cl 62a_100015361967_100000716733 [0,2,0,0,0,0|2,0,0]=4 10870 B12R1.25 FCSCc1cccc(c1F)F 62a_100000217499_100015361967 [0,2,0,0,0,0|2,0,0]=4 10871 B12R1.25 FCSCc1cccc(c1F)F 62a_100015361967_100000217499 [0,2,0,0,0,0|2,0,0]=4 10872 B12R1.25 FCSCc1cccc(c1I)F 62a_100010149603_100015361967 [0,2,0,0,0,0|2,0,0]=4 10873 B12R1.25 FCSCc1cccc(c1I)F 62a_100015361967_100010149603 [0,2,0,0,0,0|2,0,0]=4 10874 B12R1.25 N#CCSc1cccc(c1O)Br 62a_100010084509_100011215382 [0,2,0,0,0,0|1,0,1]=4 10875 B12R1.25 N#CCSc1cccc(c1O)Br 62a_100011215382_100010084509 [0,2,0,0,0,0|1,0,1]=4 10876 B12R1.25 N#CCSc1cccc(c1O)Cl 62a_100010202889_100011215382 [0,2,0,0,0,0|1,0,1]=4 10877 B12R1.25 N#CCSc1cccc(c1O)Cl 62a_100011215382_100010202889 [0,2,0,0,0,0|1,0,1]=4 10878 B12R1.25 N#CCSc1cccc(c1O)F 62a_100009813666_100011215382 [0,2,0,0,0,0|1,0,1]=4 10879 B12R1.25 N#CCSc1cccc(c1O)F 62a_100011215382_100009813666 [0,2,0,0,0,0|1,0,1]=4 10880 B12R1.25 N#CCSc1cccc(c1O)N 62a_100011215382_100010084371 [0,2,0,0,0,0|1,0,1]=4 10881 B12R1.25 N#CCSc1cccc(c1O)N 62a_100011934915_100011215382 [0,2,0,0,0,0|1,0,1]=4 10882 B12R1.25 N#CCSc1cccc(c1O)O 62a_100011215382_100009815950 [0,2,0,0,0,0|1,0,1]=4 10883 B12R1.25 Nc1c(cccc1COCF)Br 34a_100012349457_100015361967 [0,2,0,0,0,0|2,0,0]=4 10884 B12R1.25 Nc1c(cccc1COCF)Cl 34a_100012182729_100015361967 [0,2,0,0,0,0|2,0,0]=4 10885 B12R1.25 Nc1c(cccc1COCF)F 34a_100000692437_100015361967 [0,2,0,0,0,0|2,0,0]=4 10886 B12R1.25 Nc1c(cccc1OCCF)Br 34a_100011934926_100011217306 [0,2,0,0,0,0|2,0,0]=4 10887 B12R1.25 Nc1c(cccc1OCCF)Br 7a_100011934926_100011217306 [0,2,0,0,0,0|2,0,0]=4 10888 B12R1.25 Nc1c(cccc1OCCF)Cl 34a_100012022510_100011217306 [0,2,0,0,0,0|2,0,0]=4 10889 B12R1.25 Nc1c(cccc1OCCF)Cl 7a_100012022510_100011217306 [0,2,0,0,0,0|2,0,0]=4 10890 B12R1.25 Nc1c(cccc1OCCF)F 34a_100020591140_100011217306 [0,2,0,0,0,0|2,0,0]=4 10891 B12R1.25 Nc1c(cccc1OCCF)F 7a_100020591140_100011217306 [0,2,0,0,0,0|2,0,0]=4 10892 B12R1.25 Nc1c(cccc1OCCF)I 34a_200000049512_100011217306 [0,2,0,0,0,0|2,0,0]=4 10893 B12R1.25 Nc1c(cccc1OCCF)I 7a_200000049512_100011217306 [0,2,0,0,0,0|2,0,0]=4 10894 B12R1.25 Nc1c(cccc1OCCO)Br 34a_100011934926_100000211926 [0,2,0,0,0,0|2,0,0]=4 10895 B12R1.25 Nc1c(cccc1OCCO)Br 7a_100011934926_100000211926 [0,2,0,0,0,0|2,0,0]=4 10896 B12R1.25 Nc1c(cccc1OCCO)Cl 34a_100012022510_100000211926 [0,2,0,0,0,0|2,0,0]=4 10897 B12R1.25 Nc1c(cccc1OCCO)Cl 7a_100012022510_100000211926 [0,2,0,0,0,0|2,0,0]=4 10898 B12R1.25 Nc1c(cccc1OCCO)F 34a_100020591140_100000211926 [0,2,0,0,0,0|2,0,0]=4 10899 B12R1.25 Nc1c(cccc1OCCO)F 7a_100020591140_100000211926 [0,2,0,0,0,0|2,0,0]=4 10900 B12R1.25 Nc1c(cccc1OCCO)I 34a_200000049512_100000211926 [0,2,0,0,0,0|2,0,0]=4 10901 B12R1.25 Nc1c(cccc1OCCO)I 7a_200000049512_100000211926 [0,2,0,0,0,0|2,0,0]=4 10902 B12R1.25 Nc1c(cccc1SCCF)Br 62a_100010146558_100011217306 [0,2,0,0,0,0|2,0,0]=4 10903 B12R1.25 Nc1c(cccc1SCCF)Br 62a_100011217306_100010146558 [0,2,0,0,0,0|2,0,0]=4 10904 B12R1.25 Nc1c(cccc1SCCF)Cl 62a_100010190421_100011217306 [0,2,0,0,0,0|2,0,0]=4 10905 B12R1.25 Nc1c(cccc1SCCF)Cl 62a_100011217306_100010190421 [0,2,0,0,0,0|2,0,0]=4 10906 B12R1.25 Nc1c(cccc1SCCF)F 62a_100000042321_100011217306 [0,2,0,0,0,0|2,0,0]=4 10907 B12R1.25 Nc1c(cccc1SCCF)F 62a_100011217306_100000042321 [0,2,0,0,0,0|2,0,0]=4 10908 B12R1.25 Nc1c(cccc1SCCF)O 62a_100011217306_100011934926 [0,2,0,0,0,0|2,0,0]=4 10909 B12R1.25 Nc1c(cccc1SCCO)Br 62a_100000211926_100010146558 [0,2,0,0,0,0|2,0,0]=4 10910 B12R1.25 Nc1c(cccc1SCCO)Br 62a_100010146558_100000211926 [0,2,0,0,0,0|2,0,0]=4 10911 B12R1.25 Nc1c(cccc1SCCO)Cl 62a_100000211926_100010190421 [0,2,0,0,0,0|2,0,0]=4 10912 B12R1.25 Nc1c(cccc1SCCO)Cl 62a_100010190421_100000211926 [0,2,0,0,0,0|2,0,0]=4 10913 B12R1.25 Nc1c(cccc1SCCO)F 62a_100000042321_100000211926 [0,2,0,0,0,0|2,0,0]=4 10914 B12R1.25 Nc1c(cccc1SCCO)F 62a_100000211926_100000042321 [0,2,0,0,0,0|2,0,0]=4 10915 B12R1.25 Nc1c(cccc1SCCO)O 62a_100000211926_100011934926 [0,2,0,0,0,0|2,0,0]=4 10916 B12R1.25 Nc1cccc(c1Br)OCCF 34a_100012183704_100011217306 [0,2,0,0,0,0|2,0,0]=4 10917 B12R1.25 Nc1cccc(c1Br)OCCF 7a_100012183704_100011217306 [0,2,0,0,0,0|2,0,0]=4 10918 B12R1.25 Nc1cccc(c1Br)OCCO 34a_100012183704_100000211926 [0,2,0,0,0,0|2,0,0]=4 10919 B12R1.25 Nc1cccc(c1Br)OCCO 7a_100012183704_100000211926 [0,2,0,0,0,0|2,0,0]=4 10920 B12R1.25 Nc1cccc(c1Cl)OCCF 34a_100012002038_100011217306 [0,2,0,0,0,0|2,0,0]=4 10921 B12R1.25 Nc1cccc(c1Cl)OCCF 7a_100012002038_100011217306 [0,2,0,0,0,0|2,0,0]=4 10922 B12R1.25 Nc1cccc(c1Cl)OCCO 34a_100012002038_100000211926 [0,2,0,0,0,0|2,0,0]=4 10923 B12R1.25 Nc1cccc(c1Cl)OCCO 7a_100012002038_100000211926 [0,2,0,0,0,0|2,0,0]=4 10924 B12R1.25 Nc1cccc(c1F)COCF 34a_100012023829_100015361967 [0,2,0,0,0,0|2,0,0]=4 10925 B12R1.25 Nc1cccc(c1F)SCCF 62a_100011217306_100011935091 [0,2,0,0,0,0|2,0,0]=4 10926 B12R1.25 Nc1cccc(c1F)SCCF 62a_100011935091_100011217306 [0,2,0,0,0,0|2,0,0]=4 10927 B12R1.25 Nc1cccc(c1F)SCCO 62a_100000211926_100011935091 [0,2,0,0,0,0|2,0,0]=4 10928 B12R1.25 Nc1cccc(c1F)SCCO 62a_100011935091_100000211926 [0,2,0,0,0,0|2,0,0]=4 10929 B12R1.25 Nc1cccc(c1N)OCCF 34a_100000033209_100011217306 [0,2,0,0,0,0|2,0,0]=4 10930 B12R1.25 Nc1cccc(c1N)OCCO 34a_100000033209_100000211926 [0,2,0,0,0,0|2,0,0]=4 10931 B12R1.25 Nc1cccc(c1N)SCCF 62a_100015191791_100011217306 [0,2,0,0,0,0|2,0,0]=4 10932 B12R1.25 Nc1cccc(c1N)SCCO 62a_100015191791_100000211926 [0,2,0,0,0,0|2,0,0]=4 10933 B12R1.25 Nc1cccc(c1O)SCC=O 62a_100011934915_200015260668 [0,2,0,0,0,0|1,0,1]=4 10934 B12R1.25 Nc1cccc(c1O)SCC=O 62a_200015260668_100010084371 [0,2,0,0,0,0|1,0,1]=4 10935 B12R1.25 Nc1cccc(c1O)SCCF 62a_100011217306_100010084371 [0,2,0,0,0,0|1,0,0]=3 10936 B12R1.25 Nc1cccc(c1O)SCCF 62a_100011934915_100011217306 [0,2,0,0,0,0|1,0,0]=3 10937 B12R1.25 Nc1cccc(c1O)SCCO 62a_100000211926_100010084371 [0,2,0,0,0,0|1,0,0]=3 10938 B12R1.25 Nc1cccc(c1O)SCCO 62a_100011934915_100000211926 [0,2,0,0,0,0|1,0,0]=3 10939 B12R1.25 Nc1ccnc(c1O)SCCF 62a_100011217306_100009844647 [0,2,0,0,0,0|2,0,0]=4 10940 B12R1.25 Nc1ccnc(c1O)SCCO 62a_100000211926_100009844647 [0,2,0,0,0,0|2,0,0]=4 10941 B12R1.25 Nc1cncc(c1O)SCCF 62a_100000694263_100011217306 [0,2,0,0,0,0|2,0,0]=4 10942 B12R1.25 Nc1cncc(c1O)SCCF 62a_100011217306_100000694263 [0,2,0,0,0,0|2,0,0]=4 10943 B12R1.25 Nc1cncc(c1O)SCCO 62a_100000211926_100000694263 [0,2,0,0,0,0|2,0,0]=4 10944 B12R1.25 Nc1cncc(c1O)SCCO 62a_100000694263_100000211926 [0,2,0,0,0,0|2,0,0]=4 10945 B12R1.25 O=CCNc1cccc(c1O)Br 34a_100011934915_200009817547 [0,2,0,0,0,0|1,0,1]=4 10946 B12R1.25 O=CCNc1cccc(c1O)Cl 34a_100000754742_200009817547 [0,2,0,0,0,0|1,0,1]=4 10947 B12R1.25 O=CCNc1cccc(c1O)F 34a_100011934987_200009817547 [0,2,0,0,0,0|1,0,1]=4 10948 B12R1.25 O=CCSc1cccc(c1O)Br 62a_100010084509_200015260668 [0,2,0,0,0,0|1,0,1]=4 10949 B12R1.25 O=CCSc1cccc(c1O)Br 62a_200015260668_100010084509 [0,2,0,0,0,0|1,0,1]=4 10950 B12R1.25 O=CCSc1cccc(c1O)Cl 62a_100010202889_200015260668 [0,2,0,0,0,0|1,0,1]=4 10951 B12R1.25 O=CCSc1cccc(c1O)Cl 62a_200015260668_100010202889 [0,2,0,0,0,0|1,0,1]=4 10952 B12R1.25 O=CCSc1cccc(c1O)F 62a_100009813666_200015260668 [0,2,0,0,0,0|1,0,1]=4 10953 B12R1.25 O=CCSc1cccc(c1O)F 62a_200015260668_100009813666 [0,2,0,0,0,0|1,0,1]=4 10954 B12R1.25 O=CCSc1cccc(c1O)O 62a_200015260668_100009815950 [0,2,0,0,0,0|1,0,1]=4 10955 B12R1.25 OCCNc1cccc(c1Br)Cl 34a_100000687072_100000211926 [0,2,0,0,0,0|2,0,0]=4 10956 B12R1.25 OCCNc1cccc(c1Br)F 34a_100011934729_100000211926 [0,2,0,0,0,0|2,0,0]=4 10957 B12R1.25 OCCNc1cccc(c1Br)O 34a_100012183704_100000211926 [0,2,0,0,0,0|2,0,0]=4 10958 B12R1.25 OCCNc1cccc(c1Br)O 7a_100012183704_100000211926 [0,2,0,0,0,0|2,0,0]=4 10959 B12R1.25 OCCNc1cccc(c1Cl)Br 34a_100000687075_100000211926 [0,2,0,0,0,0|2,0,0]=4 10960 B12R1.25 OCCNc1cccc(c1Cl)Cl 34a_100000185733_100000211926 [0,2,0,0,0,0|2,0,0]=4 10961 B12R1.25 OCCNc1cccc(c1Cl)F 34a_100000692321_100000211926 [0,2,0,0,0,0|2,0,0]=4 10962 B12R1.25 OCCNc1cccc(c1Cl)O 34a_100012002038_100000211926 [0,2,0,0,0,0|2,0,0]=4 10963 B12R1.25 OCCNc1cccc(c1Cl)O 7a_100012002038_100000211926 [0,2,0,0,0,0|2,0,0]=4 10964 B12R1.25 OCCNc1cccc(c1F)Br 2230a_100011935091_100000211926 [0,2,0,0,0,0|2,0,0]=4 10965 B12R1.25 OCCNc1cccc(c1F)Br 34a_100011935091_100000211926 [0,2,0,0,0,0|2,0,0]=4 10966 B12R1.25 OCCNc1cccc(c1F)Cl 2230a_100000199060_100000211926 [0,2,0,0,0,0|2,0,0]=4 10967 B12R1.25 OCCNc1cccc(c1F)Cl 34a_100000199060_100000211926 [0,2,0,0,0,0|2,0,0]=4 10968 B12R1.25 OCCNc1cccc(c1F)F 34a_100000743855_100000211926 [0,2,0,0,0,0|2,0,0]=4 10969 B12R1.25 OCCNc1cccc(c1I)Br 34a_100020590159_100000211926 [0,2,0,0,0,0|2,0,0]=4 10970 B12R1.25 OCCNc1cccc(c1I)Cl 34a_100000049713_100000211926 [0,2,0,0,0,0|2,0,0]=4 10971 B12R1.25 OCCNc1cccc(c1I)F 34a_100000690935_100000211926 [0,2,0,0,0,0|2,0,0]=4 10972 B12R1.25 OCCNc1cccc(c1O)Br 34a_100011934915_100000211926 [0,2,0,0,0,0|1,0,0]=3 10973 B12R1.25 OCCNc1cccc(c1O)Cl 34a_100000754742_100000211926 [0,2,0,0,0,0|1,0,0]=3 10974 B12R1.25 OCCNc1cccc(c1O)F 34a_100011934987_100000211926 [0,2,0,0,0,0|1,0,0]=3 10975 B12R1.25 OCCOc1cccc(c1Br)Br 34a_100010187966_100000211926 [0,2,0,0,0,0|2,0,0]=4 10976 B12R1.25 OCCOc1cccc(c1Br)Br 7a_100010187966_100000211926 [0,2,0,0,0,0|2,0,0]=4 10977 B12R1.25 OCCOc1cccc(c1Br)Cl 34a_100012348804_100000211926 [0,2,0,0,0,0|2,0,0]=4 10978 B12R1.25 OCCOc1cccc(c1Br)Cl 7a_100012348804_100000211926 [0,2,0,0,0,0|2,0,0]=4 10979 B12R1.25 OCCOc1cccc(c1Br)F 34a_100009820682_100000211926 [0,2,0,0,0,0|2,0,0]=4 10980 B12R1.25 OCCOc1cccc(c1Br)F 7a_100009820682_100000211926 [0,2,0,0,0,0|2,0,0]=4 10981 B12R1.25 OCCOc1cccc(c1Br)I 34a_100010187914_100000211926 [0,2,0,0,0,0|2,0,0]=4 10982 B12R1.25 OCCOc1cccc(c1Br)I 7a_100010187914_100000211926 [0,2,0,0,0,0|2,0,0]=4 10983 B12R1.25 OCCOc1cccc(c1Cl)Br 34a_100010187913_100000211926 [0,2,0,0,0,0|2,0,0]=4 10984 B12R1.25 OCCOc1cccc(c1Cl)Br 7a_100010187913_100000211926 [0,2,0,0,0,0|2,0,0]=4 10985 B12R1.25 OCCOc1cccc(c1Cl)Cl 34a_100000211076_100000211926 [0,2,0,0,0,0|2,0,0]=4 10986 B12R1.25 OCCOc1cccc(c1Cl)Cl 7a_100000211076_100000211926 [0,2,0,0,0,0|2,0,0]=4 10987 B12R1.25 OCCOc1cccc(c1Cl)F 34a_100000087408_100000211926 [0,2,0,0,0,0|2,0,0]=4 10988 B12R1.25 OCCOc1cccc(c1Cl)F 7a_100000087408_100000211926 [0,2,0,0,0,0|2,0,0]=4 10989 B12R1.25 OCCOc1cccc(c1Cl)I 34a_100000049636_100000211926 [0,2,0,0,0,0|2,0,0]=4 10990 B12R1.25 OCCOc1cccc(c1Cl)I 7a_100000049636_100000211926 [0,2,0,0,0,0|2,0,0]=4 10991 B12R1.25 OCCOc1cccc(c1F)Br 34a_100009817021_100000211926 [0,2,0,0,0,0|2,0,0]=4 10992 B12R1.25 OCCOc1cccc(c1F)Br 7a_100009817021_100000211926 [0,2,0,0,0,0|2,0,0]=4 10993 B12R1.25 OCCOc1cccc(c1F)Cl 34a_100000687438_100000211926 [0,2,0,0,0,0|2,0,0]=4 10994 B12R1.25 OCCOc1cccc(c1F)Cl 7a_100000687438_100000211926 [0,2,0,0,0,0|2,0,0]=4 10995 B12R1.25 OCCOc1cccc(c1F)F 34a_100000751161_100000211926 [0,2,0,0,0,0|2,0,0]=4 10996 B12R1.25 OCCOc1cccc(c1F)F 7a_100000751161_100000211926 [0,2,0,0,0,0|2,0,0]=4 10997 B12R1.25 OCCOc1cccc(c1I)Br 34a_100010187912_100000211926 [0,2,0,0,0,0|2,0,0]=4 10998 B12R1.25 OCCOc1cccc(c1I)Br 7a_100010187912_100000211926 [0,2,0,0,0,0|2,0,0]=4 10999 B12R1.25 OCCOc1cccc(c1I)Cl 34a_100000050174_100000211926 [0,2,0,0,0,0|2,0,0]=4 11000 B12R1.25 OCCOc1cccc(c1I)Cl 7a_100000050174_100000211926 [0,2,0,0,0,0|2,0,0]=4 11001 B12R1.25 OCCOc1cccc(c1I)F 34a_100000690913_100000211926 [0,2,0,0,0,0|2,0,0]=4 11002 B12R1.25 OCCOc1cccc(c1I)F 7a_100000690913_100000211926 [0,2,0,0,0,0|2,0,0]=4 11003 B12R1.25 OCCSc1cccc(c1Br)Br 62a_100000211926_100010175083 [0,2,0,0,0,0|2,0,0]=4 11004 B12R1.25 OCCSc1cccc(c1Br)Br 62a_100010175083_100000211926 [0,2,0,0,0,0|2,0,0]=4 11005 B12R1.25 OCCSc1cccc(c1Br)Cl 62a_100000211926_100014021842 [0,2,0,0,0,0|2,0,0]=4 11006 B12R1.25 OCCSc1cccc(c1Br)Cl 62a_100014021842_100000211926 [0,2,0,0,0,0|2,0,0]=4 11007 B12R1.25 OCCSc1cccc(c1Br)F 62a_100000211926_100010202630 [0,2,0,0,0,0|2,0,0]=4 11008 B12R1.25 OCCSc1cccc(c1Br)F 62a_100010202630_100000211926 [0,2,0,0,0,0|2,0,0]=4 11009 B12R1.25 OCCSc1cccc(c1Br)O 62a_100000211926_100010187914 [0,2,0,0,0,0|2,0,0]=4 11010 B12R1.25 OCCSc1cccc(c1Br)O 62a_100010187914_100000211926 [0,2,0,0,0,0|2,0,0]=4 11011 B12R1.25 OCCSc1cccc(c1Cl)Br 62a_100000211926_100010142854 [0,2,0,0,0,0|2,0,0]=4 11012 B12R1.25 OCCSc1cccc(c1Cl)Br 62a_100010142854_100000211926 [0,2,0,0,0,0|2,0,0]=4 11013 B12R1.25 OCCSc1cccc(c1Cl)Cl 62a_100000211926_100011215384 [0,2,0,0,0,0|2,0,0]=4 11014 B12R1.25 OCCSc1cccc(c1Cl)Cl 62a_100011215384_100000211926 [0,2,0,0,0,0|2,0,0]=4 11015 B12R1.25 OCCSc1cccc(c1Cl)F 62a_100000211926_200010234923 [0,2,0,0,0,0|2,0,0]=4 11016 B12R1.25 OCCSc1cccc(c1Cl)F 62a_200010234923_100000211926 [0,2,0,0,0,0|2,0,0]=4 11017 B12R1.25 OCCSc1cccc(c1Cl)O 62a_100000211926_100000049636 [0,2,0,0,0,0|2,0,0]=4 11018 B12R1.25 OCCSc1cccc(c1F)Br 62a_100000211926_100000702267 [0,2,0,0,0,0|2,0,0]=4 11019 B12R1.25 OCCSc1cccc(c1F)Br 62a_100000702267_100000211926 [0,2,0,0,0,0|2,0,0]=4 11020 B12R1.25 OCCSc1cccc(c1F)Cl 62a_100000211926_100011217346 [0,2,0,0,0,0|2,0,0]=4 11021 B12R1.25 OCCSc1cccc(c1F)Cl 62a_100011217346_100000211926 [0,2,0,0,0,0|2,0,0]=4 11022 B12R1.25 OCCSc1cccc(c1F)F 62a_100000211926_100000694657 [0,2,0,0,0,0|2,0,0]=4 11023 B12R1.25 OCCSc1cccc(c1F)F 62a_100000694657_100000211926 [0,2,0,0,0,0|2,0,0]=4 11024 B12R1.25 OCCSc1cccc(c1F)O 62a_100000211926_100009817021 [0,2,0,0,0,0|2,0,0]=4 11025 B12R1.25 OCCSc1cccc(c1F)O 62a_100009817021_100000211926 [0,2,0,0,0,0|2,0,0]=4 11026 B12R1.25 OCCSc1cccc(c1O)Br 62a_100000211926_100010084509 [0,2,0,0,0,0|1,0,0]=3 11027 B12R1.25 OCCSc1cccc(c1O)Br 62a_100010084509_100000211926 [0,2,0,0,0,0|1,0,0]=3 11028 B12R1.25 OCCSc1cccc(c1O)Cl 62a_100000211926_100010202889 [0,2,0,0,0,0|1,0,0]=3 11029 B12R1.25 OCCSc1cccc(c1O)Cl 62a_100010202889_100000211926 [0,2,0,0,0,0|1,0,0]=3 11030 B12R1.25 OCCSc1cccc(c1O)F 62a_100000211926_100009813666 [0,2,0,0,0,0|1,0,0]=3 11031 B12R1.25 OCCSc1cccc(c1O)F 62a_100009813666_100000211926 [0,2,0,0,0,0|1,0,0]=3 11032 B12R1.25 OCCSc1cccc(c1O)O 62a_100000211926_100009815950 [0,2,0,0,0,0|1,0,0]=3 11033 B12R1.25 OCCSc1ccnc(c1O)Cl 62a_100000211926_100010067911 [0,2,0,0,0,0|2,0,0]=4 11034 B12R1.25 OCCSc1nccc(c1O)F 62a_100000211926_100009867227 [0,2,0,0,0,0|2,0,0]=4 11035 B12R1.25 Oc1c(cccc1NCCF)Br 34a_100011934915_100011217306 [0,2,0,0,0,0|1,0,0]=3 11036 B12R1.25 Oc1c(cccc1NCCF)Cl 34a_100000754742_100011217306 [0,2,0,0,0,0|1,0,0]=3 11037 B12R1.25 Oc1c(cccc1NCCF)F 34a_100011934987_100011217306 [0,2,0,0,0,0|1,0,0]=3 11038 B12R1.25 Oc1c(cccc1SCCF)Br 62a_100010084509_100011217306 [0,2,0,0,0,0|1,0,0]=3 11039 B12R1.25 Oc1c(cccc1SCCF)Br 62a_100011217306_100010084509 [0,2,0,0,0,0|1,0,0]=3 11040 B12R1.25 Oc1c(cccc1SCCF)Cl 62a_100010202889_100011217306 [0,2,0,0,0,0|1,0,0]=3 11041 B12R1.25 Oc1c(cccc1SCCF)Cl 62a_100011217306_100010202889 [0,2,0,0,0,0|1,0,0]=3 11042 B12R1.25 Oc1c(cccc1SCCF)F 62a_100009813666_100011217306 [0,2,0,0,0,0|1,0,0]=3 11043 B12R1.25 Oc1c(cccc1SCCF)F 62a_100011217306_100009813666 [0,2,0,0,0,0|1,0,0]=3 11044 B12R1.25 Oc1c(ccnc1Cl)SCCF 62a_100011217306_100010067911 [0,2,0,0,0,0|2,0,0]=4 11045 B12R1.25 Oc1c(ccnc1SCCF)F 62a_100011217306_100009867227 [0,2,0,0,0,0|2,0,0]=4 11046 B12R1.25 Oc1cccc(c1Br)NCCF 34a_100012183704_100011217306 [0,2,0,0,0,0|2,0,0]=4 11047 B12R1.25 Oc1cccc(c1Br)NCCF 7a_100012183704_100011217306 [0,2,0,0,0,0|2,0,0]=4 11048 B12R1.25 Oc1cccc(c1Br)SCCF 62a_100010187914_100011217306 [0,2,0,0,0,0|2,0,0]=4 11049 B12R1.25 Oc1cccc(c1Br)SCCF 62a_100011217306_100010187914 [0,2,0,0,0,0|2,0,0]=4 11050 B12R1.25 Oc1cccc(c1Cl)NCCF 34a_100012002038_100011217306 [0,2,0,0,0,0|2,0,0]=4 11051 B12R1.25 Oc1cccc(c1Cl)NCCF 7a_100012002038_100011217306 [0,2,0,0,0,0|2,0,0]=4 11052 B12R1.25 Oc1cccc(c1Cl)SCCF 62a_100011217306_100000049636 [0,2,0,0,0,0|2,0,0]=4 11053 B12R1.25 Oc1cccc(c1F)CNCF 34a_100025773512_100015361967 [0,2,0,0,0,0|2,0,0]=4 11054 B12R1.25 Oc1cccc(c1F)SCCF 62a_100009817021_100011217306 [0,2,0,0,0,0|2,0,0]=4 11055 B12R1.25 Oc1cccc(c1F)SCCF 62a_100011217306_100009817021 [0,2,0,0,0,0|2,0,0]=4 11056 B12R1.25 Oc1cccc(c1O)SCCF 62a_100011217306_100009815950 [0,2,0,0,0,0|1,0,0]=3 11057 B12R1.25 [13CH3]NCCc1cccc(c1Cl)Cl 2230a_100000741019_200025704644 [0,2,0,0,0,0|1,0,0]=3 11058 B12R1.25 [13CH3]NCCc1cccc(c1Cl)Cl 34a_100000741019_200025704644 [0,2,0,0,0,0|1,0,0]=3 11059 B12R1.25 [13CH3]OCCc1cccc(c1Cl)Cl 34a_100011754357_200025704644 [0,2,0,0,0,0|1,0,0]=3 11060 B12R1.25 [13CH3]OCCc1cccc(c1Cl)Cl 7a_100011754357_200025704644 [0,2,0,0,0,0|1,0,0]=3 11061 B12R1.25 [13CH3]OCCc1cccc(c1F)Cl 34a_100011830271_200025704644 [0,2,0,0,0,0|1,0,0]=3 11062 B12R1.25 [13CH3]OCCc1cccc(c1F)Cl 7a_100011830271_200025704644 [0,2,0,0,0,0|1,0,0]=3 11063 B12R1.25 [13CH3]OCCc1cccc(c1F)F 34a_100000698707_200025704644 [0,2,0,0,0,0|1,0,0]=3 11064 B12R1.25 [13CH3]OCCc1cccc(c1F)F 7a_100000698707_200025704644 [0,2,0,0,0,0|1,0,0]=3 11065 B12R1.25 [13CH3]SCCc1cccc(c1Cl)Cl 62a_100000723033_200025704644 [0,2,0,0,0,0|1,0,0]=3 11066 B12R1.25 [13CH3]SCCc1cccc(c1Cl)Cl 62a_200025704644_100000723033 [0,2,0,0,0,0|1,0,0]=3 11067 B12R1.40 CC=Cc1cc(cc(c1O)Br)F 271570a_100016259895_200013085147 [0,2,0,0,0,0|0,0,2]=4 11068 B12R1.40 CC=Cc1cc(cc(c1O)C)C 271570a_100016259895_100011934984 [0,2,0,0,0,0|0,0,2]=4 11069 B12R1.40 CC=Cc1cc(cc(c1O)C)Cl 271570a_100016259895_100012343667 [0,2,0,0,0,0|0,0,2]=4 11070 B12R1.40 CC=Cc1cc(cc(c1O)C)N 271570a_100016259895_100010064301 [0,2,0,0,0,0|0,0,2]=4 11071 B12R1.40 CC=Cc1cc(cc(c1O)Cl)Cl 271570a_100016259895_200012339341 [0,2,0,0,0,0|0,0,2]=4 11072 B12R1.40 CC=Cc1cc(cc(c1O)F)Br 271570a_100016259895_100013354677 [0,2,0,0,0,0|0,0,2]=4 11073 B12R1.40 CC=Cc1cc(cc(c1O)F)C 271570a_100016259895_200135191068 [0,2,0,0,0,0|0,0,2]=4 11074 B12R1.40 CC=Cc1cc(cc(c1O)F)F 271570a_100016259895_100000688693 [0,2,0,0,0,0|0,0,2]=4 11075 B12R1.40 CC=Cc1cc(cc(c1O)N)F 271570a_100016259895_200011217456 [0,2,0,0,0,0|0,0,2]=4 11076 B12R1.40 CCNc1cc(cc(c1Br)Cl)Cl 34a_200010220950_100000210202 [0,2,0,0,0,0|2,0,0]=4 11077 B12R1.40 CCNc1cc(cc(c1Br)Cl)Cl 7a_200010220950_100000210202 [0,2,0,0,0,0|2,0,0]=4 11078 B12R1.40 CCNc1cc(cc(c1Br)F)F 34a_100000716482_100000210202 [0,2,0,0,0,0|2,0,0]=4 11079 B12R1.40 CCNc1cc(cc(c1Br)F)F 7a_100000716482_100000210202 [0,2,0,0,0,0|2,0,0]=4 11080 B12R1.40 CCNc1cc(cc(c1C)Br)Br 34a_100010206801_100000210202 [0,2,0,0,0,0|2,0,0]=4 11081 B12R1.40 CCNc1cc(cc(c1C)Br)Br 7a_100010206801_100000210202 [0,2,0,0,0,0|2,0,0]=4 11082 B12R1.40 CCNc1cc(cc(c1C)Br)C 2230a_102495365385_100000210202 [0,2,0,0,0,0|2,0,0]=4 11083 B12R1.40 CCNc1cc(cc(c1C)Br)C 34a_102495365385_100000210202 [0,2,0,0,0,0|2,0,0]=4 11084 B12R1.40 CCNc1cc(cc(c1C)Br)C 7a_102495365385_100000210202 [0,2,0,0,0,0|2,0,0]=4 11085 B12R1.40 CCNc1cc(cc(c1C)Br)Cl 34a_100010063005_100000210202 [0,2,0,0,0,0|2,0,0]=4 11086 B12R1.40 CCNc1cc(cc(c1C)Br)Cl 7a_100010063005_100000210202 [0,2,0,0,0,0|2,0,0]=4 11087 B12R1.40 CCNc1cc(cc(c1C)Br)F 34a_100009814351_100000210202 [0,2,0,0,0,0|2,0,0]=4 11088 B12R1.40 CCNc1cc(cc(c1C)Br)F 7a_100009814351_100000210202 [0,2,0,0,0,0|2,0,0]=4 11089 B12R1.40 CCNc1cc(cc(c1C)C)C 2230a_100000035412_100000210202 [0,2,0,0,0,0|2,0,0]=4 11090 B12R1.40 CCNc1cc(cc(c1C)C)C 34a_100000035412_100000210202 [0,2,0,0,0,0|2,0,0]=4 11091 B12R1.40 CCNc1cc(cc(c1C)C)C 7a_100000035412_100000210202 [0,2,0,0,0,0|2,0,0]=4 11092 B12R1.40 CCNc1cc(cc(c1C)Cl)Cl 34a_200009956477_100000210202 [0,2,0,0,0,0|2,0,0]=4 11093 B12R1.40 CCNc1cc(cc(c1C)Cl)Cl 7a_200009956477_100000210202 [0,2,0,0,0,0|2,0,0]=4 11094 B12R1.40 CCNc1cc(cc(c1C)F)Br 34a_100009813729_100000210202 [0,2,0,0,0,0|2,0,0]=4 11095 B12R1.40 CCNc1cc(cc(c1C)F)Br 7a_100009813729_100000210202 [0,2,0,0,0,0|2,0,0]=4 11096 B12R1.40 CCNc1cc(cc(c1C)I)Cl 34a_200000050010_100000210202 [0,2,0,0,0,0|2,0,0]=4 11097 B12R1.40 CCNc1cc(cc(c1C)I)Cl 7a_200000050010_100000210202 [0,2,0,0,0,0|2,0,0]=4 11098 B12R1.40 CCNc1cc(cc(c1Cl)Cl)Cl 34a_106623411496_100000210202 [0,2,0,0,0,0|2,0,0]=4 11099 B12R1.40 CCNc1cc(cc(c1Cl)Cl)Cl 7a_106623411496_100000210202 [0,2,0,0,0,0|2,0,0]=4 11100 B12R1.40 CCNc1cc(cc(c1Cl)F)F 34a_100000037168_100000210202 [0,2,0,0,0,0|2,0,0]=4 11101 B12R1.40 CCNc1cc(cc(c1Cl)F)F 7a_100000037168_100000210202 [0,2,0,0,0,0|2,0,0]=4 11102 B12R1.40 CCNc1cc(cc(c1F)Br)C 2230a_100010589139_100000210202 [0,2,0,0,0,0|2,0,0]=4 11103 B12R1.40 CCNc1cc(cc(c1F)Br)C 34a_100010589139_100000210202 [0,2,0,0,0,0|2,0,0]=4 11104 B12R1.40 CCNc1cc(cc(c1F)Br)C 7a_100010589139_100000210202 [0,2,0,0,0,0|2,0,0]=4 11105 B12R1.40 CCNc1cc(cc(c1F)Br)Cl 34a_100010110407_100000210202 [0,2,0,0,0,0|2,0,0]=4 11106 B12R1.40 CCNc1cc(cc(c1F)Br)Cl 7a_100010110407_100000210202 [0,2,0,0,0,0|2,0,0]=4 11107 B12R1.40 CCNc1cc(cc(c1F)Br)F 34a_100000722353_100000210202 [0,2,0,0,0,0|2,0,0]=4 11108 B12R1.40 CCNc1cc(cc(c1F)Br)F 7a_100000722353_100000210202 [0,2,0,0,0,0|2,0,0]=4 11109 B12R1.40 CCNc1cc(cc(c1F)C)Br 34a_100010381932_100000210202 [0,2,0,0,0,0|2,0,0]=4 11110 B12R1.40 CCNc1cc(cc(c1F)C)Br 7a_100010381932_100000210202 [0,2,0,0,0,0|2,0,0]=4 11111 B12R1.40 CCNc1cc(cc(c1F)Cl)Cl 34a_100010713094_100000210202 [0,2,0,0,0,0|2,0,0]=4 11112 B12R1.40 CCNc1cc(cc(c1F)Cl)Cl 7a_100010713094_100000210202 [0,2,0,0,0,0|2,0,0]=4 11113 B12R1.40 CCNc1cc(cc(c1F)F)F 34a_100000037171_100000210202 [0,2,0,0,0,0|2,0,0]=4 11114 B12R1.40 CCNc1cc(cc(c1F)F)F 7a_100000037171_100000210202 [0,2,0,0,0,0|2,0,0]=4 11115 B12R1.40 CCNc1cc(cc(c1I)Br)F 34a_200010740111_100000210202 [0,2,0,0,0,0|2,0,0]=4 11116 B12R1.40 CCNc1cc(cc(c1I)C)Cl 34a_100000698757_100000210202 [0,2,0,0,0,0|2,0,0]=4 11117 B12R1.40 CCNc1cc(cc(c1I)C)Cl 7a_100000698757_100000210202 [0,2,0,0,0,0|2,0,0]=4 11118 B12R1.40 CCNc1cc(cc(c1I)F)C 34a_100021129147_100000210202 [0,2,0,0,0,0|2,0,0]=4 11119 B12R1.40 CCNc1cc(cc(c1I)F)C 7a_100021129147_100000210202 [0,2,0,0,0,0|2,0,0]=4 11120 B12R1.40 CCNc1cc(cc(c1I)F)Cl 34a_200021297760_100000210202 [0,2,0,0,0,0|2,0,0]=4 11121 B12R1.40 CCNc1cc(cc(c1I)F)Cl 7a_200021297760_100000210202 [0,2,0,0,0,0|2,0,0]=4 11122 B12R1.40 CCNc1cc(cc(c1I)F)F 34a_100016149863_100000210202 [0,2,0,0,0,0|2,0,0]=4 11123 B12R1.40 CCNc1cc(cc(c1I)F)F 7a_100016149863_100000210202 [0,2,0,0,0,0|2,0,0]=4 11124 B12R1.40 CCNc1cc(cc(c1O)Br)Br 34a_100010781877_100000210202 [0,2,0,0,0,0|1,0,0]=3 11125 B12R1.40 CCNc1cc(cc(c1O)Br)Cl 34a_106741647128_100000210202 [0,2,0,0,0,0|1,0,0]=3 11126 B12R1.40 CCNc1cc(cc(c1O)Br)F 34a_200011217456_100000210202 [0,2,0,0,0,0|1,0,0]=3 11127 B12R1.40 CCNc1cc(cc(c1O)C)Br 34a_100011825904_100000210202 [0,2,0,0,0,0|1,0,0]=3 11128 B12R1.40 CCNc1cc(cc(c1O)C)Br 7a_100011825904_100000210202 [0,2,0,0,0,0|1,0,0]=3 11129 B12R1.40 CCNc1cc(cc(c1O)C)C 34a_100011216242_100000210202 [0,2,0,0,0,0|1,0,0]=3 11130 B12R1.40 CCNc1cc(cc(c1O)C)C 7a_100011216242_100000210202 [0,2,0,0,0,0|1,0,0]=3 11131 B12R1.40 CCNc1cc(cc(c1O)C)F 34a_100000130126_100000210202 [0,2,0,0,0,0|1,0,0]=3 11132 B12R1.40 CCNc1cc(cc(c1O)C)F 7a_100000130126_100000210202 [0,2,0,0,0,0|1,0,0]=3 11133 B12R1.40 CCNc1cc(cc(c1O)Cl)Br 34a_100000694353_100000210202 [0,2,0,0,0,0|1,0,0]=3 11134 B12R1.40 CCNc1cc(cc(c1O)Cl)Cl 34a_100000695819_100000210202 [0,2,0,0,0,0|1,0,0]=3 11135 B12R1.40 CCNc1cc(cc(c1O)F)Br 34a_100011217383_100000210202 [0,2,0,0,0,0|1,0,0]=3 11136 B12R1.40 CCNc1cc(cc(c1O)F)Br 7a_100011217383_100000210202 [0,2,0,0,0,0|1,0,0]=3 11137 B12R1.40 CCNc1cc(cc(c1O)F)F 34a_100015205836_100000210202 [0,2,0,0,0,0|1,0,0]=3 11138 B12R1.40 CCOc1cc(cc(c1Br)C)C 34a_100010342985_100000210202 [0,2,0,0,0,0|2,0,0]=4 11139 B12R1.40 CCOc1cc(cc(c1Br)C)C 7a_100010342985_100000210202 [0,2,0,0,0,0|2,0,0]=4 11140 B12R1.40 CCOc1cc(cc(c1Br)F)Cl 34a_100015539415_100000210202 [0,2,0,0,0,0|2,0,0]=4 11141 B12R1.40 CCOc1cc(cc(c1Br)F)Cl 7a_100015539415_100000210202 [0,2,0,0,0,0|2,0,0]=4 11142 B12R1.40 CCOc1cc(cc(c1Br)F)F 34a_100009815984_100000210202 [0,2,0,0,0,0|2,0,0]=4 11143 B12R1.40 CCOc1cc(cc(c1Br)F)F 7a_100009815984_100000210202 [0,2,0,0,0,0|2,0,0]=4 11144 B12R1.40 CCOc1cc(cc(c1C)C)C 34a_100000230004_100000210202 [0,2,0,0,0,0|2,0,0]=4 11145 B12R1.40 CCOc1cc(cc(c1C)C)C 7a_100000230004_100000210202 [0,2,0,0,0,0|2,0,0]=4 11146 B12R1.40 CCOc1cc(cc(c1Cl)C)C 34a_100000094344_100000210202 [0,2,0,0,0,0|2,0,0]=4 11147 B12R1.40 CCOc1cc(cc(c1Cl)C)C 7a_100000094344_100000210202 [0,2,0,0,0,0|2,0,0]=4 11148 B12R1.40 CCOc1cc(cc(c1Cl)Cl)N 34a_100015839415_100000210202 [0,2,0,0,0,0|2,0,0]=4 11149 B12R1.40 CCOc1cc(cc(c1Cl)Cl)N 7a_100015839415_100000210202 [0,2,0,0,0,0|2,0,0]=4 11150 B12R1.40 CCOc1cc(cc(c1Cl)F)Br 34a_100010981968_100000210202 [0,2,0,0,0,0|2,0,0]=4 11151 B12R1.40 CCOc1cc(cc(c1Cl)F)Br 7a_100010981968_100000210202 [0,2,0,0,0,0|2,0,0]=4 11152 B12R1.40 CCOc1cc(cc(c1Cl)F)F 34a_200000037661_100000210202 [0,2,0,0,0,0|2,0,0]=4 11153 B12R1.40 CCOc1cc(cc(c1Cl)F)F 7a_200000037661_100000210202 [0,2,0,0,0,0|2,0,0]=4 11154 B12R1.40 CCOc1cc(cc(c1F)Cl)Br 34a_100010077842_100000210202 [0,2,0,0,0,0|2,0,0]=4 11155 B12R1.40 CCOc1cc(cc(c1F)Cl)Br 7a_100010077842_100000210202 [0,2,0,0,0,0|2,0,0]=4 11156 B12R1.40 CCOc1cc(cc(c1F)F)Br 34a_100000709865_100000210202 [0,2,0,0,0,0|2,0,0]=4 11157 B12R1.40 CCOc1cc(cc(c1F)F)Br 7a_100000709865_100000210202 [0,2,0,0,0,0|2,0,0]=4 11158 B12R1.40 CCOc1cc(cc(c1F)F)F 34a_200011215507_100000210202 [0,2,0,0,0,0|2,0,0]=4 11159 B12R1.40 CCOc1cc(cc(c1F)F)F 7a_200011215507_100000210202 [0,2,0,0,0,0|2,0,0]=4 11160 B12R1.40 CCOc1cc(cc(c1F)F)O 271570a_203496583355_200012359421 [0,2,0,0,0,0|2,0,0]=4 11161 B12R1.40 CCOc1cc(cc(c1I)C)Cl 34a_100010254216_100000210202 [0,2,0,0,0,0|2,0,0]=4 11162 B12R1.40 CCOc1cc(cc(c1I)C)Cl 7a_100010254216_100000210202 [0,2,0,0,0,0|2,0,0]=4 11163 B12R1.40 CCOc1cc(cc(c1N)Br)Cl 34a_100015696055_100000210202 [0,2,0,0,0,0|2,0,0]=4 11164 B12R1.40 CCOc1cc(cc(c1N)Br)Cl 7a_100015696055_100000210202 [0,2,0,0,0,0|2,0,0]=4 11165 B12R1.40 CCOc1cc(cc(c1N)C)Br 34a_100010371313_100000210202 [0,2,0,0,0,0|2,0,0]=4 11166 B12R1.40 CCOc1cc(cc(c1N)C)Br 7a_100010371313_100000210202 [0,2,0,0,0,0|2,0,0]=4 11167 B12R1.40 CCOc1cc(cc(c1N)Cl)C 34a_100015906060_100000210202 [0,2,0,0,0,0|2,0,0]=4 11168 B12R1.40 CCOc1cc(cc(c1N)Cl)C 7a_100015906060_100000210202 [0,2,0,0,0,0|2,0,0]=4 11169 B12R1.40 CCOc1cc(cc(c1N)F)Br 34a_100015475841_100000210202 [0,2,0,0,0,0|2,0,0]=4 11170 B12R1.40 CCOc1cc(cc(c1N)F)Br 7a_100015475841_100000210202 [0,2,0,0,0,0|2,0,0]=4 11171 B12R1.40 CCOc1cc(cc(c1N)F)Cl 34a_100010883250_100000210202 [0,2,0,0,0,0|2,0,0]=4 11172 B12R1.40 CCOc1cc(cc(c1N)F)Cl 7a_100010883250_100000210202 [0,2,0,0,0,0|2,0,0]=4 11173 B12R1.40 CCOc1cc(cc(c1N)F)F 34a_100011217947_100000210202 [0,2,0,0,0,0|2,0,0]=4 11174 B12R1.40 CCOc1cc(cc(c1N)F)F 7a_100011217947_100000210202 [0,2,0,0,0,0|2,0,0]=4 11175 B12R1.40 CCSc1cc(cc(c1Br)F)F 62a_100000210202_100010256416 [0,2,0,0,0,0|2,0,0]=4 11176 B12R1.40 CCSc1cc(cc(c1Br)F)F 62a_100010256416_100000210202 [0,2,0,0,0,0|2,0,0]=4 11177 B12R1.40 CCSc1cc(cc(c1C)C)N 62a_100000210202_100010368239 [0,2,0,0,0,0|2,0,0]=4 11178 B12R1.40 CCSc1cc(cc(c1C)C)N 62a_100010368239_100000210202 [0,2,0,0,0,0|2,0,0]=4 11179 B12R1.40 CCSc1cc(cc(c1C)C)O 62a_100000210202_100010068915 [0,2,0,0,0,0|2,0,0]=4 11180 B12R1.40 CCSc1cc(cc(c1C)C)O 62a_100010068915_100000210202 [0,2,0,0,0,0|2,0,0]=4 11181 B12R1.40 CCSc1cc(cc(c1C)F)C 62a_100000210202_100015473476 [0,2,0,0,0,0|2,0,0]=4 11182 B12R1.40 CCSc1cc(cc(c1C)F)C 62a_100015473476_100000210202 [0,2,0,0,0,0|2,0,0]=4 11183 B12R1.40 CCSc1cc(cc(c1C)F)F 62a_100000210202_100015579730 [0,2,0,0,0,0|2,0,0]=4 11184 B12R1.40 CCSc1cc(cc(c1C)F)F 62a_100015579730_100000210202 [0,2,0,0,0,0|2,0,0]=4 11185 B12R1.40 CCSc1cc(cc(c1C)F)N 62a_100000210202_100010254531 [0,2,0,0,0,0|2,0,0]=4 11186 B12R1.40 CCSc1cc(cc(c1C)F)N 62a_100010254531_100000210202 [0,2,0,0,0,0|2,0,0]=4 11187 B12R1.40 CCSc1cc(cc(c1C)N)C 62a_100000210202_102495365385 [0,2,0,0,0,0|2,0,0]=4 11188 B12R1.40 CCSc1cc(cc(c1C)N)C 62a_102495365385_100000210202 [0,2,0,0,0,0|2,0,0]=4 11189 B12R1.40 CCSc1cc(cc(c1C)N)Cl 62a_100000210202_200000050010 [0,2,0,0,0,0|2,0,0]=4 11190 B12R1.40 CCSc1cc(cc(c1C)N)Cl 62a_200000050010_100000210202 [0,2,0,0,0,0|2,0,0]=4 11191 B12R1.40 CCSc1cc(cc(c1C)N)F 62a_100000210202_100009814351 [0,2,0,0,0,0|2,0,0]=4 11192 B12R1.40 CCSc1cc(cc(c1C)N)F 62a_100009814351_100000210202 [0,2,0,0,0,0|2,0,0]=4 11193 B12R1.40 CCSc1cc(cc(c1Cl)Cl)Cl 62a_100000210202_200000042848 [0,2,0,0,0,0|2,0,0]=4 11194 B12R1.40 CCSc1cc(cc(c1Cl)Cl)Cl 62a_200000042848_100000210202 [0,2,0,0,0,0|2,0,0]=4 11195 B12R1.40 CCSc1cc(cc(c1F)C)C 62a_100000210202_200010204574 [0,2,0,0,0,0|2,0,0]=4 11196 B12R1.40 CCSc1cc(cc(c1F)C)C 62a_200010204574_100000210202 [0,2,0,0,0,0|2,0,0]=4 11197 B12R1.40 CCSc1cc(cc(c1F)C)F 62a_100000210202_100010291795 [0,2,0,0,0,0|2,0,0]=4 11198 B12R1.40 CCSc1cc(cc(c1F)C)F 62a_100010291795_100000210202 [0,2,0,0,0,0|2,0,0]=4 11199 B12R1.40 CCSc1cc(cc(c1F)Cl)Br 62a_100000210202_100010270166 [0,2,0,0,0,0|2,0,0]=4 11200 B12R1.40 CCSc1cc(cc(c1F)Cl)Br 62a_100010270166_100000210202 [0,2,0,0,0,0|2,0,0]=4 11201 B12R1.40 CCSc1cc(cc(c1F)F)C 62a_100000210202_100010141297 [0,2,0,0,0,0|2,0,0]=4 11202 B12R1.40 CCSc1cc(cc(c1F)F)C 62a_100010141297_100000210202 [0,2,0,0,0,0|2,0,0]=4 11203 B12R1.40 CCSc1cc(cc(c1F)F)F 62a_100000210202_100000724850 [0,2,0,0,0,0|2,0,0]=4 11204 B12R1.40 CCSc1cc(cc(c1F)F)F 62a_100000724850_100000210202 [0,2,0,0,0,0|2,0,0]=4 11205 B12R1.40 CCSc1cc(cc(c1F)F)N 62a_100000210202_100009816004 [0,2,0,0,0,0|2,0,0]=4 11206 B12R1.40 CCSc1cc(cc(c1F)F)N 62a_100009816004_100000210202 [0,2,0,0,0,0|2,0,0]=4 11207 B12R1.40 CCSc1cc(cc(c1F)N)C 62a_100000210202_100010589139 [0,2,0,0,0,0|2,0,0]=4 11208 B12R1.40 CCSc1cc(cc(c1F)N)C 62a_100010589139_100000210202 [0,2,0,0,0,0|2,0,0]=4 11209 B12R1.40 CCSc1cc(cc(c1F)N)F 62a_100000210202_100000722353 [0,2,0,0,0,0|2,0,0]=4 11210 B12R1.40 CCSc1cc(cc(c1F)N)F 62a_100000722353_100000210202 [0,2,0,0,0,0|2,0,0]=4 11211 B12R1.40 CCSc1cc(cc(c1N)Br)Cl 62a_100000210202_200012970264 [0,2,0,0,0,0|2,0,0]=4 11212 B12R1.40 CCSc1cc(cc(c1N)Br)Cl 62a_200012970264_100000210202 [0,2,0,0,0,0|2,0,0]=4 11213 B12R1.40 CCSc1cc(cc(c1N)C)Br 62a_100000210202_200000690823 [0,2,0,0,0,0|2,0,0]=4 11214 B12R1.40 CCSc1cc(cc(c1N)C)Br 62a_200000690823_100000210202 [0,2,0,0,0,0|2,0,0]=4 11215 B12R1.40 CCSc1cc(cc(c1N)C)C 62a_100000210202_100000688863 [0,2,0,0,0,0|2,0,0]=4 11216 B12R1.40 CCSc1cc(cc(c1N)C)C 62a_100000688863_100000210202 [0,2,0,0,0,0|2,0,0]=4 11217 B12R1.40 CCSc1cc(cc(c1N)C)Cl 62a_100000210202_100012344046 [0,2,0,0,0,0|2,0,0]=4 11218 B12R1.40 CCSc1cc(cc(c1N)C)Cl 62a_100012344046_100000210202 [0,2,0,0,0,0|2,0,0]=4 11219 B12R1.40 CCSc1cc(cc(c1N)C)F 62a_100000210202_100011216670 [0,2,0,0,0,0|2,0,0]=4 11220 B12R1.40 CCSc1cc(cc(c1N)C)F 62a_100011216670_100000210202 [0,2,0,0,0,0|2,0,0]=4 11221 B12R1.40 CCSc1cc(cc(c1N)Cl)Cl 62a_100000210202_100011216899 [0,2,0,0,0,0|2,0,0]=4 11222 B12R1.40 CCSc1cc(cc(c1N)Cl)Cl 62a_100011216899_100000210202 [0,2,0,0,0,0|2,0,0]=4 11223 B12R1.40 CCSc1cc(cc(c1N)F)Br 62a_100000210202_100012970276 [0,2,0,0,0,0|2,0,0]=4 11224 B12R1.40 CCSc1cc(cc(c1N)F)Br 62a_100012970276_100000210202 [0,2,0,0,0,0|2,0,0]=4 11225 B12R1.40 CCSc1cc(cc(c1N)F)C 62a_100000210202_100012353694 [0,2,0,0,0,0|2,0,0]=4 11226 B12R1.40 CCSc1cc(cc(c1N)F)C 62a_100012353694_100000210202 [0,2,0,0,0,0|2,0,0]=4 11227 B12R1.40 CCSc1cc(cc(c1N)F)Cl 62a_100000210202_100011214900 [0,2,0,0,0,0|2,0,0]=4 11228 B12R1.40 CCSc1cc(cc(c1N)F)Cl 62a_100011214900_100000210202 [0,2,0,0,0,0|2,0,0]=4 11229 B12R1.40 CCSc1cc(cc(c1N)F)F 62a_100000210202_100000211602 [0,2,0,0,0,0|2,0,0]=4 11230 B12R1.40 CCSc1cc(cc(c1N)F)F 62a_100000211602_100000210202 [0,2,0,0,0,0|2,0,0]=4 11231 B12R1.40 CCSc1cc(cc(c1N)N)C 62a_100000210202_100012348275 [0,2,0,0,0,0|2,0,0]=4 11232 B12R1.40 CCSc1cc(cc(c1N)N)C 62a_100012348275_100000210202 [0,2,0,0,0,0|2,0,0]=4 11233 B12R1.40 CCSc1cc(cc(c1N)N)F 62a_100000210202_100011934818 [0,2,0,0,0,0|2,0,0]=4 11234 B12R1.40 CCSc1cc(cc(c1N)N)F 62a_100011934818_100000210202 [0,2,0,0,0,0|2,0,0]=4 11235 B12R1.40 CCSc1cc(cc(c1O)Br)F 62a_100000210202_200013085147 [0,2,0,0,0,0|1,0,0]=3 11236 B12R1.40 CCSc1cc(cc(c1O)Br)F 62a_200013085147_100000210202 [0,2,0,0,0,0|1,0,0]=3 11237 B12R1.40 CCSc1cc(cc(c1O)C)C 62a_100000210202_100011934984 [0,2,0,0,0,0|1,0,0]=3 11238 B12R1.40 CCSc1cc(cc(c1O)C)C 62a_100011934984_100000210202 [0,2,0,0,0,0|1,0,0]=3 11239 B12R1.40 CCSc1cc(cc(c1O)C)Cl 62a_100000210202_100012343667 [0,2,0,0,0,0|1,0,0]=3 11240 B12R1.40 CCSc1cc(cc(c1O)C)Cl 62a_100012343667_100000210202 [0,2,0,0,0,0|1,0,0]=3 11241 B12R1.40 CCSc1cc(cc(c1O)C)N 62a_100000210202_100010064301 [0,2,0,0,0,0|1,0,0]=3 11242 B12R1.40 CCSc1cc(cc(c1O)C)N 62a_100010064301_100000210202 [0,2,0,0,0,0|1,0,0]=3 11243 B12R1.40 CCSc1cc(cc(c1O)Cl)Cl 62a_100000210202_200012339341 [0,2,0,0,0,0|1,0,0]=3 11244 B12R1.40 CCSc1cc(cc(c1O)Cl)Cl 62a_200012339341_100000210202 [0,2,0,0,0,0|1,0,0]=3 11245 B12R1.40 CCSc1cc(cc(c1O)F)Br 62a_100000210202_100013354677 [0,2,0,0,0,0|1,0,0]=3 11246 B12R1.40 CCSc1cc(cc(c1O)F)Br 62a_100013354677_100000210202 [0,2,0,0,0,0|1,0,0]=3 11247 B12R1.40 CCSc1cc(cc(c1O)F)C 62a_100000210202_200135191068 [0,2,0,0,0,0|1,0,0]=3 11248 B12R1.40 CCSc1cc(cc(c1O)F)C 62a_200135191068_100000210202 [0,2,0,0,0,0|1,0,0]=3 11249 B12R1.40 CCSc1cc(cc(c1O)F)F 62a_100000210202_100000688693 [0,2,0,0,0,0|1,0,0]=3 11250 B12R1.40 CCSc1cc(cc(c1O)F)F 62a_100000688693_100000210202 [0,2,0,0,0,0|1,0,0]=3 11251 B12R1.40 CCSc1cc(cc(c1O)N)Br 62a_100000210202_100016071998 [0,2,0,0,0,0|1,0,0]=3 11252 B12R1.40 CCSc1cc(cc(c1O)N)Br 62a_100016071998_100000210202 [0,2,0,0,0,0|1,0,0]=3 11253 B12R1.40 CCSc1cc(cc(c1O)N)F 62a_100000210202_200011217456 [0,2,0,0,0,0|1,0,0]=3 11254 B12R1.40 CCSc1cc(cc(c1O)N)F 62a_200011217456_100000210202 [0,2,0,0,0,0|1,0,0]=3 11255 B12R1.40 CNCc1cc(cc(c1Br)C)C 26a_100102657272_100010342985 [0,2,0,0,0,0|2,0,0]=4 11256 B12R1.40 CNCc1cc(cc(c1Br)Cl)Cl 207a_100102657272_100021453488 [0,2,0,0,0,0|2,0,0]=4 11257 B12R1.40 CNCc1cc(cc(c1Br)Cl)Cl 270004a_106832991635_100021453488 [0,2,0,0,0,0|2,0,0]=4 11258 B12R1.40 CNCc1cc(cc(c1Br)F)Cl 26a_100102657272_100015539415 [0,2,0,0,0,0|2,0,0]=4 11259 B12R1.40 CNCc1cc(cc(c1Br)F)F 207a_100102657272_100010775724 [0,2,0,0,0,0|2,0,0]=4 11260 B12R1.40 CNCc1cc(cc(c1Br)F)F 2230a_106832991635_100015714476 [0,2,0,0,0,0|2,0,0]=4 11261 B12R1.40 CNCc1cc(cc(c1Br)F)F 26a_100102657272_100009815984 [0,2,0,0,0,0|2,0,0]=4 11262 B12R1.40 CNCc1cc(cc(c1Br)F)F 270004a_106832991635_100010775724 [0,2,0,0,0,0|2,0,0]=4 11263 B12R1.40 CNCc1cc(cc(c1Br)F)F 34a_100102657272_100015714476 [0,2,0,0,0,0|2,0,0]=4 11264 B12R1.40 CNCc1cc(cc(c1Br)F)F 7a_106832991635_100015714476 [0,2,0,0,0,0|2,0,0]=4 11265 B12R1.40 CNCc1cc(cc(c1Cl)Br)C 207a_100102657272_200015622410 [0,2,0,0,0,0|2,0,0]=4 11266 B12R1.40 CNCc1cc(cc(c1Cl)Br)C 270004a_106832991635_200015622410 [0,2,0,0,0,0|2,0,0]=4 11267 B12R1.40 CNCc1cc(cc(c1Cl)Br)F 207a_100102657272_200011105904 [0,2,0,0,0,0|2,0,0]=4 11268 B12R1.40 CNCc1cc(cc(c1Cl)Br)F 270004a_106832991635_200011105904 [0,2,0,0,0,0|2,0,0]=4 11269 B12R1.40 CNCc1cc(cc(c1Cl)Br)I 2230a_106832991635_100021522891 [0,2,0,0,0,0|2,0,0]=4 11270 B12R1.40 CNCc1cc(cc(c1Cl)Br)I 34a_100102657272_100021522891 [0,2,0,0,0,0|2,0,0]=4 11271 B12R1.40 CNCc1cc(cc(c1Cl)Br)I 7a_106832991635_100021522891 [0,2,0,0,0,0|2,0,0]=4 11272 B12R1.40 CNCc1cc(cc(c1Cl)C)C 26a_100102657272_100000094344 [0,2,0,0,0,0|2,0,0]=4 11273 B12R1.40 CNCc1cc(cc(c1Cl)Cl)Cl 207a_100102657272_100000043451 [0,2,0,0,0,0|2,0,0]=4 11274 B12R1.40 CNCc1cc(cc(c1Cl)Cl)Cl 270004a_106832991635_100000043451 [0,2,0,0,0,0|2,0,0]=4 11275 B12R1.40 CNCc1cc(cc(c1Cl)F)Br 26a_100102657272_100010981968 [0,2,0,0,0,0|2,0,0]=4 11276 B12R1.40 CNCc1cc(cc(c1Cl)F)F 26a_100102657272_200000037661 [0,2,0,0,0,0|2,0,0]=4 11277 B12R1.40 CNCc1cc(cc(c1F)Br)Br 207a_100102657272_200009813688 [0,2,0,0,0,0|2,0,0]=4 11278 B12R1.40 CNCc1cc(cc(c1F)Br)Br 270004a_106832991635_200009813688 [0,2,0,0,0,0|2,0,0]=4 11279 B12R1.40 CNCc1cc(cc(c1F)Br)C 207a_100102657272_100010161323 [0,2,0,0,0,0|2,0,0]=4 11280 B12R1.40 CNCc1cc(cc(c1F)Br)C 270004a_106832991635_100010161323 [0,2,0,0,0,0|2,0,0]=4 11281 B12R1.40 CNCc1cc(cc(c1F)Br)Cl 207a_100102657272_100010735113 [0,2,0,0,0,0|2,0,0]=4 11282 B12R1.40 CNCc1cc(cc(c1F)Br)Cl 270004a_106832991635_100010735113 [0,2,0,0,0,0|2,0,0]=4 11283 B12R1.40 CNCc1cc(cc(c1F)Br)F 207a_100102657272_100010890130 [0,2,0,0,0,0|2,0,0]=4 11284 B12R1.40 CNCc1cc(cc(c1F)Br)F 270004a_106832991635_100010890130 [0,2,0,0,0,0|2,0,0]=4 11285 B12R1.40 CNCc1cc(cc(c1F)C)Br 207a_100102657272_100010235757 [0,2,0,0,0,0|2,0,0]=4 11286 B12R1.40 CNCc1cc(cc(c1F)C)Br 270004a_106832991635_100010235757 [0,2,0,0,0,0|2,0,0]=4 11287 B12R1.40 CNCc1cc(cc(c1F)Cl)Br 207a_100102657272_100010062393 [0,2,0,0,0,0|2,0,0]=4 11288 B12R1.40 CNCc1cc(cc(c1F)Cl)Br 26a_100102657272_100010077842 [0,2,0,0,0,0|2,0,0]=4 11289 B12R1.40 CNCc1cc(cc(c1F)Cl)Br 270004a_106832991635_100010062393 [0,2,0,0,0,0|2,0,0]=4 11290 B12R1.40 CNCc1cc(cc(c1F)Cl)Cl 207a_100102657272_100010946434 [0,2,0,0,0,0|2,0,0]=4 11291 B12R1.40 CNCc1cc(cc(c1F)Cl)Cl 270004a_106832991635_100010946434 [0,2,0,0,0,0|2,0,0]=4 11292 B12R1.40 CNCc1cc(cc(c1F)F)Br 207a_100102657272_100009814787 [0,2,0,0,0,0|2,0,0]=4 11293 B12R1.40 CNCc1cc(cc(c1F)F)Br 26a_100102657272_100000709865 [0,2,0,0,0,0|2,0,0]=4 11294 B12R1.40 CNCc1cc(cc(c1F)F)Br 270004a_106832991635_100009814787 [0,2,0,0,0,0|2,0,0]=4 11295 B12R1.40 CNCc1cc(cc(c1F)F)C 2230a_106832991635_100015889675 [0,2,0,0,0,0|2,0,0]=4 11296 B12R1.40 CNCc1cc(cc(c1F)F)C 34a_100102657272_100015889675 [0,2,0,0,0,0|2,0,0]=4 11297 B12R1.40 CNCc1cc(cc(c1F)F)C 7a_106832991635_100015889675 [0,2,0,0,0,0|2,0,0]=4 11298 B12R1.40 CNCc1cc(cc(c1F)F)Cl 207a_100102657272_100010290101 [0,2,0,0,0,0|2,0,0]=4 11299 B12R1.40 CNCc1cc(cc(c1F)F)Cl 270004a_106832991635_100010290101 [0,2,0,0,0,0|2,0,0]=4 11300 B12R1.40 CNCc1cc(cc(c1F)F)F 207a_100102657272_100011217573 [0,2,0,0,0,0|2,0,0]=4 11301 B12R1.40 CNCc1cc(cc(c1F)F)F 2230a_100011830225_200000210301 [0,2,0,0,0,0|2,0,0]=4 11302 B12R1.40 CNCc1cc(cc(c1F)F)F 2230a_106832991635_100009813678 [0,2,0,0,0,0|2,0,0]=4 11303 B12R1.40 CNCc1cc(cc(c1F)F)F 270004a_106832991635_100011217573 [0,2,0,0,0,0|2,0,0]=4 11304 B12R1.40 CNCc1cc(cc(c1F)F)F 34a_100011830225_200000210301 [0,2,0,0,0,0|2,0,0]=4 11305 B12R1.40 CNCc1cc(cc(c1F)F)F 34a_100102657272_100009813678 [0,2,0,0,0,0|2,0,0]=4 11306 B12R1.40 CNCc1cc(cc(c1F)F)F 7a_106832991635_100009813678 [0,2,0,0,0,0|2,0,0]=4 11307 B12R1.40 CNCc1cc(cc(c1I)I)I 207a_100102657272_100010197720 [0,2,0,0,0,0|2,0,0]=4 11308 B12R1.40 CNCc1cc(cc(c1I)I)I 2230a_106832991635_100010206063 [0,2,0,0,0,0|2,0,0]=4 11309 B12R1.40 CNCc1cc(cc(c1I)I)I 34a_100102657272_100010206063 [0,2,0,0,0,0|2,0,0]=4 11310 B12R1.40 CNCc1cc(cc(c1I)I)I 7a_106832991635_100010206063 [0,2,0,0,0,0|2,0,0]=4 11311 B12R1.40 CNCc1cc(cc(c1O)Br)Br 2230a_106832991635_200009814416 [0,2,0,0,0,0|1,0,0]=3 11312 B12R1.40 CNCc1cc(cc(c1O)Br)Br 34a_100102657272_200009814416 [0,2,0,0,0,0|1,0,0]=3 11313 B12R1.40 CNCc1cc(cc(c1O)Br)Br 7a_106832991635_200009814416 [0,2,0,0,0,0|1,0,0]=3 11314 B12R1.40 CNCc1cc(cc(c1O)Cl)Cl 270004a_106832991635_100000212163 [0,2,0,0,0,0|1,0,0]=3 11315 B12R1.40 COCc1cc(cc(c1Br)F)F 34a_100138415774_100015714476 [0,2,0,0,0,0|2,0,0]=4 11316 B12R1.40 COCc1cc(cc(c1Cl)Br)I 34a_100138415774_100021522891 [0,2,0,0,0,0|2,0,0]=4 11317 B12R1.40 COCc1cc(cc(c1Cl)F)F 34a_100015484686_200000210301 [0,2,0,0,0,0|2,0,0]=4 11318 B12R1.40 COCc1cc(cc(c1Cl)F)F 7a_100015484686_200000210301 [0,2,0,0,0,0|2,0,0]=4 11319 B12R1.40 COCc1cc(cc(c1F)Br)Cl 34a_100016005154_200000210301 [0,2,0,0,0,0|2,0,0]=4 11320 B12R1.40 COCc1cc(cc(c1F)Br)Cl 7a_100016005154_200000210301 [0,2,0,0,0,0|2,0,0]=4 11321 B12R1.40 COCc1cc(cc(c1F)Br)F 34a_100010988950_200000210301 [0,2,0,0,0,0|2,0,0]=4 11322 B12R1.40 COCc1cc(cc(c1F)Br)F 7a_100010988950_200000210301 [0,2,0,0,0,0|2,0,0]=4 11323 B12R1.40 COCc1cc(cc(c1F)C)Br 34a_200010782270_200000210301 [0,2,0,0,0,0|2,0,0]=4 11324 B12R1.40 COCc1cc(cc(c1F)C)Br 7a_200010782270_200000210301 [0,2,0,0,0,0|2,0,0]=4 11325 B12R1.40 COCc1cc(cc(c1F)Cl)Br 34a_100015743440_200000210301 [0,2,0,0,0,0|2,0,0]=4 11326 B12R1.40 COCc1cc(cc(c1F)Cl)Br 7a_100015743440_200000210301 [0,2,0,0,0,0|2,0,0]=4 11327 B12R1.40 COCc1cc(cc(c1F)F)C 34a_100138415774_100015889675 [0,2,0,0,0,0|2,0,0]=4 11328 B12R1.40 COCc1cc(cc(c1F)F)F 34a_100138415774_100009813678 [0,2,0,0,0,0|2,0,0]=4 11329 B12R1.40 COCc1cc(cc(c1F)F)F 34a_200011215099_200000210301 [0,2,0,0,0,0|2,0,0]=4 11330 B12R1.40 COCc1cc(cc(c1F)F)F 7a_200011215099_200000210301 [0,2,0,0,0,0|2,0,0]=4 11331 B12R1.40 COCc1cc(cc(c1I)I)I 34a_100138415774_100010206063 [0,2,0,0,0,0|2,0,0]=4 11332 B12R1.40 COCc1cc(cc(c1N)Br)Br 34a_100012350754_200000210301 [0,2,0,0,0,0|2,0,0]=4 11333 B12R1.40 COCc1cc(cc(c1N)Br)Br 7a_100012350754_200000210301 [0,2,0,0,0,0|2,0,0]=4 11334 B12R1.40 COCc1cc(cc(c1N)Br)F 34a_200010775858_200000210301 [0,2,0,0,0,0|2,0,0]=4 11335 B12R1.40 COCc1cc(cc(c1N)Br)F 7a_200010775858_200000210301 [0,2,0,0,0,0|2,0,0]=4 11336 B12R1.40 COCc1cc(cc(c1O)Br)Br 34a_100138415774_200009814416 [0,2,0,0,0,0|1,0,0]=3 11337 B12R1.40 CSCc1cc(cc(c1Br)F)F 62a_100015714476_200000210301 [0,2,0,0,0,0|2,0,0]=4 11338 B12R1.40 CSCc1cc(cc(c1Br)F)F 62a_200000210301_100015714476 [0,2,0,0,0,0|2,0,0]=4 11339 B12R1.40 CSCc1cc(cc(c1Cl)Br)I 62a_100021522891_200000210301 [0,2,0,0,0,0|2,0,0]=4 11340 B12R1.40 CSCc1cc(cc(c1Cl)Br)I 62a_200000210301_100021522891 [0,2,0,0,0,0|2,0,0]=4 11341 B12R1.40 CSCc1cc(cc(c1F)F)C 62a_100015889675_200000210301 [0,2,0,0,0,0|2,0,0]=4 11342 B12R1.40 CSCc1cc(cc(c1F)F)C 62a_200000210301_100015889675 [0,2,0,0,0,0|2,0,0]=4 11343 B12R1.40 CSCc1cc(cc(c1F)F)F 62a_100009813678_200000210301 [0,2,0,0,0,0|2,0,0]=4 11344 B12R1.40 CSCc1cc(cc(c1F)F)F 62a_200000210301_100009813678 [0,2,0,0,0,0|2,0,0]=4 11345 B12R1.40 CSCc1cc(cc(c1I)I)I 62a_100010206063_200000210301 [0,2,0,0,0,0|2,0,0]=4 11346 B12R1.40 CSCc1cc(cc(c1I)I)I 62a_200000210301_100010206063 [0,2,0,0,0,0|2,0,0]=4 11347 B12R1.40 CSCc1cc(cc(c1O)Br)Br 62a_200000210301_200009814416 [0,2,0,0,0,0|1,0,0]=3 11348 B12R1.40 CSCc1cc(cc(c1O)Br)Br 62a_200009814416_200000210301 [0,2,0,0,0,0|1,0,0]=3 11349 B12R1.40 Cc1cc(c(c(c1)CS[13CH3])F)F 62a_100015889675_200025704644 [0,2,0,0,0,0|2,0,0]=4 11350 B12R1.40 Cc1cc(c(c(c1)CS[13CH3])F)F 62a_200025704644_100015889675 [0,2,0,0,0,0|2,0,0]=4 11351 B12R1.40 Cc1cc(c(c(c1)NCF)O)C 34a_100011216242_100015361967 [0,2,0,0,0,0|2,0,0]=4 11352 B12R1.40 Cc1cc(c(c(c1)NCF)O)C 7a_100011216242_100015361967 [0,2,0,0,0,0|2,0,0]=4 11353 B12R1.40 Cc1cc(c(c(c1)SCF)O)C 62a_100011934984_100015361967 [0,2,0,0,0,0|2,0,0]=4 11354 B12R1.40 Cc1cc(c(c(c1)SCF)O)C 62a_100015361967_100011934984 [0,2,0,0,0,0|2,0,0]=4 11355 B12R1.40 Cc1cc(c(c(c1)SCF)O)F 62a_100015361967_200135191068 [0,2,0,0,0,0|2,0,0]=4 11356 B12R1.40 Cc1cc(c(c(c1)SCF)O)F 62a_200135191068_100015361967 [0,2,0,0,0,0|2,0,0]=4 11357 B12R1.40 Cc1cc(cc(c1F)CO[13CH3])Br 34a_200010782270_200025704644 [0,2,0,0,0,0|2,0,0]=4 11358 B12R1.40 Cc1cc(cc(c1F)CO[13CH3])Br 7a_200010782270_200025704644 [0,2,0,0,0,0|2,0,0]=4 11359 B12R1.40 Cc1cc(cc(c1O)NCF)Br 34a_100011825904_100015361967 [0,2,0,0,0,0|2,0,0]=4 11360 B12R1.40 Cc1cc(cc(c1O)NCF)Br 7a_100011825904_100015361967 [0,2,0,0,0,0|2,0,0]=4 11361 B12R1.40 Cc1cc(cc(c1O)NCF)F 34a_100000130126_100015361967 [0,2,0,0,0,0|2,0,0]=4 11362 B12R1.40 Cc1cc(cc(c1O)NCF)F 7a_100000130126_100015361967 [0,2,0,0,0,0|2,0,0]=4 11363 B12R1.40 Cc1cc(cc(c1O)SCF)Cl 62a_100012343667_100015361967 [0,2,0,0,0,0|2,0,0]=4 11364 B12R1.40 Cc1cc(cc(c1O)SCF)Cl 62a_100015361967_100012343667 [0,2,0,0,0,0|2,0,0]=4 11365 B12R1.40 Cc1cc(cc(c1O)SCF)N 62a_100010064301_100015361967 [0,2,0,0,0,0|2,0,0]=4 11366 B12R1.40 Cc1cc(cc(c1O)SCF)N 62a_100015361967_100010064301 [0,2,0,0,0,0|2,0,0]=4 11367 B12R1.40 Nc1cc(cc(c1O)SCF)Br 62a_100015361967_100016071998 [0,2,0,0,0,0|2,0,0]=4 11368 B12R1.40 Nc1cc(cc(c1O)SCF)Br 62a_100016071998_100015361967 [0,2,0,0,0,0|2,0,0]=4 11369 B12R1.40 Nc1cc(cc(c1O)SCF)F 62a_100015361967_200011217456 [0,2,0,0,0,0|2,0,0]=4 11370 B12R1.40 Nc1cc(cc(c1O)SCF)F 62a_200011217456_100015361967 [0,2,0,0,0,0|2,0,0]=4 11371 B12R1.40 Oc1c(cc(cc1NCF)Br)Br 34a_100010781877_100015361967 [0,2,0,0,0,0|2,0,0]=4 11372 B12R1.40 Oc1c(cc(cc1NCF)Br)Cl 34a_100000694353_100015361967 [0,2,0,0,0,0|2,0,0]=4 11373 B12R1.40 Oc1c(cc(cc1NCF)Br)F 34a_100011217383_100015361967 [0,2,0,0,0,0|2,0,0]=4 11374 B12R1.40 Oc1c(cc(cc1NCF)Br)F 7a_100011217383_100015361967 [0,2,0,0,0,0|2,0,0]=4 11375 B12R1.40 Oc1c(cc(cc1NCF)Cl)Br 34a_106741647128_100015361967 [0,2,0,0,0,0|2,0,0]=4 11376 B12R1.40 Oc1c(cc(cc1NCF)Cl)Cl 34a_100000695819_100015361967 [0,2,0,0,0,0|2,0,0]=4 11377 B12R1.40 Oc1c(cc(cc1NCF)F)Br 34a_200011217456_100015361967 [0,2,0,0,0,0|2,0,0]=4 11378 B12R1.40 Oc1c(cc(cc1NCF)F)F 34a_100015205836_100015361967 [0,2,0,0,0,0|2,0,0]=4 11379 B12R1.40 Oc1c(cc(cc1SCF)Br)F 62a_100013354677_100015361967 [0,2,0,0,0,0|2,0,0]=4 11380 B12R1.40 Oc1c(cc(cc1SCF)Br)F 62a_100015361967_100013354677 [0,2,0,0,0,0|2,0,0]=4 11381 B12R1.40 Oc1c(cc(cc1SCF)Cl)Cl 62a_100015361967_200012339341 [0,2,0,0,0,0|2,0,0]=4 11382 B12R1.40 Oc1c(cc(cc1SCF)Cl)Cl 62a_200012339341_100015361967 [0,2,0,0,0,0|2,0,0]=4 11383 B12R1.40 Oc1c(cc(cc1SCF)F)Br 62a_100015361967_200013085147 [0,2,0,0,0,0|2,0,0]=4 11384 B12R1.40 Oc1c(cc(cc1SCF)F)Br 62a_200013085147_100015361967 [0,2,0,0,0,0|2,0,0]=4 11385 B12R1.40 Oc1c(cc(cc1SCF)F)F 62a_100000688693_100015361967 [0,2,0,0,0,0|2,0,0]=4 11386 B12R1.40 Oc1c(cc(cc1SCF)F)F 62a_100015361967_100000688693 [0,2,0,0,0,0|2,0,0]=4 11387 B12R1.40 [13CH3]NCc1cc(cc(c1F)F)F 2230a_100011830225_200025704644 [0,2,0,0,0,0|2,0,0]=4 11388 B12R1.40 [13CH3]NCc1cc(cc(c1F)F)F 34a_100011830225_200025704644 [0,2,0,0,0,0|2,0,0]=4 11389 B12R1.40 [13CH3]OCc1cc(cc(c1Cl)F)F 34a_100015484686_200025704644 [0,2,0,0,0,0|2,0,0]=4 11390 B12R1.40 [13CH3]OCc1cc(cc(c1Cl)F)F 7a_100015484686_200025704644 [0,2,0,0,0,0|2,0,0]=4 11391 B12R1.40 [13CH3]OCc1cc(cc(c1F)Br)Cl 34a_100016005154_200025704644 [0,2,0,0,0,0|2,0,0]=4 11392 B12R1.40 [13CH3]OCc1cc(cc(c1F)Br)Cl 7a_100016005154_200025704644 [0,2,0,0,0,0|2,0,0]=4 11393 B12R1.40 [13CH3]OCc1cc(cc(c1F)Br)F 34a_100010988950_200025704644 [0,2,0,0,0,0|2,0,0]=4 11394 B12R1.40 [13CH3]OCc1cc(cc(c1F)Br)F 7a_100010988950_200025704644 [0,2,0,0,0,0|2,0,0]=4 11395 B12R1.40 [13CH3]OCc1cc(cc(c1F)Cl)Br 34a_100015743440_200025704644 [0,2,0,0,0,0|2,0,0]=4 11396 B12R1.40 [13CH3]OCc1cc(cc(c1F)Cl)Br 7a_100015743440_200025704644 [0,2,0,0,0,0|2,0,0]=4 11397 B12R1.40 [13CH3]OCc1cc(cc(c1F)F)F 34a_200011215099_200025704644 [0,2,0,0,0,0|2,0,0]=4 11398 B12R1.40 [13CH3]OCc1cc(cc(c1F)F)F 7a_200011215099_200025704644 [0,2,0,0,0,0|2,0,0]=4 11399 B12R1.40 [13CH3]OCc1cc(cc(c1N)Br)Br 34a_100012350754_200025704644 [0,2,0,0,0,0|2,0,0]=4 11400 B12R1.40 [13CH3]OCc1cc(cc(c1N)Br)Br 7a_100012350754_200025704644 [0,2,0,0,0,0|2,0,0]=4 11401 B12R1.40 [13CH3]OCc1cc(cc(c1N)Br)F 34a_200010775858_200025704644 [0,2,0,0,0,0|2,0,0]=4 11402 B12R1.40 [13CH3]OCc1cc(cc(c1N)Br)F 7a_200010775858_200025704644 [0,2,0,0,0,0|2,0,0]=4 11403 B12R1.40 [13CH3]SCc1cc(cc(c1Br)F)F 62a_100015714476_200025704644 [0,2,0,0,0,0|2,0,0]=4 11404 B12R1.40 [13CH3]SCc1cc(cc(c1Br)F)F 62a_200025704644_100015714476 [0,2,0,0,0,0|2,0,0]=4 11405 B12R1.40 [13CH3]SCc1cc(cc(c1Cl)Br)I 62a_100021522891_200025704644 [0,2,0,0,0,0|2,0,0]=4 11406 B12R1.40 [13CH3]SCc1cc(cc(c1Cl)Br)I 62a_200025704644_100021522891 [0,2,0,0,0,0|2,0,0]=4 11407 B12R1.40 [13CH3]SCc1cc(cc(c1F)F)F 62a_100009813678_200025704644 [0,2,0,0,0,0|2,0,0]=4 11408 B12R1.40 [13CH3]SCc1cc(cc(c1F)F)F 62a_200025704644_100009813678 [0,2,0,0,0,0|2,0,0]=4 11409 B12R1.40 [13CH3]SCc1cc(cc(c1I)I)I 62a_100010206063_200025704644 [0,2,0,0,0,0|2,0,0]=4 11410 B12R1.40 [13CH3]SCc1cc(cc(c1I)I)I 62a_200025704644_100010206063 [0,2,0,0,0,0|2,0,0]=4 11411 B12R1.40 [13CH3]SCc1cc(cc(c1O)Br)Br 62a_200009814416_200025704644 [0,2,0,0,0,0|1,0,0]=3 11412 B12R1.40 [13CH3]SCc1cc(cc(c1O)Br)Br 62a_200025704644_200009814416 [0,2,0,0,0,0|1,0,0]=3 11413 B12R1.224 CC(=Cc1cccc(c1O)Br)C 271570a_100102525489_100010084509 [0,2,0,0,0,0|0,0,2]=4 11414 B12R1.224 CC(=Cc1cccc(c1O)C)C 271570a_100102525489_100009817157 [0,2,0,0,0,0|0,0,2]=4 11415 B12R1.224 CC(=Cc1cccc(c1O)Cl)C 271570a_100102525489_100010202889 [0,2,0,0,0,0|0,0,2]=4 11416 B12R1.224 CC(=Cc1cccc(c1O)F)C 271570a_100102525489_100009813666 [0,2,0,0,0,0|0,0,2]=4 11417 B12R1.224 CC(=Cc1cccc(c1O)N)C 271570a_100102525489_100011934915 [0,2,0,0,0,0|0,0,2]=4 11418 B12R1.224 CC(=Cc1cccc(c1O)O)C 271570a_100102525489_100009815950 [0,2,0,0,0,0|0,0,2]=4 11419 B12R1.224 CC(=O)Cc1cccc(c1Br)C 1458a_100000070787_200012349612 [0,2,0,0,0,0|1,0,1]=4 11420 B12R1.224 CC(=O)Cc1cccc(c1Br)C 1458a_100010147021_200000210301 [0,2,0,0,0,0|1,0,1]=4 11421 B12R1.224 CC(=O)Cc1cccc(c1Br)Cl 1458a_100000070787_100010145525 [0,2,0,0,0,0|1,0,1]=4 11422 B12R1.224 CC(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_200000210301 [0,2,0,0,0,0|1,0,1]=4 11423 B12R1.224 CC(=O)Cc1cccc(c1Br)F 1458a_100000070787_100012351116 [0,2,0,0,0,0|1,0,1]=4 11424 B12R1.224 CC(=O)Cc1cccc(c1Br)F 1458a_100012356664_200000210301 [0,2,0,0,0,0|1,0,1]=4 11425 B12R1.224 CC(=O)Cc1cccc(c1Br)I 1458a_100000070787_100010254545 [0,2,0,0,0,0|1,0,1]=4 11426 B12R1.224 CC(=O)Cc1cccc(c1C)Br 1458a_100000070787_100000694682 [0,2,0,0,0,0|1,0,1]=4 11427 B12R1.224 CC(=O)Cc1cccc(c1C)C 1458a_100000070787_100011515928 [0,2,0,0,0,0|1,0,1]=4 11428 B12R1.224 CC(=O)Cc1cccc(c1C)C 1458a_100011698479_200000210301 [0,2,0,0,0,0|1,0,1]=4 11429 B12R1.224 CC(=O)Cc1cccc(c1C)Cl 1458a_100000070787_100012186920 [0,2,0,0,0,0|1,0,1]=4 11430 B12R1.224 CC(=O)Cc1cccc(c1C)F 1458a_100000035905_200000210301 [0,2,0,0,0,0|1,0,1]=4 11431 B12R1.224 CC(=O)Cc1cccc(c1C)F 1458a_100000070787_100009813626 [0,2,0,0,0,0|1,0,1]=4 11432 B12R1.224 CC(=O)Cc1cccc(c1C)I 1458a_100000070787_100010150147 [0,2,0,0,0,0|1,0,1]=4 11433 B12R1.224 CC(=O)Cc1cccc(c1Cl)Br 1458a_100000070787_100012349491 [0,2,0,0,0,0|1,0,1]=4 11434 B12R1.224 CC(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_200000210301 [0,2,0,0,0,0|1,0,1]=4 11435 B12R1.224 CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000070787_100000720918 [0,2,0,0,0,0|1,0,1]=4 11436 B12R1.224 CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_200000210301 [0,2,0,0,0,0|1,0,1]=4 11437 B12R1.224 CC(=O)Cc1cccc(c1Cl)F 1458a_100000070787_100000696688 [0,2,0,0,0,0|1,0,1]=4 11438 B12R1.224 CC(=O)Cc1cccc(c1Cl)F 1458a_100012001123_200000210301 [0,2,0,0,0,0|1,0,1]=4 11439 B12R1.224 CC(=O)Cc1cccc(c1F)Br 1458a_100000070787_100012356507 [0,2,0,0,0,0|1,0,1]=4 11440 B12R1.224 CC(=O)Cc1cccc(c1F)Br 1458a_100011935088_200000210301 [0,2,0,0,0,0|1,0,1]=4 11441 B12R1.224 CC(=O)Cc1cccc(c1F)C 1458a_100000070787_100011216058 [0,2,0,0,0,0|1,0,1]=4 11442 B12R1.224 CC(=O)Cc1cccc(c1F)Cl 1458a_100000070787_100000716733 [0,2,0,0,0,0|1,0,1]=4 11443 B12R1.224 CC(=O)Cc1cccc(c1F)Cl 1458a_100000709823_200000210301 [0,2,0,0,0,0|1,0,1]=4 11444 B12R1.224 CC(=O)Cc1cccc(c1F)F 1458a_100000070787_100000217499 [0,2,0,0,0,0|1,0,1]=4 11445 B12R1.224 CC(=O)Cc1cccc(c1F)F 1458a_100000684727_200000210301 [0,2,0,0,0,0|1,0,1]=4 11446 B12R1.224 CC(=O)Cc1cccc(c1I)F 1458a_100000070787_100010149603 [0,2,0,0,0,0|1,0,1]=4 11447 B12R1.224 CC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000070787 [0,2,0,0,0,0|1,0,1]=4 11448 B12R1.224 CC(=O)Nc1cccc(c1O)Br 527a_100011934915_100103153847 [0,2,0,0,0,0|1,0,1]=4 11449 B12R1.224 CC(=O)Nc1cccc(c1O)C 11a_100000756359_100015343762 [0,2,0,0,0,0|1,0,1]=4 11450 B12R1.224 CC(=O)Nc1cccc(c1O)C 1626a_100000756359_100015343762 [0,2,0,0,0,0|1,0,1]=4 11451 B12R1.224 CC(=O)Nc1cccc(c1O)C 22a_100000756359_100000070787 [0,2,0,0,0,0|1,0,1]=4 11452 B12R1.224 CC(=O)Nc1cccc(c1O)C 527a_100000756359_100103153847 [0,2,0,0,0,0|1,0,1]=4 11453 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000070787 [0,2,0,0,0,0|1,0,1]=4 11454 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100103153847 [0,2,0,0,0,0|1,0,1]=4 11455 B12R1.224 CC(=O)Nc1cccc(c1O)F 1626a_100011934987_100015343762 [0,2,0,0,0,0|1,0,1]=4 11456 B12R1.224 CC(=O)Nc1cccc(c1O)F 22a_100011934987_100000070787 [0,2,0,0,0,0|1,0,1]=4 11457 B12R1.224 CC(=O)Nc1cccc(c1O)F 527a_100011934987_100103153847 [0,2,0,0,0,0|1,0,1]=4 11458 B12R1.224 CC(=O)Nc1cccc(c1O)I 1626a_100010084371_100015343762 [0,2,0,0,0,0|1,0,1]=4 11459 B12R1.224 CC(=O)Nc1cccc(c1O)I 22a_100010084371_100000070787 [0,2,0,0,0,0|1,0,1]=4 11460 B12R1.224 CC(=O)Nc1cccc(c1O)I 527a_100010084371_100103153847 [0,2,0,0,0,0|1,0,1]=4 11461 B12R1.224 CC(C)Nc1cccc(c1Br)Cl 34a_100000687072_100000210206 [0,2,0,0,0,0|2,0,0]=4 11462 B12R1.224 CC(C)Nc1cccc(c1Br)F 34a_100011934729_100000210206 [0,2,0,0,0,0|2,0,0]=4 11463 B12R1.224 CC(C)Nc1cccc(c1Br)O 34a_100012183704_100000210206 [0,2,0,0,0,0|2,0,0]=4 11464 B12R1.224 CC(C)Nc1cccc(c1Br)O 7a_100012183704_100000210206 [0,2,0,0,0,0|2,0,0]=4 11465 B12R1.224 CC(C)Nc1cccc(c1Cl)Br 34a_100000687075_100000210206 [0,2,0,0,0,0|2,0,0]=4 11466 B12R1.224 CC(C)Nc1cccc(c1Cl)Cl 34a_100000185733_100000210206 [0,2,0,0,0,0|2,0,0]=4 11467 B12R1.224 CC(C)Nc1cccc(c1Cl)F 34a_100000692321_100000210206 [0,2,0,0,0,0|2,0,0]=4 11468 B12R1.224 CC(C)Nc1cccc(c1Cl)O 34a_100012002038_100000210206 [0,2,0,0,0,0|2,0,0]=4 11469 B12R1.224 CC(C)Nc1cccc(c1Cl)O 7a_100012002038_100000210206 [0,2,0,0,0,0|2,0,0]=4 11470 B12R1.224 CC(C)Nc1cccc(c1F)Br 2230a_100011935091_100000210206 [0,2,0,0,0,0|2,0,0]=4 11471 B12R1.224 CC(C)Nc1cccc(c1F)Br 34a_100011935091_100000210206 [0,2,0,0,0,0|2,0,0]=4 11472 B12R1.224 CC(C)Nc1cccc(c1F)Cl 2230a_100000199060_100000210206 [0,2,0,0,0,0|2,0,0]=4 11473 B12R1.224 CC(C)Nc1cccc(c1F)Cl 34a_100000199060_100000210206 [0,2,0,0,0,0|2,0,0]=4 11474 B12R1.224 CC(C)Nc1cccc(c1F)F 34a_100000743855_100000210206 [0,2,0,0,0,0|2,0,0]=4 11475 B12R1.224 CC(C)Nc1cccc(c1I)Br 34a_100020590159_100000210206 [0,2,0,0,0,0|2,0,0]=4 11476 B12R1.224 CC(C)Nc1cccc(c1I)Cl 34a_100000049713_100000210206 [0,2,0,0,0,0|2,0,0]=4 11477 B12R1.224 CC(C)Nc1cccc(c1I)F 34a_100000690935_100000210206 [0,2,0,0,0,0|2,0,0]=4 11478 B12R1.224 CC(C)Nc1cccc(c1O)Br 34a_100011934915_100000210206 [0,2,0,0,0,0|1,0,0]=3 11479 B12R1.224 CC(C)Nc1cccc(c1O)Cl 34a_100000754742_100000210206 [0,2,0,0,0,0|1,0,0]=3 11480 B12R1.224 CC(C)Nc1cccc(c1O)F 34a_100011934987_100000210206 [0,2,0,0,0,0|1,0,0]=3 11481 B12R1.224 CC(C)Oc1cccc(c1Br)Br 34a_100010187966_100000210206 [0,2,0,0,0,0|2,0,0]=4 11482 B12R1.224 CC(C)Oc1cccc(c1Br)Br 7a_100010187966_100000210206 [0,2,0,0,0,0|2,0,0]=4 11483 B12R1.224 CC(C)Oc1cccc(c1Br)Cl 34a_100012348804_100000210206 [0,2,0,0,0,0|2,0,0]=4 11484 B12R1.224 CC(C)Oc1cccc(c1Br)Cl 7a_100012348804_100000210206 [0,2,0,0,0,0|2,0,0]=4 11485 B12R1.224 CC(C)Oc1cccc(c1Br)F 34a_100009820682_100000210206 [0,2,0,0,0,0|2,0,0]=4 11486 B12R1.224 CC(C)Oc1cccc(c1Br)F 7a_100009820682_100000210206 [0,2,0,0,0,0|2,0,0]=4 11487 B12R1.224 CC(C)Oc1cccc(c1Br)I 34a_100010187914_100000210206 [0,2,0,0,0,0|2,0,0]=4 11488 B12R1.224 CC(C)Oc1cccc(c1Br)I 7a_100010187914_100000210206 [0,2,0,0,0,0|2,0,0]=4 11489 B12R1.224 CC(C)Oc1cccc(c1Br)N 34a_100012183704_100000210206 [0,2,0,0,0,0|2,0,0]=4 11490 B12R1.224 CC(C)Oc1cccc(c1Br)N 7a_100012183704_100000210206 [0,2,0,0,0,0|2,0,0]=4 11491 B12R1.224 CC(C)Oc1cccc(c1Cl)Br 34a_100010187913_100000210206 [0,2,0,0,0,0|2,0,0]=4 11492 B12R1.224 CC(C)Oc1cccc(c1Cl)Br 7a_100010187913_100000210206 [0,2,0,0,0,0|2,0,0]=4 11493 B12R1.224 CC(C)Oc1cccc(c1Cl)Cl 34a_100000211076_100000210206 [0,2,0,0,0,0|2,0,0]=4 11494 B12R1.224 CC(C)Oc1cccc(c1Cl)Cl 7a_100000211076_100000210206 [0,2,0,0,0,0|2,0,0]=4 11495 B12R1.224 CC(C)Oc1cccc(c1Cl)F 34a_100000087408_100000210206 [0,2,0,0,0,0|2,0,0]=4 11496 B12R1.224 CC(C)Oc1cccc(c1Cl)F 7a_100000087408_100000210206 [0,2,0,0,0,0|2,0,0]=4 11497 B12R1.224 CC(C)Oc1cccc(c1Cl)I 34a_100000049636_100000210206 [0,2,0,0,0,0|2,0,0]=4 11498 B12R1.224 CC(C)Oc1cccc(c1Cl)I 7a_100000049636_100000210206 [0,2,0,0,0,0|2,0,0]=4 11499 B12R1.224 CC(C)Oc1cccc(c1Cl)N 34a_100012002038_100000210206 [0,2,0,0,0,0|2,0,0]=4 11500 B12R1.224 CC(C)Oc1cccc(c1Cl)N 7a_100012002038_100000210206 [0,2,0,0,0,0|2,0,0]=4 11501 B12R1.224 CC(C)Oc1cccc(c1F)Br 34a_100009817021_100000210206 [0,2,0,0,0,0|2,0,0]=4 11502 B12R1.224 CC(C)Oc1cccc(c1F)Br 7a_100009817021_100000210206 [0,2,0,0,0,0|2,0,0]=4 11503 B12R1.224 CC(C)Oc1cccc(c1F)Cl 34a_100000687438_100000210206 [0,2,0,0,0,0|2,0,0]=4 11504 B12R1.224 CC(C)Oc1cccc(c1F)Cl 7a_100000687438_100000210206 [0,2,0,0,0,0|2,0,0]=4 11505 B12R1.224 CC(C)Oc1cccc(c1F)F 34a_100000751161_100000210206 [0,2,0,0,0,0|2,0,0]=4 11506 B12R1.224 CC(C)Oc1cccc(c1F)F 7a_100000751161_100000210206 [0,2,0,0,0,0|2,0,0]=4 11507 B12R1.224 CC(C)Oc1cccc(c1I)Br 34a_100010187912_100000210206 [0,2,0,0,0,0|2,0,0]=4 11508 B12R1.224 CC(C)Oc1cccc(c1I)Br 7a_100010187912_100000210206 [0,2,0,0,0,0|2,0,0]=4 11509 B12R1.224 CC(C)Oc1cccc(c1I)Cl 34a_100000050174_100000210206 [0,2,0,0,0,0|2,0,0]=4 11510 B12R1.224 CC(C)Oc1cccc(c1I)Cl 7a_100000050174_100000210206 [0,2,0,0,0,0|2,0,0]=4 11511 B12R1.224 CC(C)Oc1cccc(c1I)F 34a_100000690913_100000210206 [0,2,0,0,0,0|2,0,0]=4 11512 B12R1.224 CC(C)Oc1cccc(c1I)F 7a_100000690913_100000210206 [0,2,0,0,0,0|2,0,0]=4 11513 B12R1.224 CC(C)Oc1cccc(c1N)Br 34a_100011934926_100000210206 [0,2,0,0,0,0|2,0,0]=4 11514 B12R1.224 CC(C)Oc1cccc(c1N)Br 7a_100011934926_100000210206 [0,2,0,0,0,0|2,0,0]=4 11515 B12R1.224 CC(C)Oc1cccc(c1N)Cl 34a_100012022510_100000210206 [0,2,0,0,0,0|2,0,0]=4 11516 B12R1.224 CC(C)Oc1cccc(c1N)Cl 7a_100012022510_100000210206 [0,2,0,0,0,0|2,0,0]=4 11517 B12R1.224 CC(C)Oc1cccc(c1N)F 34a_100020591140_100000210206 [0,2,0,0,0,0|2,0,0]=4 11518 B12R1.224 CC(C)Oc1cccc(c1N)F 7a_100020591140_100000210206 [0,2,0,0,0,0|2,0,0]=4 11519 B12R1.224 CC(C)Oc1cccc(c1N)I 34a_200000049512_100000210206 [0,2,0,0,0,0|2,0,0]=4 11520 B12R1.224 CC(C)Oc1cccc(c1N)I 7a_200000049512_100000210206 [0,2,0,0,0,0|2,0,0]=4 11521 B12R1.224 CC(C)Oc1cccc(c1N)N 34a_100000033209_100000210206 [0,2,0,0,0,0|2,0,0]=4 11522 B12R1.224 CC(C)Sc1cccc(c1Br)Br 62a_100000210206_100010175083 [0,2,0,0,0,0|2,0,0]=4 11523 B12R1.224 CC(C)Sc1cccc(c1Br)Br 62a_100010175083_100000210206 [0,2,0,0,0,0|2,0,0]=4 11524 B12R1.224 CC(C)Sc1cccc(c1Br)Cl 62a_100000210206_100014021842 [0,2,0,0,0,0|2,0,0]=4 11525 B12R1.224 CC(C)Sc1cccc(c1Br)Cl 62a_100014021842_100000210206 [0,2,0,0,0,0|2,0,0]=4 11526 B12R1.224 CC(C)Sc1cccc(c1Br)F 62a_100000210206_100010202630 [0,2,0,0,0,0|2,0,0]=4 11527 B12R1.224 CC(C)Sc1cccc(c1Br)F 62a_100010202630_100000210206 [0,2,0,0,0,0|2,0,0]=4 11528 B12R1.224 CC(C)Sc1cccc(c1Br)O 62a_100000210206_100010187914 [0,2,0,0,0,0|2,0,0]=4 11529 B12R1.224 CC(C)Sc1cccc(c1Br)O 62a_100010187914_100000210206 [0,2,0,0,0,0|2,0,0]=4 11530 B12R1.224 CC(C)Sc1cccc(c1Cl)Br 62a_100000210206_100010142854 [0,2,0,0,0,0|2,0,0]=4 11531 B12R1.224 CC(C)Sc1cccc(c1Cl)Br 62a_100010142854_100000210206 [0,2,0,0,0,0|2,0,0]=4 11532 B12R1.224 CC(C)Sc1cccc(c1Cl)Cl 62a_100000210206_100011215384 [0,2,0,0,0,0|2,0,0]=4 11533 B12R1.224 CC(C)Sc1cccc(c1Cl)Cl 62a_100011215384_100000210206 [0,2,0,0,0,0|2,0,0]=4 11534 B12R1.224 CC(C)Sc1cccc(c1Cl)F 62a_100000210206_200010234923 [0,2,0,0,0,0|2,0,0]=4 11535 B12R1.224 CC(C)Sc1cccc(c1Cl)F 62a_200010234923_100000210206 [0,2,0,0,0,0|2,0,0]=4 11536 B12R1.224 CC(C)Sc1cccc(c1Cl)O 62a_100000210206_100000049636 [0,2,0,0,0,0|2,0,0]=4 11537 B12R1.224 CC(C)Sc1cccc(c1F)Br 62a_100000210206_100000702267 [0,2,0,0,0,0|2,0,0]=4 11538 B12R1.224 CC(C)Sc1cccc(c1F)Br 62a_100000702267_100000210206 [0,2,0,0,0,0|2,0,0]=4 11539 B12R1.224 CC(C)Sc1cccc(c1F)Cl 62a_100000210206_100011217346 [0,2,0,0,0,0|2,0,0]=4 11540 B12R1.224 CC(C)Sc1cccc(c1F)Cl 62a_100011217346_100000210206 [0,2,0,0,0,0|2,0,0]=4 11541 B12R1.224 CC(C)Sc1cccc(c1F)F 62a_100000210206_100000694657 [0,2,0,0,0,0|2,0,0]=4 11542 B12R1.224 CC(C)Sc1cccc(c1F)F 62a_100000694657_100000210206 [0,2,0,0,0,0|2,0,0]=4 11543 B12R1.224 CC(C)Sc1cccc(c1F)N 62a_100000210206_100011935091 [0,2,0,0,0,0|2,0,0]=4 11544 B12R1.224 CC(C)Sc1cccc(c1F)N 62a_100011935091_100000210206 [0,2,0,0,0,0|2,0,0]=4 11545 B12R1.224 CC(C)Sc1cccc(c1F)O 62a_100000210206_100009817021 [0,2,0,0,0,0|2,0,0]=4 11546 B12R1.224 CC(C)Sc1cccc(c1F)O 62a_100009817021_100000210206 [0,2,0,0,0,0|2,0,0]=4 11547 B12R1.224 CC(C)Sc1cccc(c1N)Br 62a_100000210206_100010146558 [0,2,0,0,0,0|2,0,0]=4 11548 B12R1.224 CC(C)Sc1cccc(c1N)Br 62a_100010146558_100000210206 [0,2,0,0,0,0|2,0,0]=4 11549 B12R1.224 CC(C)Sc1cccc(c1N)Cl 62a_100000210206_100010190421 [0,2,0,0,0,0|2,0,0]=4 11550 B12R1.224 CC(C)Sc1cccc(c1N)Cl 62a_100010190421_100000210206 [0,2,0,0,0,0|2,0,0]=4 11551 B12R1.224 CC(C)Sc1cccc(c1N)F 62a_100000042321_100000210206 [0,2,0,0,0,0|2,0,0]=4 11552 B12R1.224 CC(C)Sc1cccc(c1N)F 62a_100000210206_100000042321 [0,2,0,0,0,0|2,0,0]=4 11553 B12R1.224 CC(C)Sc1cccc(c1N)N 62a_100015191791_100000210206 [0,2,0,0,0,0|2,0,0]=4 11554 B12R1.224 CC(C)Sc1cccc(c1N)O 62a_100000210206_100011934926 [0,2,0,0,0,0|2,0,0]=4 11555 B12R1.224 CC(C)Sc1cccc(c1O)Br 62a_100000210206_100010084509 [0,2,0,0,0,0|1,0,0]=3 11556 B12R1.224 CC(C)Sc1cccc(c1O)Br 62a_100010084509_100000210206 [0,2,0,0,0,0|1,0,0]=3 11557 B12R1.224 CC(C)Sc1cccc(c1O)Cl 62a_100000210206_100010202889 [0,2,0,0,0,0|1,0,0]=3 11558 B12R1.224 CC(C)Sc1cccc(c1O)Cl 62a_100010202889_100000210206 [0,2,0,0,0,0|1,0,0]=3 11559 B12R1.224 CC(C)Sc1cccc(c1O)F 62a_100000210206_100009813666 [0,2,0,0,0,0|1,0,0]=3 11560 B12R1.224 CC(C)Sc1cccc(c1O)F 62a_100009813666_100000210206 [0,2,0,0,0,0|1,0,0]=3 11561 B12R1.224 CC(C)Sc1cccc(c1O)N 62a_100000210206_100010084371 [0,2,0,0,0,0|1,0,0]=3 11562 B12R1.224 CC(C)Sc1cccc(c1O)N 62a_100011934915_100000210206 [0,2,0,0,0,0|1,0,0]=3 11563 B12R1.224 CC(C)Sc1cccc(c1O)O 62a_100000210206_100009815950 [0,2,0,0,0,0|1,0,0]=3 11564 B12R1.224 CC(C)Sc1ccnc(c1O)Cl 62a_100000210206_100010067911 [0,2,0,0,0,0|2,0,0]=4 11565 B12R1.224 CC(C)Sc1cncc(c1O)N 62a_100000210206_100000694263 [0,2,0,0,0,0|2,0,0]=4 11566 B12R1.224 CC(C)Sc1cncc(c1O)N 62a_100000694263_100000210206 [0,2,0,0,0,0|2,0,0]=4 11567 B12R1.224 CC(C)Sc1nccc(c1O)F 62a_100000210206_100009867227 [0,2,0,0,0,0|2,0,0]=4 11568 B12R1.224 CC(C)Sc1nccc(c1O)N 62a_100000210206_100009844647 [0,2,0,0,0,0|2,0,0]=4 11569 B12R1.224 CN(C)Cc1cccc(c1Br)Br 270004a_100102631434_100010240334 [0,2,0,0,0,0|2,0,0]=4 11570 B12R1.224 CN(C)Cc1cccc(c1Br)Cl 2230a_100102631434_100010145525 [0,2,0,0,0,0|2,0,0]=4 11571 B12R1.224 CN(C)Cc1cccc(c1Br)Cl 269982a_100102631434_100010145525 [0,2,0,0,0,0|2,0,0]=4 11572 B12R1.224 CN(C)Cc1cccc(c1Br)Cl 270004a_100102631434_100010232083 [0,2,0,0,0,0|2,0,0]=4 11573 B12R1.224 CN(C)Cc1cccc(c1Br)F 2230a_100102631434_100012351116 [0,2,0,0,0,0|2,0,0]=4 11574 B12R1.224 CN(C)Cc1cccc(c1Br)F 269982a_100102631434_100012351116 [0,2,0,0,0,0|2,0,0]=4 11575 B12R1.224 CN(C)Cc1cccc(c1Br)F 270004a_100102631434_100011934749 [0,2,0,0,0,0|2,0,0]=4 11576 B12R1.224 CN(C)Cc1cccc(c1Br)I 2230a_100102631434_100010254545 [0,2,0,0,0,0|2,0,0]=4 11577 B12R1.224 CN(C)Cc1cccc(c1Br)I 269982a_100102631434_100010254545 [0,2,0,0,0,0|2,0,0]=4 11578 B12R1.224 CN(C)Cc1cccc(c1Cl)Br 2230a_100102631434_100012349491 [0,2,0,0,0,0|2,0,0]=4 11579 B12R1.224 CN(C)Cc1cccc(c1Cl)Br 269982a_100102631434_100012349491 [0,2,0,0,0,0|2,0,0]=4 11580 B12R1.224 CN(C)Cc1cccc(c1Cl)Br 270004a_100102631434_100012362481 [0,2,0,0,0,0|2,0,0]=4 11581 B12R1.224 CN(C)Cc1cccc(c1Cl)Cl 2230a_100000690605_200000210301 [0,2,0,0,0,0|2,0,0]=4 11582 B12R1.224 CN(C)Cc1cccc(c1Cl)Cl 2230a_100102631434_100000723366 [0,2,0,0,0,0|2,0,0]=4 11583 B12R1.224 CN(C)Cc1cccc(c1Cl)Cl 269982a_100000690605_200000210301 [0,2,0,0,0,0|2,0,0]=4 11584 B12R1.224 CN(C)Cc1cccc(c1Cl)Cl 269982a_100102631434_100000720918 [0,2,0,0,0,0|2,0,0]=4 11585 B12R1.224 CN(C)Cc1cccc(c1Cl)Cl 270004a_100102631434_100000210504 [0,2,0,0,0,0|2,0,0]=4 11586 B12R1.224 CN(C)Cc1cccc(c1Cl)Cl 34a_100000690605_200000210301 [0,2,0,0,0,0|2,0,0]=4 11587 B12R1.224 CN(C)Cc1cccc(c1Cl)F 2230a_100102631434_100000696688 [0,2,0,0,0,0|2,0,0]=4 11588 B12R1.224 CN(C)Cc1cccc(c1Cl)F 269982a_100102631434_100000696688 [0,2,0,0,0,0|2,0,0]=4 11589 B12R1.224 CN(C)Cc1cccc(c1Cl)F 270004a_100102631434_100011998484 [0,2,0,0,0,0|2,0,0]=4 11590 B12R1.224 CN(C)Cc1cccc(c1Cl)O 270004a_100102631434_100000050521 [0,2,0,0,0,0|2,0,0]=4 11591 B12R1.224 CN(C)Cc1cccc(c1F)Br 2230a_100102631434_100012356506 [0,2,0,0,0,0|2,0,0]=4 11592 B12R1.224 CN(C)Cc1cccc(c1F)Br 2230a_114873767014_200000210301 [0,2,0,0,0,0|2,0,0]=4 11593 B12R1.224 CN(C)Cc1cccc(c1F)Br 269982a_100102631434_100012356506 [0,2,0,0,0,0|2,0,0]=4 11594 B12R1.224 CN(C)Cc1cccc(c1F)Br 269982a_114873767014_200000210301 [0,2,0,0,0,0|2,0,0]=4 11595 B12R1.224 CN(C)Cc1cccc(c1F)Br 270004a_100102631434_100011361543 [0,2,0,0,0,0|2,0,0]=4 11596 B12R1.224 CN(C)Cc1cccc(c1F)Br 34a_114873767014_200000210301 [0,2,0,0,0,0|2,0,0]=4 11597 B12R1.224 CN(C)Cc1cccc(c1F)Cl 2230a_100102631434_100000716733 [0,2,0,0,0,0|2,0,0]=4 11598 B12R1.224 CN(C)Cc1cccc(c1F)Cl 269982a_100102631434_100000716733 [0,2,0,0,0,0|2,0,0]=4 11599 B12R1.224 CN(C)Cc1cccc(c1F)Cl 270004a_100102631434_100000766533 [0,2,0,0,0,0|2,0,0]=4 11600 B12R1.224 CN(C)Cc1cccc(c1F)F 2230a_100102631434_100000217499 [0,2,0,0,0,0|2,0,0]=4 11601 B12R1.224 CN(C)Cc1cccc(c1F)F 2230a_102515433064_200000210301 [0,2,0,0,0,0|2,0,0]=4 11602 B12R1.224 CN(C)Cc1cccc(c1F)F 269982a_100102631434_100000217499 [0,2,0,0,0,0|2,0,0]=4 11603 B12R1.224 CN(C)Cc1cccc(c1F)F 269982a_102515433064_200000210301 [0,2,0,0,0,0|2,0,0]=4 11604 B12R1.224 CN(C)Cc1cccc(c1F)F 270004a_100102631434_100000753312 [0,2,0,0,0,0|2,0,0]=4 11605 B12R1.224 CN(C)Cc1cccc(c1F)F 34a_102515433064_200000210301 [0,2,0,0,0,0|2,0,0]=4 11606 B12R1.224 CN(C)Cc1cccc(c1F)I 270004a_100102631434_100010202174 [0,2,0,0,0,0|2,0,0]=4 11607 B12R1.224 CN(C)Cc1cccc(c1I)F 2230a_100102631434_100010149603 [0,2,0,0,0,0|2,0,0]=4 11608 B12R1.224 CN(C)Cc1cccc(c1I)F 269982a_100102631434_100010149603 [0,2,0,0,0,0|2,0,0]=4 11609 B12R1.224 CN(C)Cc1cccc(c1I)F 270004a_100102631434_100010186293 [0,2,0,0,0,0|2,0,0]=4 11610 B12R1.224 CN([13CH3])Cc1cccc(c1Cl)Cl 2230a_100000690605_200025704644 [0,2,0,0,0,0|2,0,0]=4 11611 B12R1.224 CN([13CH3])Cc1cccc(c1Cl)Cl 269982a_100000690605_200025704644 [0,2,0,0,0,0|2,0,0]=4 11612 B12R1.224 CN([13CH3])Cc1cccc(c1Cl)Cl 34a_100000690605_200025704644 [0,2,0,0,0,0|2,0,0]=4 11613 B12R1.224 CN([13CH3])Cc1cccc(c1F)Br 2230a_114873767014_200025704644 [0,2,0,0,0,0|2,0,0]=4 11614 B12R1.224 CN([13CH3])Cc1cccc(c1F)Br 269982a_114873767014_200025704644 [0,2,0,0,0,0|2,0,0]=4 11615 B12R1.224 CN([13CH3])Cc1cccc(c1F)Br 34a_114873767014_200025704644 [0,2,0,0,0,0|2,0,0]=4 11616 B12R1.224 CN([13CH3])Cc1cccc(c1F)F 2230a_102515433064_200025704644 [0,2,0,0,0,0|2,0,0]=4 11617 B12R1.224 CN([13CH3])Cc1cccc(c1F)F 269982a_102515433064_200025704644 [0,2,0,0,0,0|2,0,0]=4 11618 B12R1.224 CN([13CH3])Cc1cccc(c1F)F 34a_102515433064_200025704644 [0,2,0,0,0,0|2,0,0]=4 11619 B12R1.224 Cc1c(cccc1CC(=O)[13CH3])F 1458a_100000035905_200025704644 [0,2,0,0,0,0|1,0,1]=4 11620 B12R1.224 Cc1c(cccc1CN(C)C)Br 2230a_100102631434_100000694682 [0,2,0,0,0,0|2,0,0]=4 11621 B12R1.224 Cc1c(cccc1CN(C)C)Br 269982a_100102631434_100000694682 [0,2,0,0,0,0|2,0,0]=4 11622 B12R1.224 Cc1c(cccc1CN(C)C)Br 270004a_100102631434_100012179384 [0,2,0,0,0,0|2,0,0]=4 11623 B12R1.224 Cc1c(cccc1CN(C)C)Cl 2230a_100102631434_100012186920 [0,2,0,0,0,0|2,0,0]=4 11624 B12R1.224 Cc1c(cccc1CN(C)C)Cl 269982a_100102631434_100012186920 [0,2,0,0,0,0|2,0,0]=4 11625 B12R1.224 Cc1c(cccc1CN(C)C)Cl 270004a_100102631434_100012002129 [0,2,0,0,0,0|2,0,0]=4 11626 B12R1.224 Cc1c(cccc1CN(C)C)F 2230a_100102631434_100009813626 [0,2,0,0,0,0|2,0,0]=4 11627 B12R1.224 Cc1c(cccc1CN(C)C)F 269982a_100102631434_100009813626 [0,2,0,0,0,0|2,0,0]=4 11628 B12R1.224 Cc1c(cccc1CN(C)C)F 270004a_100102631434_100000037668 [0,2,0,0,0,0|2,0,0]=4 11629 B12R1.224 Cc1c(cccc1CN(C)C)I 2230a_100102631434_100010150147 [0,2,0,0,0,0|2,0,0]=4 11630 B12R1.224 Cc1c(cccc1CN(C)C)I 269982a_100102631434_100010150147 [0,2,0,0,0,0|2,0,0]=4 11631 B12R1.224 Cc1c(cccc1CN(C)C)O 270004a_100102631434_100009868165 [0,2,0,0,0,0|2,0,0]=4 11632 B12R1.224 Cc1c(cccc1NC(C)C)Br 34a_100000750434_100000210206 [0,2,0,0,0,0|2,0,0]=4 11633 B12R1.224 Cc1c(cccc1NC(C)C)Cl 2230a_100000210441_100000210206 [0,2,0,0,0,0|2,0,0]=4 11634 B12R1.224 Cc1c(cccc1NC(C)C)Cl 34a_100000210441_100000210206 [0,2,0,0,0,0|2,0,0]=4 11635 B12R1.224 Cc1c(cccc1NC(C)C)Cl 7a_100000210441_100000210206 [0,2,0,0,0,0|2,0,0]=4 11636 B12R1.224 Cc1c(cccc1NC(C)C)F 34a_100000745574_100000210206 [0,2,0,0,0,0|2,0,0]=4 11637 B12R1.224 Cc1c(cccc1NC(C)C)F 7a_100000745574_100000210206 [0,2,0,0,0,0|2,0,0]=4 11638 B12R1.224 Cc1c(cccc1NC(C)C)I 34a_100000761887_100000210206 [0,2,0,0,0,0|2,0,0]=4 11639 B12R1.224 Cc1c(cccc1NC(C)C)O 34a_100011216573_100000210206 [0,2,0,0,0,0|2,0,0]=4 11640 B12R1.224 Cc1c(cccc1NC(C)C)O 7a_100011216573_100000210206 [0,2,0,0,0,0|2,0,0]=4 11641 B12R1.224 Cc1c(cccc1OC(C)C)Br 34a_100012002258_100000210206 [0,2,0,0,0,0|2,0,0]=4 11642 B12R1.224 Cc1c(cccc1OC(C)C)Br 7a_100012002258_100000210206 [0,2,0,0,0,0|2,0,0]=4 11643 B12R1.224 Cc1c(cccc1OC(C)C)Cl 34a_100011265684_100000210206 [0,2,0,0,0,0|2,0,0]=4 11644 B12R1.224 Cc1c(cccc1OC(C)C)Cl 7a_100011265684_100000210206 [0,2,0,0,0,0|2,0,0]=4 11645 B12R1.224 Cc1c(cccc1OC(C)C)F 34a_100011217231_100000210206 [0,2,0,0,0,0|2,0,0]=4 11646 B12R1.224 Cc1c(cccc1OC(C)C)F 7a_100011217231_100000210206 [0,2,0,0,0,0|2,0,0]=4 11647 B12R1.224 Cc1c(cccc1OC(C)C)N 34a_100011216573_100000210206 [0,2,0,0,0,0|2,0,0]=4 11648 B12R1.224 Cc1c(cccc1OC(C)C)N 7a_100011216573_100000210206 [0,2,0,0,0,0|2,0,0]=4 11649 B12R1.224 Cc1c(cccc1SC(C)C)Br 62a_100000210206_100012353703 [0,2,0,0,0,0|2,0,0]=4 11650 B12R1.224 Cc1c(cccc1SC(C)C)Br 62a_100012353703_100000210206 [0,2,0,0,0,0|2,0,0]=4 11651 B12R1.224 Cc1c(cccc1SC(C)C)Cl 62a_100000210206_100000726075 [0,2,0,0,0,0|2,0,0]=4 11652 B12R1.224 Cc1c(cccc1SC(C)C)Cl 62a_100000726075_100000210206 [0,2,0,0,0,0|2,0,0]=4 11653 B12R1.224 Cc1c(cccc1SC(C)C)F 62a_100000210206_100011216893 [0,2,0,0,0,0|2,0,0]=4 11654 B12R1.224 Cc1c(cccc1SC(C)C)F 62a_100011216893_100000210206 [0,2,0,0,0,0|2,0,0]=4 11655 B12R1.224 Cc1c(cccc1SC(C)C)N 62a_100000210206_100000761887 [0,2,0,0,0,0|2,0,0]=4 11656 B12R1.224 Cc1c(cccc1SC(C)C)N 62a_100000761887_100000210206 [0,2,0,0,0,0|2,0,0]=4 11657 B12R1.224 Cc1c(cccc1SC(C)C)O 62a_100000210206_100012002258 [0,2,0,0,0,0|2,0,0]=4 11658 B12R1.224 Cc1c(cccc1SC(C)C)O 62a_100012002258_100000210206 [0,2,0,0,0,0|2,0,0]=4 11659 B12R1.224 Cc1cccc(c1Br)CC(=O)[13CH3] 1458a_100010147021_200025704644 [0,2,0,0,0,0|1,0,1]=4 11660 B12R1.224 Cc1cccc(c1Br)CN(C)C 2230a_100102631434_200012349612 [0,2,0,0,0,0|2,0,0]=4 11661 B12R1.224 Cc1cccc(c1Br)CN(C)C 269982a_100102631434_200012349612 [0,2,0,0,0,0|2,0,0]=4 11662 B12R1.224 Cc1cccc(c1Br)CN(C)C 270004a_100102631434_100012186367 [0,2,0,0,0,0|2,0,0]=4 11663 B12R1.224 Cc1cccc(c1Br)NC(C)C 34a_100000684715_100000210206 [0,2,0,0,0,0|2,0,0]=4 11664 B12R1.224 Cc1cccc(c1Br)OC(C)C 34a_100000686692_100000210206 [0,2,0,0,0,0|2,0,0]=4 11665 B12R1.224 Cc1cccc(c1Br)OC(C)C 7a_100000686692_100000210206 [0,2,0,0,0,0|2,0,0]=4 11666 B12R1.224 Cc1cccc(c1Br)SC(C)C 62a_100000210206_100012362457 [0,2,0,0,0,0|2,0,0]=4 11667 B12R1.224 Cc1cccc(c1Br)SC(C)C 62a_100012362457_100000210206 [0,2,0,0,0,0|2,0,0]=4 11668 B12R1.224 Cc1cccc(c1C)CC(=O)[13CH3] 1458a_100011698479_200025704644 [0,2,0,0,0,0|1,0,1]=4 11669 B12R1.224 Cc1cccc(c1C)CN(C)C 2230a_100000207598_200000210301 [0,2,0,0,0,0|2,0,0]=4 11670 B12R1.224 Cc1cccc(c1C)CN(C)C 2230a_100102631434_100011515928 [0,2,0,0,0,0|2,0,0]=4 11671 B12R1.224 Cc1cccc(c1C)CN(C)C 269982a_100000207598_200000210301 [0,2,0,0,0,0|2,0,0]=4 11672 B12R1.224 Cc1cccc(c1C)CN(C)C 269982a_100102631434_100011515928 [0,2,0,0,0,0|2,0,0]=4 11673 B12R1.224 Cc1cccc(c1C)CN(C)C 270004a_100102631434_100000229941 [0,2,0,0,0,0|2,0,0]=4 11674 B12R1.224 Cc1cccc(c1C)CN(C)C 34a_100000207598_200000210301 [0,2,0,0,0,0|2,0,0]=4 11675 B12R1.224 Cc1cccc(c1C)CN(C)[13CH3] 2230a_100000207598_200025704644 [0,2,0,0,0,0|2,0,0]=4 11676 B12R1.224 Cc1cccc(c1C)CN(C)[13CH3] 269982a_100000207598_200025704644 [0,2,0,0,0,0|2,0,0]=4 11677 B12R1.224 Cc1cccc(c1C)CN(C)[13CH3] 34a_100000207598_200025704644 [0,2,0,0,0,0|2,0,0]=4 11678 B12R1.224 Cc1cccc(c1C)NC(C)C 2230a_100000210026_100000210206 [0,2,0,0,0,0|2,0,0]=4 11679 B12R1.224 Cc1cccc(c1C)NC(C)C 34a_100000210026_100000210206 [0,2,0,0,0,0|2,0,0]=4 11680 B12R1.224 Cc1cccc(c1C)NC(C)C 7a_100000210026_100000210206 [0,2,0,0,0,0|2,0,0]=4 11681 B12R1.224 Cc1cccc(c1C)OC(C)C 34a_100000185855_100000210206 [0,2,0,0,0,0|2,0,0]=4 11682 B12R1.224 Cc1cccc(c1C)OC(C)C 7a_100000185855_100000210206 [0,2,0,0,0,0|2,0,0]=4 11683 B12R1.224 Cc1cccc(c1C)SC(C)C 62a_100000210206_100011214922 [0,2,0,0,0,0|2,0,0]=4 11684 B12R1.224 Cc1cccc(c1C)SC(C)C 62a_100011214922_100000210206 [0,2,0,0,0,0|2,0,0]=4 11685 B12R1.224 Cc1cccc(c1Cl)CN(C)C 270004a_100102631434_100012017286 [0,2,0,0,0,0|2,0,0]=4 11686 B12R1.224 Cc1cccc(c1Cl)NC(C)C 34a_100000765562_100000210206 [0,2,0,0,0,0|2,0,0]=4 11687 B12R1.224 Cc1cccc(c1Cl)NC(C)C 7a_100000765562_100000210206 [0,2,0,0,0,0|2,0,0]=4 11688 B12R1.224 Cc1cccc(c1Cl)OC(C)C 34a_100000695629_100000210206 [0,2,0,0,0,0|2,0,0]=4 11689 B12R1.224 Cc1cccc(c1Cl)OC(C)C 7a_100000695629_100000210206 [0,2,0,0,0,0|2,0,0]=4 11690 B12R1.224 Cc1cccc(c1Cl)SC(C)C 62a_100000210206_200012352035 [0,2,0,0,0,0|2,0,0]=4 11691 B12R1.224 Cc1cccc(c1Cl)SC(C)C 62a_200012352035_100000210206 [0,2,0,0,0,0|2,0,0]=4 11692 B12R1.224 Cc1cccc(c1F)CN(C)C 2230a_100102631434_100011216058 [0,2,0,0,0,0|2,0,0]=4 11693 B12R1.224 Cc1cccc(c1F)CN(C)C 269982a_100102631434_100011216058 [0,2,0,0,0,0|2,0,0]=4 11694 B12R1.224 Cc1cccc(c1F)CN(C)C 270004a_100102631434_100011219516 [0,2,0,0,0,0|2,0,0]=4 11695 B12R1.224 Cc1cccc(c1F)NC(C)C 2230a_100000697159_100000210206 [0,2,0,0,0,0|2,0,0]=4 11696 B12R1.224 Cc1cccc(c1F)NC(C)C 34a_100000697159_100000210206 [0,2,0,0,0,0|2,0,0]=4 11697 B12R1.224 Cc1cccc(c1F)NC(C)C 7a_100000697159_100000210206 [0,2,0,0,0,0|2,0,0]=4 11698 B12R1.224 Cc1cccc(c1F)OC(C)C 34a_100000751311_100000210206 [0,2,0,0,0,0|2,0,0]=4 11699 B12R1.224 Cc1cccc(c1F)OC(C)C 7a_100000751311_100000210206 [0,2,0,0,0,0|2,0,0]=4 11700 B12R1.224 Cc1cccc(c1F)SC(C)C 62a_100000210206_100000717567 [0,2,0,0,0,0|2,0,0]=4 11701 B12R1.224 Cc1cccc(c1F)SC(C)C 62a_100000717567_100000210206 [0,2,0,0,0,0|2,0,0]=4 11702 B12R1.224 Cc1cccc(c1I)NC(C)C 34a_100000761888_100000210206 [0,2,0,0,0,0|2,0,0]=4 11703 B12R1.224 Cc1cccc(c1I)OC(C)C 34a_100010083724_100000210206 [0,2,0,0,0,0|2,0,0]=4 11704 B12R1.224 Cc1cccc(c1I)OC(C)C 7a_100010083724_100000210206 [0,2,0,0,0,0|2,0,0]=4 11705 B12R1.224 Cc1cccc(c1N)OC(C)C 34a_100000743429_100000210206 [0,2,0,0,0,0|2,0,0]=4 11706 B12R1.224 Cc1cccc(c1N)OC(C)C 7a_100000743429_100000210206 [0,2,0,0,0,0|2,0,0]=4 11707 B12R1.224 Cc1cccc(c1N)SC(C)C 62a_100000210206_100011834072 [0,2,0,0,0,0|2,0,0]=4 11708 B12R1.224 Cc1cccc(c1N)SC(C)C 62a_100011834072_100000210206 [0,2,0,0,0,0|2,0,0]=4 11709 B12R1.224 Cc1cccc(c1O)CC(=O)N 271570a_203496583355_100011096275 [0,2,0,0,0,0|1,0,1]=4 11710 B12R1.224 Cc1cccc(c1O)NC(C)C 34a_100000756359_100000210206 [0,2,0,0,0,0|1,0,0]=3 11711 B12R1.224 Cc1cccc(c1O)SC(C)C 62a_100000210206_100009817157 [0,2,0,0,0,0|1,0,0]=3 11712 B12R1.224 Cc1cccc(c1O)SC(C)C 62a_100009817157_100000210206 [0,2,0,0,0,0|1,0,0]=3 11713 B12R1.224 Cc1ccnc(c1O)SC(C)C 62a_100000210206_100000696282 [0,2,0,0,0,0|2,0,0]=4 11714 B12R1.224 Oc1c(cccc1OC(F)F)F 271570a_203496583355_100010146002 [0,2,0,0,0,0|2,0,0]=4 11715 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_200025704644 [0,2,0,0,0,0|1,0,1]=4 11716 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Br)F 1458a_100012356664_200025704644 [0,2,0,0,0,0|1,0,1]=4 11717 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_200025704644 [0,2,0,0,0,0|1,0,1]=4 11718 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_200025704644 [0,2,0,0,0,0|1,0,1]=4 11719 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)F 1458a_100012001123_200025704644 [0,2,0,0,0,0|1,0,1]=4 11720 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)Br 1458a_100011935088_200025704644 [0,2,0,0,0,0|1,0,1]=4 11721 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)Cl 1458a_100000709823_200025704644 [0,2,0,0,0,0|1,0,1]=4 11722 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)F 1458a_100000684727_200025704644 [0,2,0,0,0,0|1,0,1]=4 11723 B12R1.280 C=Cc1cccc(c1C)CCN 271570a_100011290941_100161000114 [0,2,0,0,0,0|2,0,0]=4 11724 B12R1.280 C=Cc1cccc(c1C)COC 271570a_100011290941_100102485947 [0,2,0,0,0,0|2,0,0]=4 11725 B12R1.280 C=Cc1cccc(c1F)CNC 271570a_100011290941_114873767014 [0,2,0,0,0,0|2,0,0]=4 11726 B12R1.280 C=Cc1cccc(c1F)SCC 62a_100000210202_100010741937 [0,2,0,0,0,0|2,0,0]=4 11727 B12R1.280 C=Cc1cccc(c1F)SCC 62a_100010741937_100000210202 [0,2,0,0,0,0|2,0,0]=4 11728 B12R1.280 C=Cc1cccc(c1N)OCC 271570a_100011290941_200103155331 [0,2,0,0,0,0|2,0,0]=4 11729 B12R1.280 CC=Cc1cccc(c1O)C#N 271570a_100016259895_100009817103 [0,2,0,0,0,0|0,0,2]=4 11730 B12R1.280 CC=Cc1cccc(c1O)C=O 271570a_100016259895_100000737635 [0,2,0,0,0,0|0,0,2]=4 11731 B12R1.280 CC=Cc1cccc(c1O)CC 271570a_100016259895_200010001580 [0,2,0,0,0,0|0,0,2]=4 11732 B12R1.280 CC=Cc1cccc(c1O)OC 271570a_100016259895_100000686866 [0,2,0,0,0,0|0,0,2]=4 11733 B12R1.280 CCNc1cccc(c1Br)C#N 34a_100009877206_100000210202 [0,2,0,0,0,0|2,0,0]=4 11734 B12R1.280 CCNc1cccc(c1Br)OC 34a_100000703447_100000210202 [0,2,0,0,0,0|2,0,0]=4 11735 B12R1.280 CCNc1cccc(c1C)CO 2230a_102495339961_100000210202 [0,2,0,0,0,0|2,0,0]=4 11736 B12R1.280 CCNc1cccc(c1C)CO 34a_102495339961_100000210202 [0,2,0,0,0,0|2,0,0]=4 11737 B12R1.280 CCNc1cccc(c1C)OC 34a_100011244893_100000210202 [0,2,0,0,0,0|2,0,0]=4 11738 B12R1.280 CCNc1cccc(c1C)OC 7a_100011244893_100000210202 [0,2,0,0,0,0|2,0,0]=4 11739 B12R1.280 CCNc1cccc(c1Cl)C#N 34a_100012184300_100000210202 [0,2,0,0,0,0|2,0,0]=4 11740 B12R1.280 CCNc1cccc(c1Cl)OC 34a_100000089720_100000210202 [0,2,0,0,0,0|2,0,0]=4 11741 B12R1.280 CCNc1cccc(c1F)C#N 34a_100000087142_100000210202 [0,2,0,0,0,0|2,0,0]=4 11742 B12R1.280 CCNc1cccc(c1F)CO 34a_100012023829_100000210202 [0,2,0,0,0,0|2,0,0]=4 11743 B12R1.280 CCNc1cccc(c1F)OC 34a_100000100910_100000210202 [0,2,0,0,0,0|2,0,0]=4 11744 B12R1.280 CCNc1cccc(c1I)OC 34a_100010245509_100000210202 [0,2,0,0,0,0|2,0,0]=4 11745 B12R1.280 CCNc1cccc(c1O)OC 34a_100000123586_100000210202 [0,2,0,0,0,0|1,0,0]=3 11746 B12R1.280 CCOc1cccc(c1Br)C#N 34a_100009818990_100000210202 [0,2,0,0,0,0|2,0,0]=4 11747 B12R1.280 CCOc1cccc(c1Br)C#N 7a_100009818990_100000210202 [0,2,0,0,0,0|2,0,0]=4 11748 B12R1.280 CCOc1cccc(c1Br)OC 34a_100010202623_100000210202 [0,2,0,0,0,0|2,0,0]=4 11749 B12R1.280 CCOc1cccc(c1Br)OC 7a_100010202623_100000210202 [0,2,0,0,0,0|2,0,0]=4 11750 B12R1.280 CCOc1cccc(c1C)C#N 34a_100000079589_100000210202 [0,2,0,0,0,0|2,0,0]=4 11751 B12R1.280 CCOc1cccc(c1C)C#N 7a_100000079589_100000210202 [0,2,0,0,0,0|2,0,0]=4 11752 B12R1.280 CCOc1cccc(c1C)CO 34a_200000084602_100000210202 [0,2,0,0,0,0|2,0,0]=4 11753 B12R1.280 CCOc1cccc(c1C)CO 7a_200000084602_100000210202 [0,2,0,0,0,0|2,0,0]=4 11754 B12R1.280 CCOc1cccc(c1Cl)C#N 34a_200009871651_100000210202 [0,2,0,0,0,0|2,0,0]=4 11755 B12R1.280 CCOc1cccc(c1Cl)C#N 7a_200009871651_100000210202 [0,2,0,0,0,0|2,0,0]=4 11756 B12R1.280 CCOc1cccc(c1Cl)OC 34a_100000087810_100000210202 [0,2,0,0,0,0|2,0,0]=4 11757 B12R1.280 CCOc1cccc(c1Cl)OC 7a_100000087810_100000210202 [0,2,0,0,0,0|2,0,0]=4 11758 B12R1.280 CCOc1cccc(c1F)C#N 34a_200000094591_100000210202 [0,2,0,0,0,0|2,0,0]=4 11759 B12R1.280 CCOc1cccc(c1F)C#N 7a_200000094591_100000210202 [0,2,0,0,0,0|2,0,0]=4 11760 B12R1.280 CCOc1cccc(c1F)CN 34a_100025773512_100000210202 [0,2,0,0,0,0|2,0,0]=4 11761 B12R1.280 CCOc1cccc(c1F)OC 34a_100000102366_100000210202 [0,2,0,0,0,0|2,0,0]=4 11762 B12R1.280 CCOc1cccc(c1F)OC 7a_100000102366_100000210202 [0,2,0,0,0,0|2,0,0]=4 11763 B12R1.280 CCOc1cccc(c1I)OC 34a_200010201982_100000210202 [0,2,0,0,0,0|2,0,0]=4 11764 B12R1.280 CCOc1cccc(c1I)OC 7a_200010201982_100000210202 [0,2,0,0,0,0|2,0,0]=4 11765 B12R1.280 CCOc1cccc(c1N)OC 34a_100012022766_100000210202 [0,2,0,0,0,0|2,0,0]=4 11766 B12R1.280 CCOc1cccc(c1N)OC 7a_100012022766_100000210202 [0,2,0,0,0,0|2,0,0]=4 11767 B12R1.280 CCOc1cccc(c1N)SC 62a_200103155331_200000210301 [0,2,0,0,0,0|2,0,0]=4 11768 B12R1.280 CCOc1cccc(c1N)S[13CH3] 62a_200103155331_200025704644 [0,2,0,0,0,0|2,0,0]=4 11769 B12R1.280 CCSc1cccc(c1Br)CO 62a_100000210202_100010240205 [0,2,0,0,0,0|2,0,0]=4 11770 B12R1.280 CCSc1cccc(c1Br)CO 62a_100010240205_100000210202 [0,2,0,0,0,0|2,0,0]=4 11771 B12R1.280 CCSc1cccc(c1Br)OC 62a_100000210202_100010146559 [0,2,0,0,0,0|2,0,0]=4 11772 B12R1.280 CCSc1cccc(c1Br)OC 62a_100010146559_100000210202 [0,2,0,0,0,0|2,0,0]=4 11773 B12R1.280 CCSc1cccc(c1C)C#N 62a_100000210202_100000721996 [0,2,0,0,0,0|2,0,0]=4 11774 B12R1.280 CCSc1cccc(c1C)C=O 62a_100000210202_100012179384 [0,2,0,0,0,0|2,0,0]=4 11775 B12R1.280 CCSc1cccc(c1C)C=O 62a_100012179384_100000210202 [0,2,0,0,0,0|2,0,0]=4 11776 B12R1.280 CCSc1cccc(c1C)CN 62a_100000210202_100000724210 [0,2,0,0,0,0|2,0,0]=4 11777 B12R1.280 CCSc1cccc(c1C)CN 62a_100000724210_100000210202 [0,2,0,0,0,0|2,0,0]=4 11778 B12R1.280 CCSc1cccc(c1C)CO 62a_100000210202_100000694458 [0,2,0,0,0,0|2,0,0]=4 11779 B12R1.280 CCSc1cccc(c1C)CO 62a_100000694458_100000210202 [0,2,0,0,0,0|2,0,0]=4 11780 B12R1.280 CCSc1cccc(c1C)OC 62a_100000210202_100010002647 [0,2,0,0,0,0|2,0,0]=4 11781 B12R1.280 CCSc1cccc(c1C)OC 62a_100010002647_100000210202 [0,2,0,0,0,0|2,0,0]=4 11782 B12R1.280 CCSc1cccc(c1Cl)OC 62a_100000210202_100010147677 [0,2,0,0,0,0|2,0,0]=4 11783 B12R1.280 CCSc1cccc(c1Cl)OC 62a_100010147677_100000210202 [0,2,0,0,0,0|2,0,0]=4 11784 B12R1.280 CCSc1cccc(c1F)C#N 62a_100000210202_100000239898 [0,2,0,0,0,0|2,0,0]=4 11785 B12R1.280 CCSc1cccc(c1F)C=O 62a_100000210202_100000766533 [0,2,0,0,0,0|2,0,0]=4 11786 B12R1.280 CCSc1cccc(c1F)C=O 62a_100000766533_100000210202 [0,2,0,0,0,0|2,0,0]=4 11787 B12R1.280 CCSc1cccc(c1F)CN 62a_100000210202_100015189953 [0,2,0,0,0,0|2,0,0]=4 11788 B12R1.280 CCSc1cccc(c1F)CN 62a_100015189953_100000210202 [0,2,0,0,0,0|2,0,0]=4 11789 B12R1.280 CCSc1cccc(c1F)CO 62a_100000210202_100011935076 [0,2,0,0,0,0|2,0,0]=4 11790 B12R1.280 CCSc1cccc(c1F)CO 62a_100011935076_100000210202 [0,2,0,0,0,0|2,0,0]=4 11791 B12R1.280 CCSc1cccc(c1F)OC 62a_100000210202_100010185846 [0,2,0,0,0,0|2,0,0]=4 11792 B12R1.280 CCSc1cccc(c1F)OC 62a_100010185846_100000210202 [0,2,0,0,0,0|2,0,0]=4 11793 B12R1.280 CCSc1cccc(c1N)C#N 62a_100000210202_100011934406 [0,2,0,0,0,0|2,0,0]=4 11794 B12R1.280 CCSc1cccc(c1N)C=O 62a_100010144990_100000210202 [0,2,0,0,0,0|2,0,0]=4 11795 B12R1.280 CCSc1cccc(c1N)CO 62a_100000210202_100012349457 [0,2,0,0,0,0|2,0,0]=4 11796 B12R1.280 CCSc1cccc(c1N)CO 62a_100012349457_100000210202 [0,2,0,0,0,0|2,0,0]=4 11797 B12R1.280 CCSc1cccc(c1N)NC 62a_100000695761_100000210202 [0,2,0,0,0,0|2,0,0]=4 11798 B12R1.280 CCSc1cccc(c1N)OC 62a_100000708083_100000210202 [0,2,0,0,0,0|2,0,0]=4 11799 B12R1.280 CCSc1cccc(c1O)C#N 62a_100000210202_100009817103 [0,2,0,0,0,0|1,0,0]=3 11800 B12R1.280 CCSc1cccc(c1O)C=O 62a_100000210202_100010171435 [0,2,0,0,0,0|1,0,0]=3 11801 B12R1.280 CCSc1cccc(c1O)CC 62a_100000210202_200010001580 [0,2,0,0,0,0|1,0,0]=3 11802 B12R1.280 CCSc1cccc(c1O)CC 62a_200010001580_100000210202 [0,2,0,0,0,0|1,0,0]=3 11803 B12R1.280 CCSc1cccc(c1O)OC 62a_100000210202_100000686866 [0,2,0,0,0,0|1,0,0]=3 11804 B12R1.280 CCSc1cncc(c1O)C=O 62a_100000210202_100010729654 [0,2,0,0,0,0|2,0,0]=4 11805 B12R1.280 CCSc1cncc(c1O)C=O 62a_100010729654_100000210202 [0,2,0,0,0,0|2,0,0]=4 11806 B12R1.280 CCc1cccc(c1O)SCF 62a_100015361967_200010001580 [0,2,0,0,0,0|2,0,0]=4 11807 B12R1.280 CCc1cccc(c1O)SCF 62a_200010001580_100015361967 [0,2,0,0,0,0|2,0,0]=4 11808 B12R1.280 CNCc1cccc(c1Br)C#N 2230a_106832991635_100010145452 [0,2,0,0,0,0|2,0,0]=4 11809 B12R1.280 CNCc1cccc(c1Br)C#N 26a_100102657272_100009818990 [0,2,0,0,0,0|2,0,0]=4 11810 B12R1.280 CNCc1cccc(c1Br)C#N 34a_100102657272_100010145452 [0,2,0,0,0,0|2,0,0]=4 11811 B12R1.280 CNCc1cccc(c1Br)C#N 7a_106832991635_100010145452 [0,2,0,0,0,0|2,0,0]=4 11812 B12R1.280 CNCc1cccc(c1Br)OC 207a_100102657272_100010209554 [0,2,0,0,0,0|2,0,0]=4 11813 B12R1.280 CNCc1cccc(c1Br)OC 26a_100102657272_100010202623 [0,2,0,0,0,0|2,0,0]=4 11814 B12R1.280 CNCc1cccc(c1Br)OC 270004a_106832991635_100010209554 [0,2,0,0,0,0|2,0,0]=4 11815 B12R1.280 CNCc1cccc(c1C)C#N 207a_100102657272_200009888290 [0,2,0,0,0,0|2,0,0]=4 11816 B12R1.280 CNCc1cccc(c1C)C#N 270004a_106832991635_200009888290 [0,2,0,0,0,0|2,0,0]=4 11817 B12R1.280 CNCc1cccc(c1C)OC 207a_100102657272_100000101217 [0,2,0,0,0,0|2,0,0]=4 11818 B12R1.280 CNCc1cccc(c1C)OC 2230a_106832991635_100009876938 [0,2,0,0,0,0|2,0,0]=4 11819 B12R1.280 CNCc1cccc(c1C)OC 270004a_106832991635_100000101217 [0,2,0,0,0,0|2,0,0]=4 11820 B12R1.280 CNCc1cccc(c1C)OC 34a_100102657272_100009876938 [0,2,0,0,0,0|2,0,0]=4 11821 B12R1.280 CNCc1cccc(c1C)OC 7a_106832991635_100009876938 [0,2,0,0,0,0|2,0,0]=4 11822 B12R1.280 CNCc1cccc(c1Cl)C#N 2230a_106832991635_100010147161 [0,2,0,0,0,0|2,0,0]=4 11823 B12R1.280 CNCc1cccc(c1Cl)C#N 26a_100102657272_200009871651 [0,2,0,0,0,0|2,0,0]=4 11824 B12R1.280 CNCc1cccc(c1Cl)C#N 7a_106832991635_100010147161 [0,2,0,0,0,0|2,0,0]=4 11825 B12R1.280 CNCc1cccc(c1Cl)OC 207a_100102657272_100000068750 [0,2,0,0,0,0|2,0,0]=4 11826 B12R1.280 CNCc1cccc(c1Cl)OC 2230a_106832991635_200010147866 [0,2,0,0,0,0|2,0,0]=4 11827 B12R1.280 CNCc1cccc(c1Cl)OC 26a_100102657272_100000087810 [0,2,0,0,0,0|2,0,0]=4 11828 B12R1.280 CNCc1cccc(c1Cl)OC 270004a_106832991635_100000068750 [0,2,0,0,0,0|2,0,0]=4 11829 B12R1.280 CNCc1cccc(c1Cl)OC 34a_100102657272_200010147866 [0,2,0,0,0,0|2,0,0]=4 11830 B12R1.280 CNCc1cccc(c1Cl)OC 7a_106832991635_200010147866 [0,2,0,0,0,0|2,0,0]=4 11831 B12R1.280 CNCc1cccc(c1F)C#N 2230a_106832991635_100000695645 [0,2,0,0,0,0|2,0,0]=4 11832 B12R1.280 CNCc1cccc(c1F)C#N 34a_100102657272_100000695645 [0,2,0,0,0,0|2,0,0]=4 11833 B12R1.280 CNCc1cccc(c1F)C#N 7a_106832991635_100000695645 [0,2,0,0,0,0|2,0,0]=4 11834 B12R1.280 CNCc1cccc(c1F)OC 207a_100102657272_100000692048 [0,2,0,0,0,0|2,0,0]=4 11835 B12R1.280 CNCc1cccc(c1F)OC 2230a_106832991635_100011260763 [0,2,0,0,0,0|2,0,0]=4 11836 B12R1.280 CNCc1cccc(c1F)OC 270004a_106832991635_100000692048 [0,2,0,0,0,0|2,0,0]=4 11837 B12R1.280 CNCc1cccc(c1F)OC 34a_100102657272_100011260763 [0,2,0,0,0,0|2,0,0]=4 11838 B12R1.280 CNCc1cccc(c1F)OC 34a_100137345169_200000210301 [0,2,0,0,0,0|2,0,0]=4 11839 B12R1.280 CNCc1cccc(c1F)OC 7a_106832991635_100011260763 [0,2,0,0,0,0|2,0,0]=4 11840 B12R1.280 CNCc1cccc(c1F)SC 62a_114873767014_200000210301 [0,2,0,0,0,0|2,0,0]=4 11841 B12R1.280 CNCc1cccc(c1F)SC 62a_200000210301_114873767014 [0,2,0,0,0,0|2,0,0]=4 11842 B12R1.280 CNCc1cccc(c1F)S[13CH3] 62a_114873767014_200025704644 [0,2,0,0,0,0|2,0,0]=4 11843 B12R1.280 CNCc1cccc(c1F)S[13CH3] 62a_200025704644_114873767014 [0,2,0,0,0,0|2,0,0]=4 11844 B12R1.280 COCc1cccc(c1Br)C#N 34a_100138415774_100010145452 [0,2,0,0,0,0|2,0,0]=4 11845 B12R1.280 COCc1cccc(c1Br)OC 34a_100010146792_200000210301 [0,2,0,0,0,0|2,0,0]=4 11846 B12R1.280 COCc1cccc(c1Br)OC 7a_100010146792_200000210301 [0,2,0,0,0,0|2,0,0]=4 11847 B12R1.280 COCc1cccc(c1C)OC 34a_100009871736_200000210301 [0,2,0,0,0,0|2,0,0]=4 11848 B12R1.280 COCc1cccc(c1C)OC 34a_100138415774_100009876938 [0,2,0,0,0,0|2,0,0]=4 11849 B12R1.280 COCc1cccc(c1C)OC 7a_100009871736_200000210301 [0,2,0,0,0,0|2,0,0]=4 11850 B12R1.280 COCc1cccc(c1C)SC 62a_100102485947_200000210301 [0,2,0,0,0,0|2,0,0]=4 11851 B12R1.280 COCc1cccc(c1C)SC 62a_200000210301_100102485947 [0,2,0,0,0,0|2,0,0]=4 11852 B12R1.280 COCc1cccc(c1C)S[13CH3] 62a_100102485947_200025704644 [0,2,0,0,0,0|2,0,0]=4 11853 B12R1.280 COCc1cccc(c1C)S[13CH3] 62a_200025704644_100102485947 [0,2,0,0,0,0|2,0,0]=4 11854 B12R1.280 COCc1cccc(c1Cl)OC 34a_100138415774_200010147866 [0,2,0,0,0,0|2,0,0]=4 11855 B12R1.280 COCc1cccc(c1F)C#N 34a_100012181476_200000210301 [0,2,0,0,0,0|2,0,0]=4 11856 B12R1.280 COCc1cccc(c1F)C#N 34a_100138415774_100000695645 [0,2,0,0,0,0|2,0,0]=4 11857 B12R1.280 COCc1cccc(c1F)C#N 7a_100012181476_200000210301 [0,2,0,0,0,0|2,0,0]=4 11858 B12R1.280 COCc1cccc(c1F)OC 34a_100011935170_200000210301 [0,2,0,0,0,0|2,0,0]=4 11859 B12R1.280 COCc1cccc(c1F)OC 34a_100138415774_100011260763 [0,2,0,0,0,0|2,0,0]=4 11860 B12R1.280 COCc1cccc(c1F)OC 7a_100011935170_200000210301 [0,2,0,0,0,0|2,0,0]=4 11861 B12R1.280 COCc1cccc(c1I)OC 34a_100010236476_200000210301 [0,2,0,0,0,0|2,0,0]=4 11862 B12R1.280 COCc1cccc(c1I)OC 7a_100010236476_200000210301 [0,2,0,0,0,0|2,0,0]=4 11863 B12R1.280 COCc1cccc(c1N)OC 34a_100011999522_200000210301 [0,2,0,0,0,0|2,0,0]=4 11864 B12R1.280 COc1cccc(c1Br)CO[13CH3] 34a_100010146792_200025704644 [0,2,0,0,0,0|2,0,0]=4 11865 B12R1.280 COc1cccc(c1Br)CO[13CH3] 7a_100010146792_200025704644 [0,2,0,0,0,0|2,0,0]=4 11866 B12R1.280 COc1cccc(c1C)CO[13CH3] 34a_100009871736_200025704644 [0,2,0,0,0,0|2,0,0]=4 11867 B12R1.280 COc1cccc(c1C)CO[13CH3] 7a_100009871736_200025704644 [0,2,0,0,0,0|2,0,0]=4 11868 B12R1.280 COc1cccc(c1C)CSC 62a_100009876938_200000210301 [0,2,0,0,0,0|2,0,0]=4 11869 B12R1.280 COc1cccc(c1C)CSC 62a_200000210301_100009876938 [0,2,0,0,0,0|2,0,0]=4 11870 B12R1.280 COc1cccc(c1C)CS[13CH3] 62a_100009876938_200025704644 [0,2,0,0,0,0|2,0,0]=4 11871 B12R1.280 COc1cccc(c1C)CS[13CH3] 62a_200025704644_100009876938 [0,2,0,0,0,0|2,0,0]=4 11872 B12R1.280 COc1cccc(c1Cl)CSC 62a_200000210301_200010147866 [0,2,0,0,0,0|2,0,0]=4 11873 B12R1.280 COc1cccc(c1Cl)CSC 62a_200010147866_200000210301 [0,2,0,0,0,0|2,0,0]=4 11874 B12R1.280 COc1cccc(c1Cl)CS[13CH3] 62a_200010147866_200025704644 [0,2,0,0,0,0|2,0,0]=4 11875 B12R1.280 COc1cccc(c1Cl)CS[13CH3] 62a_200025704644_200010147866 [0,2,0,0,0,0|2,0,0]=4 11876 B12R1.280 COc1cccc(c1F)CN[13CH3] 34a_100137345169_200025704644 [0,2,0,0,0,0|2,0,0]=4 11877 B12R1.280 COc1cccc(c1F)CO[13CH3] 34a_100011935170_200025704644 [0,2,0,0,0,0|2,0,0]=4 11878 B12R1.280 COc1cccc(c1F)CO[13CH3] 7a_100011935170_200025704644 [0,2,0,0,0,0|2,0,0]=4 11879 B12R1.280 COc1cccc(c1F)CSC 62a_100011260763_200000210301 [0,2,0,0,0,0|2,0,0]=4 11880 B12R1.280 COc1cccc(c1F)CSC 62a_200000210301_100011260763 [0,2,0,0,0,0|2,0,0]=4 11881 B12R1.280 COc1cccc(c1F)CS[13CH3] 62a_100011260763_200025704644 [0,2,0,0,0,0|2,0,0]=4 11882 B12R1.280 COc1cccc(c1F)CS[13CH3] 62a_200025704644_100011260763 [0,2,0,0,0,0|2,0,0]=4 11883 B12R1.280 COc1cccc(c1I)CO[13CH3] 34a_100010236476_200025704644 [0,2,0,0,0,0|2,0,0]=4 11884 B12R1.280 COc1cccc(c1I)CO[13CH3] 7a_100010236476_200025704644 [0,2,0,0,0,0|2,0,0]=4 11885 B12R1.280 COc1cccc(c1N)CO[13CH3] 34a_100011999522_200025704644 [0,2,0,0,0,0|2,0,0]=4 11886 B12R1.280 COc1cccc(c1O)NCF 34a_100000123586_100015361967 [0,2,0,0,0,0|2,0,0]=4 11887 B12R1.280 COc1cccc(c1O)SCF 62a_100015361967_100000686866 [0,2,0,0,0,0|2,0,0]=4 11888 B12R1.280 CSCc1cccc(c1Br)C#N 62a_100010145452_200000210301 [0,2,0,0,0,0|2,0,0]=4 11889 B12R1.280 CSCc1cccc(c1Br)C#N 62a_200000210301_100010145452 [0,2,0,0,0,0|2,0,0]=4 11890 B12R1.280 CSCc1cccc(c1Cl)C#N 62a_200000210301_100010147161 [0,2,0,0,0,0|2,0,0]=4 11891 B12R1.280 CSCc1cccc(c1F)C#N 62a_200000210301_100000695645 [0,2,0,0,0,0|2,0,0]=4 11892 B12R1.280 CSc1cccc(c1C)CCN 62a_100161000114_200000210301 [0,2,0,0,0,0|2,0,0]=4 11893 B12R1.280 CSc1cccc(c1C)CCN 62a_200000210301_100161000114 [0,2,0,0,0,0|2,0,0]=4 11894 B12R1.280 Cc1c(cccc1S[13CH3])CCN 62a_100161000114_200025704644 [0,2,0,0,0,0|2,0,0]=4 11895 B12R1.280 Cc1c(cccc1S[13CH3])CCN 62a_200025704644_100161000114 [0,2,0,0,0,0|2,0,0]=4 11896 B12R1.280 N#Cc1cccc(c1O)SCF 62a_100015361967_100009817103 [0,2,0,0,0,0|2,0,0]=4 11897 B12R1.280 O=Cc1cccc(c1O)SCF 62a_100015361967_100010171435 [0,2,0,0,0,0|2,0,0]=4 11898 B12R1.280 [13CH3]OCc1cccc(c1F)C#N 34a_100012181476_200025704644 [0,2,0,0,0,0|2,0,0]=4 11899 B12R1.280 [13CH3]OCc1cccc(c1F)C#N 7a_100012181476_200025704644 [0,2,0,0,0,0|2,0,0]=4 11900 B12R1.280 [13CH3]SCc1cccc(c1Br)C#N 62a_100010145452_200025704644 [0,2,0,0,0,0|2,0,0]=4 11901 B12R1.280 [13CH3]SCc1cccc(c1Br)C#N 62a_200025704644_100010145452 [0,2,0,0,0,0|2,0,0]=4 11902 B12R1.280 [13CH3]SCc1cccc(c1Cl)C#N 62a_200025704644_100010147161 [0,2,0,0,0,0|2,0,0]=4 11903 B12R1.280 [13CH3]SCc1cccc(c1F)C#N 62a_200025704644_100000695645 [0,2,0,0,0,0|2,0,0]=4 11904 B12R1.497 CC=Cc1c(ccc(c1O)F)C 271570a_100016259895_200010223207 [0,2,0,0,0,0|0,0,2]=4 11905 B12R1.497 CC=Cc1c(ccc(c1O)F)F 271570a_100016259895_100010170822 [0,2,0,0,0,0|0,0,2]=4 11906 B12R1.497 CCNc1c(ccc(c1Br)F)F 34a_100014094178_100000210202 [0,2,0,0,0,0|2,0,0]=4 11907 B12R1.497 CCNc1c(ccc(c1C)Br)C 34a_200010074581_100000210202 [0,2,0,0,0,0|2,0,0]=4 11908 B12R1.497 CCNc1c(ccc(c1C)Br)F 2230a_100010588651_100000210202 [0,2,0,0,0,0|2,0,0]=4 11909 B12R1.497 CCNc1c(ccc(c1C)Br)F 34a_100010588651_100000210202 [0,2,0,0,0,0|2,0,0]=4 11910 B12R1.497 CCNc1c(ccc(c1C)Br)O 34a_100013039247_100000210202 [0,2,0,0,0,0|1,0,0]=3 11911 B12R1.497 CCNc1c(ccc(c1C)C)C 2230a_100000117417_100000210202 [0,2,0,0,0,0|2,0,0]=4 11912 B12R1.497 CCNc1c(ccc(c1C)C)C 34a_100000117417_100000210202 [0,2,0,0,0,0|2,0,0]=4 11913 B12R1.497 CCNc1c(ccc(c1C)C)C 7a_100000117417_100000210202 [0,2,0,0,0,0|2,0,0]=4 11914 B12R1.497 CCNc1c(ccc(c1C)Cl)C 2230a_200020642106_100000210202 [0,2,0,0,0,0|2,0,0]=4 11915 B12R1.497 CCNc1c(ccc(c1C)Cl)C 34a_200020642106_100000210202 [0,2,0,0,0,0|2,0,0]=4 11916 B12R1.497 CCNc1c(ccc(c1C)Cl)Cl 34a_100009961198_100000210202 [0,2,0,0,0,0|2,0,0]=4 11917 B12R1.497 CCNc1c(ccc(c1C)F)Br 34a_100011009917_100000210202 [0,2,0,0,0,0|2,0,0]=4 11918 B12R1.497 CCNc1c(ccc(c1C)I)C 34a_200010115591_100000210202 [0,2,0,0,0,0|2,0,0]=4 11919 B12R1.497 CCNc1c(ccc(c1Cl)C)Cl 34a_100000210993_100000210202 [0,2,0,0,0,0|2,0,0]=4 11920 B12R1.497 CCNc1c(ccc(c1Cl)C)F 34a_106744479701_100000210202 [0,2,0,0,0,0|2,0,0]=4 11921 B12R1.497 CCNc1c(ccc(c1Cl)Cl)Cl 34a_103437851083_100000210202 [0,2,0,0,0,0|2,0,0]=4 11922 B12R1.497 CCNc1c(ccc(c1Cl)Cl)F 34a_100000061523_100000210202 [0,2,0,0,0,0|2,0,0]=4 11923 B12R1.497 CCNc1c(ccc(c1Cl)F)F 34a_100000062006_100000210202 [0,2,0,0,0,0|2,0,0]=4 11924 B12R1.497 CCNc1c(ccc(c1Cl)O)Cl 34a_100016988457_100000210202 [0,2,0,0,0,0|2,0,0]=4 11925 B12R1.497 CCNc1c(ccc(c1Cl)O)Cl 7a_100016988457_100000210202 [0,2,0,0,0,0|2,0,0]=4 11926 B12R1.497 CCNc1c(ccc(c1F)Br)Cl 34a_100010995236_100000210202 [0,2,0,0,0,0|2,0,0]=4 11927 B12R1.497 CCNc1c(ccc(c1F)Br)F 2230a_100025793129_100000210202 [0,2,0,0,0,0|2,0,0]=4 11928 B12R1.497 CCNc1c(ccc(c1F)Br)F 34a_100025793129_100000210202 [0,2,0,0,0,0|2,0,0]=4 11929 B12R1.497 CCNc1c(ccc(c1F)C)Cl 34a_100000062009_100000210202 [0,2,0,0,0,0|2,0,0]=4 11930 B12R1.497 CCNc1c(ccc(c1F)C)F 2230a_102495364760_100000210202 [0,2,0,0,0,0|2,0,0]=4 11931 B12R1.497 CCNc1c(ccc(c1F)C)F 34a_102495364760_100000210202 [0,2,0,0,0,0|2,0,0]=4 11932 B12R1.497 CCNc1c(ccc(c1F)Cl)Br 34a_100011010633_100000210202 [0,2,0,0,0,0|2,0,0]=4 11933 B12R1.497 CCNc1c(ccc(c1F)Cl)Cl 34a_200000061452_100000210202 [0,2,0,0,0,0|2,0,0]=4 11934 B12R1.497 CCNc1c(ccc(c1F)Cl)F 34a_102495364764_100000210202 [0,2,0,0,0,0|2,0,0]=4 11935 B12R1.497 CCNc1c(ccc(c1F)F)Br 34a_100010008850_100000210202 [0,2,0,0,0,0|2,0,0]=4 11936 B12R1.497 CCNc1c(ccc(c1F)F)Cl 34a_200010381624_100000210202 [0,2,0,0,0,0|2,0,0]=4 11937 B12R1.497 CCNc1c(ccc(c1F)F)F 34a_100000037384_100000210202 [0,2,0,0,0,0|2,0,0]=4 11938 B12R1.497 CCNc1c(ccc(c1F)F)I 34a_100015763296_100000210202 [0,2,0,0,0,0|2,0,0]=4 11939 B12R1.497 CCOc1c(ccc(c1Br)C)F 34a_200010223207_100000210202 [0,2,0,0,0,0|2,0,0]=4 11940 B12R1.497 CCOc1c(ccc(c1Br)C)F 7a_200010223207_100000210202 [0,2,0,0,0,0|2,0,0]=4 11941 B12R1.497 CCOc1c(ccc(c1Br)F)F 34a_100010170822_100000210202 [0,2,0,0,0,0|2,0,0]=4 11942 B12R1.497 CCOc1c(ccc(c1Br)F)F 7a_100010170822_100000210202 [0,2,0,0,0,0|2,0,0]=4 11943 B12R1.497 CCOc1c(ccc(c1Br)F)N 34a_100010128263_100000210202 [0,2,0,0,0,0|2,0,0]=4 11944 B12R1.497 CCOc1c(ccc(c1Br)F)N 7a_100010128263_100000210202 [0,2,0,0,0,0|2,0,0]=4 11945 B12R1.497 CCOc1c(ccc(c1C)C)C 34a_100000211305_100000210202 [0,2,0,0,0,0|2,0,0]=4 11946 B12R1.497 CCOc1c(ccc(c1C)C)C 7a_100000211305_100000210202 [0,2,0,0,0,0|2,0,0]=4 11947 B12R1.497 CCOc1c(ccc(c1C)Cl)Br 34a_200010391122_100000210202 [0,2,0,0,0,0|2,0,0]=4 11948 B12R1.497 CCOc1c(ccc(c1C)Cl)Br 7a_200010391122_100000210202 [0,2,0,0,0,0|2,0,0]=4 11949 B12R1.497 CCOc1c(ccc(c1C)F)Br 34a_200010391124_100000210202 [0,2,0,0,0,0|2,0,0]=4 11950 B12R1.497 CCOc1c(ccc(c1C)F)Br 7a_200010391124_100000210202 [0,2,0,0,0,0|2,0,0]=4 11951 B12R1.497 CCOc1c(ccc(c1Cl)Br)Cl 34a_100010089855_100000210202 [0,2,0,0,0,0|2,0,0]=4 11952 B12R1.497 CCOc1c(ccc(c1Cl)Br)Cl 7a_100010089855_100000210202 [0,2,0,0,0,0|2,0,0]=4 11953 B12R1.497 CCOc1c(ccc(c1Cl)C)Cl 34a_200000087117_100000210202 [0,2,0,0,0,0|2,0,0]=4 11954 B12R1.497 CCOc1c(ccc(c1Cl)C)Cl 7a_200000087117_100000210202 [0,2,0,0,0,0|2,0,0]=4 11955 B12R1.497 CCOc1c(ccc(c1Cl)C)F 34a_100000035349_100000210202 [0,2,0,0,0,0|2,0,0]=4 11956 B12R1.497 CCOc1c(ccc(c1Cl)C)F 7a_100000035349_100000210202 [0,2,0,0,0,0|2,0,0]=4 11957 B12R1.497 CCOc1c(ccc(c1Cl)Cl)Cl 34a_100000042553_100000210202 [0,2,0,0,0,0|2,0,0]=4 11958 B12R1.497 CCOc1c(ccc(c1Cl)Cl)Cl 7a_100000042553_100000210202 [0,2,0,0,0,0|2,0,0]=4 11959 B12R1.497 CCOc1c(ccc(c1Cl)Cl)F 34a_100000062035_100000210202 [0,2,0,0,0,0|2,0,0]=4 11960 B12R1.497 CCOc1c(ccc(c1Cl)Cl)F 7a_100000062035_100000210202 [0,2,0,0,0,0|2,0,0]=4 11961 B12R1.497 CCOc1c(ccc(c1Cl)F)Br 34a_100014979575_100000210202 [0,2,0,0,0,0|2,0,0]=4 11962 B12R1.497 CCOc1c(ccc(c1Cl)F)Br 7a_100014979575_100000210202 [0,2,0,0,0,0|2,0,0]=4 11963 B12R1.497 CCOc1c(ccc(c1Cl)F)F 34a_100000038336_100000210202 [0,2,0,0,0,0|2,0,0]=4 11964 B12R1.497 CCOc1c(ccc(c1Cl)F)F 7a_100000038336_100000210202 [0,2,0,0,0,0|2,0,0]=4 11965 B12R1.497 CCOc1c(ccc(c1Cl)N)C 34a_100000036876_100000210202 [0,2,0,0,0,0|2,0,0]=4 11966 B12R1.497 CCOc1c(ccc(c1Cl)N)C 7a_100000036876_100000210202 [0,2,0,0,0,0|2,0,0]=4 11967 B12R1.497 CCOc1c(ccc(c1F)Br)Cl 34a_100010240321_100000210202 [0,2,0,0,0,0|2,0,0]=4 11968 B12R1.497 CCOc1c(ccc(c1F)Br)Cl 7a_100010240321_100000210202 [0,2,0,0,0,0|2,0,0]=4 11969 B12R1.497 CCOc1c(ccc(c1F)Br)F 34a_100010167067_100000210202 [0,2,0,0,0,0|2,0,0]=4 11970 B12R1.497 CCOc1c(ccc(c1F)Br)F 7a_100010167067_100000210202 [0,2,0,0,0,0|2,0,0]=4 11971 B12R1.497 CCOc1c(ccc(c1F)C)Br 34a_100000722096_100000210202 [0,2,0,0,0,0|2,0,0]=4 11972 B12R1.497 CCOc1c(ccc(c1F)C)Br 7a_100000722096_100000210202 [0,2,0,0,0,0|2,0,0]=4 11973 B12R1.497 CCOc1c(ccc(c1F)C)Cl 34a_200000034537_100000210202 [0,2,0,0,0,0|2,0,0]=4 11974 B12R1.497 CCOc1c(ccc(c1F)C)Cl 7a_200000034537_100000210202 [0,2,0,0,0,0|2,0,0]=4 11975 B12R1.497 CCOc1c(ccc(c1F)C)F 34a_100011216644_100000210202 [0,2,0,0,0,0|2,0,0]=4 11976 B12R1.497 CCOc1c(ccc(c1F)C)F 7a_100011216644_100000210202 [0,2,0,0,0,0|2,0,0]=4 11977 B12R1.497 CCOc1c(ccc(c1F)Cl)Br 34a_100010081130_100000210202 [0,2,0,0,0,0|2,0,0]=4 11978 B12R1.497 CCOc1c(ccc(c1F)Cl)Br 7a_100010081130_100000210202 [0,2,0,0,0,0|2,0,0]=4 11979 B12R1.497 CCOc1c(ccc(c1F)Cl)F 34a_100000034634_100000210202 [0,2,0,0,0,0|2,0,0]=4 11980 B12R1.497 CCOc1c(ccc(c1F)Cl)F 7a_100000034634_100000210202 [0,2,0,0,0,0|2,0,0]=4 11981 B12R1.497 CCOc1c(ccc(c1F)F)Br 34a_100010243909_100000210202 [0,2,0,0,0,0|2,0,0]=4 11982 B12R1.497 CCOc1c(ccc(c1F)F)Br 7a_100010243909_100000210202 [0,2,0,0,0,0|2,0,0]=4 11983 B12R1.497 CCOc1c(ccc(c1F)F)F 34a_100000031686_100000210202 [0,2,0,0,0,0|2,0,0]=4 11984 B12R1.497 CCOc1c(ccc(c1F)F)F 7a_100000031686_100000210202 [0,2,0,0,0,0|2,0,0]=4 11985 B12R1.497 CCOc1c(ccc(c1F)F)N 34a_100015205010_100000210202 [0,2,0,0,0,0|2,0,0]=4 11986 B12R1.497 CCOc1c(ccc(c1F)F)N 7a_100015205010_100000210202 [0,2,0,0,0,0|2,0,0]=4 11987 B12R1.497 CCOc1c(ccc(c1F)I)Br 34a_200010782288_100000210202 [0,2,0,0,0,0|2,0,0]=4 11988 B12R1.497 CCOc1c(ccc(c1F)I)Br 7a_200010782288_100000210202 [0,2,0,0,0,0|2,0,0]=4 11989 B12R1.497 CCSc1c(ccc(c1Br)F)F 62a_100000210202_100010167956 [0,2,0,0,0,0|2,0,0]=4 11990 B12R1.497 CCSc1c(ccc(c1Br)F)F 62a_100010167956_100000210202 [0,2,0,0,0,0|2,0,0]=4 11991 B12R1.497 CCSc1c(ccc(c1Br)F)N 62a_100000210202_100020765651 [0,2,0,0,0,0|2,0,0]=4 11992 B12R1.497 CCSc1c(ccc(c1Br)F)N 62a_100020765651_100000210202 [0,2,0,0,0,0|2,0,0]=4 11993 B12R1.497 CCSc1c(ccc(c1C)F)C 62a_100000210202_100011068659 [0,2,0,0,0,0|2,0,0]=4 11994 B12R1.497 CCSc1c(ccc(c1C)F)C 62a_100011068659_100000210202 [0,2,0,0,0,0|2,0,0]=4 11995 B12R1.497 CCSc1c(ccc(c1C)F)F 62a_100000210202_100010167959 [0,2,0,0,0,0|2,0,0]=4 11996 B12R1.497 CCSc1c(ccc(c1C)F)F 62a_100010167959_100000210202 [0,2,0,0,0,0|2,0,0]=4 11997 B12R1.497 CCSc1c(ccc(c1C)N)C 62a_100000210202_106354213274 [0,2,0,0,0,0|2,0,0]=4 11998 B12R1.497 CCSc1c(ccc(c1C)N)C 62a_106354213274_100000210202 [0,2,0,0,0,0|2,0,0]=4 11999 B12R1.497 CCSc1c(ccc(c1C)O)C 62a_100000210202_100010659238 [0,2,0,0,0,0|2,0,0]=4 12000 B12R1.497 CCSc1c(ccc(c1C)O)C 62a_100010659238_100000210202 [0,2,0,0,0,0|2,0,0]=4 12001 B12R1.497 CCSc1c(ccc(c1Cl)Br)N 62a_100000210202_200010779962 [0,2,0,0,0,0|2,0,0]=4 12002 B12R1.497 CCSc1c(ccc(c1Cl)Br)N 62a_200010779962_100000210202 [0,2,0,0,0,0|2,0,0]=4 12003 B12R1.497 CCSc1c(ccc(c1Cl)Cl)Cl 62a_100000210202_200010170825 [0,2,0,0,0,0|2,0,0]=4 12004 B12R1.497 CCSc1c(ccc(c1Cl)Cl)Cl 62a_200010170825_100000210202 [0,2,0,0,0,0|2,0,0]=4 12005 B12R1.497 CCSc1c(ccc(c1Cl)Cl)F 62a_100000210202_200015697950 [0,2,0,0,0,0|2,0,0]=4 12006 B12R1.497 CCSc1c(ccc(c1Cl)Cl)F 62a_200015697950_100000210202 [0,2,0,0,0,0|2,0,0]=4 12007 B12R1.497 CCSc1c(ccc(c1Cl)Cl)N 62a_100000210202_200011093878 [0,2,0,0,0,0|2,0,0]=4 12008 B12R1.497 CCSc1c(ccc(c1Cl)Cl)N 62a_200011093878_100000210202 [0,2,0,0,0,0|2,0,0]=4 12009 B12R1.497 CCSc1c(ccc(c1Cl)F)Br 62a_100000210202_200037249116 [0,2,0,0,0,0|2,0,0]=4 12010 B12R1.497 CCSc1c(ccc(c1Cl)F)Br 62a_200037249116_100000210202 [0,2,0,0,0,0|2,0,0]=4 12011 B12R1.497 CCSc1c(ccc(c1Cl)F)F 62a_100000210202_100010167948 [0,2,0,0,0,0|2,0,0]=4 12012 B12R1.497 CCSc1c(ccc(c1Cl)F)F 62a_100010167948_100000210202 [0,2,0,0,0,0|2,0,0]=4 12013 B12R1.497 CCSc1c(ccc(c1F)Br)Cl 62a_100000210202_100011092007 [0,2,0,0,0,0|2,0,0]=4 12014 B12R1.497 CCSc1c(ccc(c1F)Br)Cl 62a_100011092007_100000210202 [0,2,0,0,0,0|2,0,0]=4 12015 B12R1.497 CCSc1c(ccc(c1F)Br)F 62a_100000210202_100000722365 [0,2,0,0,0,0|2,0,0]=4 12016 B12R1.497 CCSc1c(ccc(c1F)Br)F 62a_100000722365_100000210202 [0,2,0,0,0,0|2,0,0]=4 12017 B12R1.497 CCSc1c(ccc(c1F)Cl)Br 62a_100000210202_100011084128 [0,2,0,0,0,0|2,0,0]=4 12018 B12R1.497 CCSc1c(ccc(c1F)Cl)Br 62a_100011084128_100000210202 [0,2,0,0,0,0|2,0,0]=4 12019 B12R1.497 CCSc1c(ccc(c1F)Cl)F 62a_100000210202_200010167938 [0,2,0,0,0,0|2,0,0]=4 12020 B12R1.497 CCSc1c(ccc(c1F)Cl)F 62a_200010167938_100000210202 [0,2,0,0,0,0|2,0,0]=4 12021 B12R1.497 CCSc1c(ccc(c1F)Cl)N 62a_100000210202_100010134325 [0,2,0,0,0,0|2,0,0]=4 12022 B12R1.497 CCSc1c(ccc(c1F)Cl)N 62a_100010134325_100000210202 [0,2,0,0,0,0|2,0,0]=4 12023 B12R1.497 CCSc1c(ccc(c1F)F)F 62a_100000210202_100009814005 [0,2,0,0,0,0|2,0,0]=4 12024 B12R1.497 CCSc1c(ccc(c1F)F)F 62a_100009814005_100000210202 [0,2,0,0,0,0|2,0,0]=4 12025 B12R1.497 CCSc1c(ccc(c1F)F)N 62a_100000210202_100010232473 [0,2,0,0,0,0|2,0,0]=4 12026 B12R1.497 CCSc1c(ccc(c1F)F)N 62a_100010232473_100000210202 [0,2,0,0,0,0|2,0,0]=4 12027 B12R1.497 CCSc1c(ccc(c1F)N)F 62a_100000210202_100010070858 [0,2,0,0,0,0|2,0,0]=4 12028 B12R1.497 CCSc1c(ccc(c1F)N)F 62a_100010070858_100000210202 [0,2,0,0,0,0|2,0,0]=4 12029 B12R1.497 CCSc1c(ccc(c1N)F)F 62a_100000210202_100014094178 [0,2,0,0,0,0|2,0,0]=4 12030 B12R1.497 CCSc1c(ccc(c1N)F)F 62a_100014094178_100000210202 [0,2,0,0,0,0|2,0,0]=4 12031 B12R1.497 CCSc1c(ccc(c1N)N)F 62a_100010128261_100000210202 [0,2,0,0,0,0|2,0,0]=4 12032 B12R1.497 CCSc1c(ccc(c1O)F)C 62a_100000210202_200010223207 [0,2,0,0,0,0|1,0,0]=3 12033 B12R1.497 CCSc1c(ccc(c1O)F)C 62a_200010223207_100000210202 [0,2,0,0,0,0|1,0,0]=3 12034 B12R1.497 CCSc1c(ccc(c1O)F)F 62a_100000210202_100010170822 [0,2,0,0,0,0|1,0,0]=3 12035 B12R1.497 CCSc1c(ccc(c1O)F)F 62a_100010170822_100000210202 [0,2,0,0,0,0|1,0,0]=3 12036 B12R1.497 CCSc1c(ccc(c1O)N)F 62a_100000210202_100010128263 [0,2,0,0,0,0|1,0,0]=3 12037 B12R1.497 CCSc1c(ccc(c1O)N)F 62a_100010128263_100000210202 [0,2,0,0,0,0|1,0,0]=3 12038 B12R1.497 CNCc1c(ccc(c1Br)C)Cl 207a_100102657272_200010235751 [0,2,0,0,0,0|2,0,0]=4 12039 B12R1.497 CNCc1c(ccc(c1Br)C)Cl 270004a_106832991635_200010235751 [0,2,0,0,0,0|2,0,0]=4 12040 B12R1.497 CNCc1c(ccc(c1Br)C)F 207a_100102657272_100009817119 [0,2,0,0,0,0|2,0,0]=4 12041 B12R1.497 CNCc1c(ccc(c1Br)C)F 26a_100102657272_200010223207 [0,2,0,0,0,0|2,0,0]=4 12042 B12R1.497 CNCc1c(ccc(c1Br)C)F 270004a_106832991635_100009817119 [0,2,0,0,0,0|2,0,0]=4 12043 B12R1.497 CNCc1c(ccc(c1Br)Cl)F 207a_100102657272_100010240313 [0,2,0,0,0,0|2,0,0]=4 12044 B12R1.497 CNCc1c(ccc(c1Br)Cl)F 2230a_106832991635_100011099539 [0,2,0,0,0,0|2,0,0]=4 12045 B12R1.497 CNCc1c(ccc(c1Br)Cl)F 270004a_106832991635_100010240313 [0,2,0,0,0,0|2,0,0]=4 12046 B12R1.497 CNCc1c(ccc(c1Br)Cl)F 34a_100102657272_100011099539 [0,2,0,0,0,0|2,0,0]=4 12047 B12R1.497 CNCc1c(ccc(c1Br)Cl)F 7a_106832991635_100011099539 [0,2,0,0,0,0|2,0,0]=4 12048 B12R1.497 CNCc1c(ccc(c1Br)F)Br 207a_100102657272_200015809769 [0,2,0,0,0,0|2,0,0]=4 12049 B12R1.497 CNCc1c(ccc(c1Br)F)Br 270004a_106832991635_200015809769 [0,2,0,0,0,0|2,0,0]=4 12050 B12R1.497 CNCc1c(ccc(c1Br)F)F 207a_100102657272_100009817137 [0,2,0,0,0,0|2,0,0]=4 12051 B12R1.497 CNCc1c(ccc(c1Br)F)F 26a_100102657272_100010170822 [0,2,0,0,0,0|2,0,0]=4 12052 B12R1.497 CNCc1c(ccc(c1Br)F)F 270004a_106832991635_100009817137 [0,2,0,0,0,0|2,0,0]=4 12053 B12R1.497 CNCc1c(ccc(c1C)Cl)Br 26a_100102657272_200010391122 [0,2,0,0,0,0|2,0,0]=4 12054 B12R1.497 CNCc1c(ccc(c1C)F)Br 26a_100102657272_200010391124 [0,2,0,0,0,0|2,0,0]=4 12055 B12R1.497 CNCc1c(ccc(c1C)F)F 207a_100102657272_100009872261 [0,2,0,0,0,0|2,0,0]=4 12056 B12R1.497 CNCc1c(ccc(c1C)F)F 270004a_106832991635_100009872261 [0,2,0,0,0,0|2,0,0]=4 12057 B12R1.497 CNCc1c(ccc(c1Cl)Br)Cl 207a_100102657272_200010289272 [0,2,0,0,0,0|2,0,0]=4 12058 B12R1.497 CNCc1c(ccc(c1Cl)Br)Cl 26a_100102657272_100010089855 [0,2,0,0,0,0|2,0,0]=4 12059 B12R1.497 CNCc1c(ccc(c1Cl)Br)Cl 270004a_106832991635_200010289272 [0,2,0,0,0,0|2,0,0]=4 12060 B12R1.497 CNCc1c(ccc(c1Cl)Br)F 207a_100102657272_100010235756 [0,2,0,0,0,0|2,0,0]=4 12061 B12R1.497 CNCc1c(ccc(c1Cl)Br)F 270004a_106832991635_100010235756 [0,2,0,0,0,0|2,0,0]=4 12062 B12R1.497 CNCc1c(ccc(c1Cl)C)Cl 2230a_106832991635_200010220899 [0,2,0,0,0,0|2,0,0]=4 12063 B12R1.497 CNCc1c(ccc(c1Cl)C)Cl 26a_100102657272_200000087117 [0,2,0,0,0,0|2,0,0]=4 12064 B12R1.497 CNCc1c(ccc(c1Cl)C)Cl 34a_100102657272_200010220899 [0,2,0,0,0,0|2,0,0]=4 12065 B12R1.497 CNCc1c(ccc(c1Cl)C)Cl 7a_106832991635_200010220899 [0,2,0,0,0,0|2,0,0]=4 12066 B12R1.497 CNCc1c(ccc(c1Cl)C)F 207a_100102657272_100000033498 [0,2,0,0,0,0|2,0,0]=4 12067 B12R1.497 CNCc1c(ccc(c1Cl)C)F 2230a_102235353916_200000210301 [0,2,0,0,0,0|2,0,0]=4 12068 B12R1.497 CNCc1c(ccc(c1Cl)C)F 2230a_106832991635_100009813558 [0,2,0,0,0,0|2,0,0]=4 12069 B12R1.497 CNCc1c(ccc(c1Cl)C)F 26a_100102657272_100000035349 [0,2,0,0,0,0|2,0,0]=4 12070 B12R1.497 CNCc1c(ccc(c1Cl)C)F 270004a_106832991635_100000033498 [0,2,0,0,0,0|2,0,0]=4 12071 B12R1.497 CNCc1c(ccc(c1Cl)C)F 34a_100102657272_100009813558 [0,2,0,0,0,0|2,0,0]=4 12072 B12R1.497 CNCc1c(ccc(c1Cl)C)F 34a_102235353916_200000210301 [0,2,0,0,0,0|2,0,0]=4 12073 B12R1.497 CNCc1c(ccc(c1Cl)C)F 7a_106832991635_100009813558 [0,2,0,0,0,0|2,0,0]=4 12074 B12R1.497 CNCc1c(ccc(c1Cl)Cl)Cl 207a_100102657272_100000211905 [0,2,0,0,0,0|2,0,0]=4 12075 B12R1.497 CNCc1c(ccc(c1Cl)Cl)Cl 2230a_100000705891_200000210301 [0,2,0,0,0,0|2,0,0]=4 12076 B12R1.497 CNCc1c(ccc(c1Cl)Cl)Cl 26a_100102657272_100000042553 [0,2,0,0,0,0|2,0,0]=4 12077 B12R1.497 CNCc1c(ccc(c1Cl)Cl)Cl 270004a_106832991635_100000211905 [0,2,0,0,0,0|2,0,0]=4 12078 B12R1.497 CNCc1c(ccc(c1Cl)Cl)Cl 34a_100000705891_200000210301 [0,2,0,0,0,0|2,0,0]=4 12079 B12R1.497 CNCc1c(ccc(c1Cl)Cl)F 207a_100102657272_100000062033 [0,2,0,0,0,0|2,0,0]=4 12080 B12R1.497 CNCc1c(ccc(c1Cl)Cl)F 2230a_100000062004_200000210301 [0,2,0,0,0,0|2,0,0]=4 12081 B12R1.497 CNCc1c(ccc(c1Cl)Cl)F 26a_100102657272_100000062035 [0,2,0,0,0,0|2,0,0]=4 12082 B12R1.497 CNCc1c(ccc(c1Cl)Cl)F 270004a_106832991635_100000062033 [0,2,0,0,0,0|2,0,0]=4 12083 B12R1.497 CNCc1c(ccc(c1Cl)Cl)F 34a_100000062004_200000210301 [0,2,0,0,0,0|2,0,0]=4 12084 B12R1.497 CNCc1c(ccc(c1Cl)F)Br 26a_100102657272_100014979575 [0,2,0,0,0,0|2,0,0]=4 12085 B12R1.497 CNCc1c(ccc(c1Cl)F)Cl 207a_100102657272_100000094348 [0,2,0,0,0,0|2,0,0]=4 12086 B12R1.497 CNCc1c(ccc(c1Cl)F)Cl 270004a_106832991635_100000094348 [0,2,0,0,0,0|2,0,0]=4 12087 B12R1.497 CNCc1c(ccc(c1Cl)F)F 207a_100102657272_100000034233 [0,2,0,0,0,0|2,0,0]=4 12088 B12R1.497 CNCc1c(ccc(c1Cl)F)F 2230a_100000035581_200000210301 [0,2,0,0,0,0|2,0,0]=4 12089 B12R1.497 CNCc1c(ccc(c1Cl)F)F 2230a_106832991635_100009813715 [0,2,0,0,0,0|2,0,0]=4 12090 B12R1.497 CNCc1c(ccc(c1Cl)F)F 26a_100102657272_100000038336 [0,2,0,0,0,0|2,0,0]=4 12091 B12R1.497 CNCc1c(ccc(c1Cl)F)F 270004a_106832991635_100000034233 [0,2,0,0,0,0|2,0,0]=4 12092 B12R1.497 CNCc1c(ccc(c1Cl)F)F 34a_100000035581_200000210301 [0,2,0,0,0,0|2,0,0]=4 12093 B12R1.497 CNCc1c(ccc(c1Cl)F)F 34a_100102657272_100009813715 [0,2,0,0,0,0|2,0,0]=4 12094 B12R1.497 CNCc1c(ccc(c1Cl)F)F 7a_106832991635_100009813715 [0,2,0,0,0,0|2,0,0]=4 12095 B12R1.497 CNCc1c(ccc(c1F)Br)Br 207a_100102657272_100010188740 [0,2,0,0,0,0|2,0,0]=4 12096 B12R1.497 CNCc1c(ccc(c1F)Br)Br 270004a_106832991635_100010188740 [0,2,0,0,0,0|2,0,0]=4 12097 B12R1.497 CNCc1c(ccc(c1F)Br)Cl 207a_100102657272_100010236160 [0,2,0,0,0,0|2,0,0]=4 12098 B12R1.497 CNCc1c(ccc(c1F)Br)Cl 2230a_106832991635_100010993448 [0,2,0,0,0,0|2,0,0]=4 12099 B12R1.497 CNCc1c(ccc(c1F)Br)Cl 26a_100102657272_100010240321 [0,2,0,0,0,0|2,0,0]=4 12100 B12R1.497 CNCc1c(ccc(c1F)Br)Cl 270004a_106832991635_100010236160 [0,2,0,0,0,0|2,0,0]=4 12101 B12R1.497 CNCc1c(ccc(c1F)Br)Cl 34a_100102657272_100010993448 [0,2,0,0,0,0|2,0,0]=4 12102 B12R1.497 CNCc1c(ccc(c1F)Br)Cl 7a_106832991635_100010993448 [0,2,0,0,0,0|2,0,0]=4 12103 B12R1.497 CNCc1c(ccc(c1F)Br)F 207a_100102657272_100000725362 [0,2,0,0,0,0|2,0,0]=4 12104 B12R1.497 CNCc1c(ccc(c1F)Br)F 26a_100102657272_100010167067 [0,2,0,0,0,0|2,0,0]=4 12105 B12R1.497 CNCc1c(ccc(c1F)Br)F 270004a_106832991635_100000725362 [0,2,0,0,0,0|2,0,0]=4 12106 B12R1.497 CNCc1c(ccc(c1F)C)Br 207a_100102657272_100010240314 [0,2,0,0,0,0|2,0,0]=4 12107 B12R1.497 CNCc1c(ccc(c1F)C)Br 26a_100102657272_100000722096 [0,2,0,0,0,0|2,0,0]=4 12108 B12R1.497 CNCc1c(ccc(c1F)C)Br 270004a_106832991635_100010240314 [0,2,0,0,0,0|2,0,0]=4 12109 B12R1.497 CNCc1c(ccc(c1F)C)Cl 207a_100102657272_100000039034 [0,2,0,0,0,0|2,0,0]=4 12110 B12R1.497 CNCc1c(ccc(c1F)C)Cl 2230a_100000039309_200000210301 [0,2,0,0,0,0|2,0,0]=4 12111 B12R1.497 CNCc1c(ccc(c1F)C)Cl 2230a_106832991635_100009813557 [0,2,0,0,0,0|2,0,0]=4 12112 B12R1.497 CNCc1c(ccc(c1F)C)Cl 270004a_106832991635_100000039034 [0,2,0,0,0,0|2,0,0]=4 12113 B12R1.497 CNCc1c(ccc(c1F)C)Cl 34a_100000039309_200000210301 [0,2,0,0,0,0|2,0,0]=4 12114 B12R1.497 CNCc1c(ccc(c1F)C)Cl 34a_100102657272_100009813557 [0,2,0,0,0,0|2,0,0]=4 12115 B12R1.497 CNCc1c(ccc(c1F)C)Cl 7a_106832991635_100009813557 [0,2,0,0,0,0|2,0,0]=4 12116 B12R1.497 CNCc1c(ccc(c1F)C)F 207a_100102657272_100011217914 [0,2,0,0,0,0|2,0,0]=4 12117 B12R1.497 CNCc1c(ccc(c1F)C)F 2230a_106354213922_200000210301 [0,2,0,0,0,0|2,0,0]=4 12118 B12R1.497 CNCc1c(ccc(c1F)C)F 2230a_106832991635_100011217880 [0,2,0,0,0,0|2,0,0]=4 12119 B12R1.497 CNCc1c(ccc(c1F)C)F 270004a_106832991635_100011217914 [0,2,0,0,0,0|2,0,0]=4 12120 B12R1.497 CNCc1c(ccc(c1F)C)F 34a_100102657272_100011217880 [0,2,0,0,0,0|2,0,0]=4 12121 B12R1.497 CNCc1c(ccc(c1F)C)F 34a_106354213922_200000210301 [0,2,0,0,0,0|2,0,0]=4 12122 B12R1.497 CNCc1c(ccc(c1F)C)F 7a_106832991635_100011217880 [0,2,0,0,0,0|2,0,0]=4 12123 B12R1.497 CNCc1c(ccc(c1F)Cl)Br 207a_100102657272_100010240308 [0,2,0,0,0,0|2,0,0]=4 12124 B12R1.497 CNCc1c(ccc(c1F)Cl)Br 2230a_106832991635_100011071994 [0,2,0,0,0,0|2,0,0]=4 12125 B12R1.497 CNCc1c(ccc(c1F)Cl)Br 26a_100102657272_100010081130 [0,2,0,0,0,0|2,0,0]=4 12126 B12R1.497 CNCc1c(ccc(c1F)Cl)Br 270004a_106832991635_100010240308 [0,2,0,0,0,0|2,0,0]=4 12127 B12R1.497 CNCc1c(ccc(c1F)Cl)Br 34a_100102657272_100011071994 [0,2,0,0,0,0|2,0,0]=4 12128 B12R1.497 CNCc1c(ccc(c1F)Cl)Br 7a_106832991635_100011071994 [0,2,0,0,0,0|2,0,0]=4 12129 B12R1.497 CNCc1c(ccc(c1F)Cl)Cl 207a_100102657272_100000061685 [0,2,0,0,0,0|2,0,0]=4 12130 B12R1.497 CNCc1c(ccc(c1F)Cl)Cl 2230a_100000061714_200000210301 [0,2,0,0,0,0|2,0,0]=4 12131 B12R1.497 CNCc1c(ccc(c1F)Cl)Cl 2230a_106832991635_100009814555 [0,2,0,0,0,0|2,0,0]=4 12132 B12R1.497 CNCc1c(ccc(c1F)Cl)Cl 270004a_106832991635_100000061685 [0,2,0,0,0,0|2,0,0]=4 12133 B12R1.497 CNCc1c(ccc(c1F)Cl)Cl 34a_100000061714_200000210301 [0,2,0,0,0,0|2,0,0]=4 12134 B12R1.497 CNCc1c(ccc(c1F)Cl)Cl 34a_100102657272_100009814555 [0,2,0,0,0,0|2,0,0]=4 12135 B12R1.497 CNCc1c(ccc(c1F)Cl)Cl 7a_106832991635_100009814555 [0,2,0,0,0,0|2,0,0]=4 12136 B12R1.497 CNCc1c(ccc(c1F)Cl)F 207a_100102657272_100000033663 [0,2,0,0,0,0|2,0,0]=4 12137 B12R1.497 CNCc1c(ccc(c1F)Cl)F 2230a_100000036350_200000210301 [0,2,0,0,0,0|2,0,0]=4 12138 B12R1.497 CNCc1c(ccc(c1F)Cl)F 2230a_106832991635_100009813610 [0,2,0,0,0,0|2,0,0]=4 12139 B12R1.497 CNCc1c(ccc(c1F)Cl)F 26a_100102657272_100000034634 [0,2,0,0,0,0|2,0,0]=4 12140 B12R1.497 CNCc1c(ccc(c1F)Cl)F 270004a_106832991635_100000033663 [0,2,0,0,0,0|2,0,0]=4 12141 B12R1.497 CNCc1c(ccc(c1F)Cl)F 34a_100000036350_200000210301 [0,2,0,0,0,0|2,0,0]=4 12142 B12R1.497 CNCc1c(ccc(c1F)Cl)F 34a_100102657272_100009813610 [0,2,0,0,0,0|2,0,0]=4 12143 B12R1.497 CNCc1c(ccc(c1F)Cl)F 7a_106832991635_100009813610 [0,2,0,0,0,0|2,0,0]=4 12144 B12R1.497 CNCc1c(ccc(c1F)F)Br 207a_100102657272_100009814791 [0,2,0,0,0,0|2,0,0]=4 12145 B12R1.497 CNCc1c(ccc(c1F)F)Br 2230a_106832991635_100011070584 [0,2,0,0,0,0|2,0,0]=4 12146 B12R1.497 CNCc1c(ccc(c1F)F)Br 26a_100102657272_100010243909 [0,2,0,0,0,0|2,0,0]=4 12147 B12R1.497 CNCc1c(ccc(c1F)F)Br 270004a_106832991635_100009814791 [0,2,0,0,0,0|2,0,0]=4 12148 B12R1.497 CNCc1c(ccc(c1F)F)Br 34a_100102657272_100011070584 [0,2,0,0,0,0|2,0,0]=4 12149 B12R1.497 CNCc1c(ccc(c1F)F)Br 7a_106832991635_100011070584 [0,2,0,0,0,0|2,0,0]=4 12150 B12R1.497 CNCc1c(ccc(c1F)F)C 207a_100102657272_100009854886 [0,2,0,0,0,0|2,0,0]=4 12151 B12R1.497 CNCc1c(ccc(c1F)F)C 270004a_106832991635_100009854886 [0,2,0,0,0,0|2,0,0]=4 12152 B12R1.497 CNCc1c(ccc(c1F)F)Cl 207a_100102657272_100011998157 [0,2,0,0,0,0|2,0,0]=4 12153 B12R1.497 CNCc1c(ccc(c1F)F)Cl 2230a_106832991635_100010381632 [0,2,0,0,0,0|2,0,0]=4 12154 B12R1.497 CNCc1c(ccc(c1F)F)Cl 270004a_106832991635_100011998157 [0,2,0,0,0,0|2,0,0]=4 12155 B12R1.497 CNCc1c(ccc(c1F)F)Cl 34a_100102657272_100010381632 [0,2,0,0,0,0|2,0,0]=4 12156 B12R1.497 CNCc1c(ccc(c1F)F)Cl 7a_106832991635_100010381632 [0,2,0,0,0,0|2,0,0]=4 12157 B12R1.497 CNCc1c(ccc(c1F)F)F 207a_100102657272_100000033240 [0,2,0,0,0,0|2,0,0]=4 12158 B12R1.497 CNCc1c(ccc(c1F)F)F 2230a_106430512890_200000210301 [0,2,0,0,0,0|2,0,0]=4 12159 B12R1.497 CNCc1c(ccc(c1F)F)F 2230a_106832991635_100009813269 [0,2,0,0,0,0|2,0,0]=4 12160 B12R1.497 CNCc1c(ccc(c1F)F)F 270004a_106832991635_100000033240 [0,2,0,0,0,0|2,0,0]=4 12161 B12R1.497 CNCc1c(ccc(c1F)F)F 34a_100102657272_100009813269 [0,2,0,0,0,0|2,0,0]=4 12162 B12R1.497 CNCc1c(ccc(c1F)F)F 34a_106430512890_200000210301 [0,2,0,0,0,0|2,0,0]=4 12163 B12R1.497 CNCc1c(ccc(c1F)F)F 7a_106832991635_100009813269 [0,2,0,0,0,0|2,0,0]=4 12164 B12R1.497 CNCc1c(ccc(c1F)I)Br 207a_100102657272_100010769263 [0,2,0,0,0,0|2,0,0]=4 12165 B12R1.497 CNCc1c(ccc(c1F)I)Br 26a_100102657272_200010782288 [0,2,0,0,0,0|2,0,0]=4 12166 B12R1.497 CNCc1c(ccc(c1F)I)Br 270004a_106832991635_100010769263 [0,2,0,0,0,0|2,0,0]=4 12167 B12R1.497 CNCc1c(ccc(c1F)I)Cl 207a_100102657272_100010782290 [0,2,0,0,0,0|2,0,0]=4 12168 B12R1.497 CNCc1c(ccc(c1F)I)Cl 270004a_106832991635_100010782290 [0,2,0,0,0,0|2,0,0]=4 12169 B12R1.497 COCc1c(ccc(c1Br)C)F 34a_100010365568_200000210301 [0,2,0,0,0,0|2,0,0]=4 12170 B12R1.497 COCc1c(ccc(c1Br)C)F 7a_100010365568_200000210301 [0,2,0,0,0,0|2,0,0]=4 12171 B12R1.497 COCc1c(ccc(c1Br)Cl)F 34a_100138415774_100011099539 [0,2,0,0,0,0|2,0,0]=4 12172 B12R1.497 COCc1c(ccc(c1Br)F)F 34a_100011071053_200000210301 [0,2,0,0,0,0|2,0,0]=4 12173 B12R1.497 COCc1c(ccc(c1Br)F)F 7a_100011071053_200000210301 [0,2,0,0,0,0|2,0,0]=4 12174 B12R1.497 COCc1c(ccc(c1Cl)Br)F 34a_100010289842_200000210301 [0,2,0,0,0,0|2,0,0]=4 12175 B12R1.497 COCc1c(ccc(c1Cl)Br)F 7a_100010289842_200000210301 [0,2,0,0,0,0|2,0,0]=4 12176 B12R1.497 COCc1c(ccc(c1Cl)C)Cl 34a_100009871603_200000210301 [0,2,0,0,0,0|2,0,0]=4 12177 B12R1.497 COCc1c(ccc(c1Cl)C)Cl 34a_100138415774_200010220899 [0,2,0,0,0,0|2,0,0]=4 12178 B12R1.497 COCc1c(ccc(c1Cl)C)Cl 7a_100009871603_200000210301 [0,2,0,0,0,0|2,0,0]=4 12179 B12R1.497 COCc1c(ccc(c1Cl)C)F 34a_100000035582_200000210301 [0,2,0,0,0,0|2,0,0]=4 12180 B12R1.497 COCc1c(ccc(c1Cl)C)F 34a_100138415774_100009813558 [0,2,0,0,0,0|2,0,0]=4 12181 B12R1.497 COCc1c(ccc(c1Cl)C)F 7a_100000035582_200000210301 [0,2,0,0,0,0|2,0,0]=4 12182 B12R1.497 COCc1c(ccc(c1Cl)F)F 34a_100000035659_200000210301 [0,2,0,0,0,0|2,0,0]=4 12183 B12R1.497 COCc1c(ccc(c1Cl)F)F 34a_100138415774_100009813715 [0,2,0,0,0,0|2,0,0]=4 12184 B12R1.497 COCc1c(ccc(c1Cl)F)F 7a_100000035659_200000210301 [0,2,0,0,0,0|2,0,0]=4 12185 B12R1.497 COCc1c(ccc(c1F)Br)Cl 34a_100138415774_100010993448 [0,2,0,0,0,0|2,0,0]=4 12186 B12R1.497 COCc1c(ccc(c1F)Br)F 34a_100000725363_200000210301 [0,2,0,0,0,0|2,0,0]=4 12187 B12R1.497 COCc1c(ccc(c1F)Br)F 7a_100000725363_200000210301 [0,2,0,0,0,0|2,0,0]=4 12188 B12R1.497 COCc1c(ccc(c1F)C)Cl 34a_100000038635_200000210301 [0,2,0,0,0,0|2,0,0]=4 12189 B12R1.497 COCc1c(ccc(c1F)C)Cl 34a_100138415774_100009813557 [0,2,0,0,0,0|2,0,0]=4 12190 B12R1.497 COCc1c(ccc(c1F)C)Cl 7a_100000038635_200000210301 [0,2,0,0,0,0|2,0,0]=4 12191 B12R1.497 COCc1c(ccc(c1F)C)F 34a_100011216594_200000210301 [0,2,0,0,0,0|2,0,0]=4 12192 B12R1.497 COCc1c(ccc(c1F)C)F 34a_100138415774_100011217880 [0,2,0,0,0,0|2,0,0]=4 12193 B12R1.497 COCc1c(ccc(c1F)C)F 7a_100011216594_200000210301 [0,2,0,0,0,0|2,0,0]=4 12194 B12R1.497 COCc1c(ccc(c1F)Cl)Br 34a_100010782278_200000210301 [0,2,0,0,0,0|2,0,0]=4 12195 B12R1.497 COCc1c(ccc(c1F)Cl)Br 34a_100138415774_100011071994 [0,2,0,0,0,0|2,0,0]=4 12196 B12R1.497 COCc1c(ccc(c1F)Cl)Br 7a_100010782278_200000210301 [0,2,0,0,0,0|2,0,0]=4 12197 B12R1.497 COCc1c(ccc(c1F)Cl)Cl 34a_100138415774_100009814555 [0,2,0,0,0,0|2,0,0]=4 12198 B12R1.497 COCc1c(ccc(c1F)Cl)F 34a_100000034541_200000210301 [0,2,0,0,0,0|2,0,0]=4 12199 B12R1.497 COCc1c(ccc(c1F)Cl)F 34a_100138415774_100009813610 [0,2,0,0,0,0|2,0,0]=4 12200 B12R1.497 COCc1c(ccc(c1F)Cl)F 7a_100000034541_200000210301 [0,2,0,0,0,0|2,0,0]=4 12201 B12R1.497 COCc1c(ccc(c1F)F)Br 34a_100010177773_200000210301 [0,2,0,0,0,0|2,0,0]=4 12202 B12R1.497 COCc1c(ccc(c1F)F)Br 34a_100138415774_100011070584 [0,2,0,0,0,0|2,0,0]=4 12203 B12R1.497 COCc1c(ccc(c1F)F)Br 7a_100010177773_200000210301 [0,2,0,0,0,0|2,0,0]=4 12204 B12R1.497 COCc1c(ccc(c1F)F)Cl 34a_100011998155_200000210301 [0,2,0,0,0,0|2,0,0]=4 12205 B12R1.497 COCc1c(ccc(c1F)F)Cl 34a_100138415774_100010381632 [0,2,0,0,0,0|2,0,0]=4 12206 B12R1.497 COCc1c(ccc(c1F)F)Cl 7a_100011998155_200000210301 [0,2,0,0,0,0|2,0,0]=4 12207 B12R1.497 COCc1c(ccc(c1F)F)F 34a_100000037964_200000210301 [0,2,0,0,0,0|2,0,0]=4 12208 B12R1.497 COCc1c(ccc(c1F)F)F 34a_100138415774_100009813269 [0,2,0,0,0,0|2,0,0]=4 12209 B12R1.497 COCc1c(ccc(c1F)F)F 7a_100000037964_200000210301 [0,2,0,0,0,0|2,0,0]=4 12210 B12R1.497 COCc1c(ccc(c1F)I)Br 34a_200010782277_200000210301 [0,2,0,0,0,0|2,0,0]=4 12211 B12R1.497 COCc1c(ccc(c1F)I)Br 7a_200010782277_200000210301 [0,2,0,0,0,0|2,0,0]=4 12212 B12R1.497 CSCc1c(ccc(c1Br)Cl)F 62a_100011099539_200000210301 [0,2,0,0,0,0|2,0,0]=4 12213 B12R1.497 CSCc1c(ccc(c1Br)Cl)F 62a_200000210301_100011099539 [0,2,0,0,0,0|2,0,0]=4 12214 B12R1.497 CSCc1c(ccc(c1Cl)C)Cl 62a_200000210301_200010220899 [0,2,0,0,0,0|2,0,0]=4 12215 B12R1.497 CSCc1c(ccc(c1Cl)C)Cl 62a_200010220899_200000210301 [0,2,0,0,0,0|2,0,0]=4 12216 B12R1.497 CSCc1c(ccc(c1Cl)C)F 62a_100009813558_200000210301 [0,2,0,0,0,0|2,0,0]=4 12217 B12R1.497 CSCc1c(ccc(c1Cl)C)F 62a_200000210301_100009813558 [0,2,0,0,0,0|2,0,0]=4 12218 B12R1.497 CSCc1c(ccc(c1Cl)F)F 62a_100009813715_200000210301 [0,2,0,0,0,0|2,0,0]=4 12219 B12R1.497 CSCc1c(ccc(c1Cl)F)F 62a_200000210301_100009813715 [0,2,0,0,0,0|2,0,0]=4 12220 B12R1.497 CSCc1c(ccc(c1F)Br)Cl 62a_100010993448_200000210301 [0,2,0,0,0,0|2,0,0]=4 12221 B12R1.497 CSCc1c(ccc(c1F)Br)Cl 62a_200000210301_100010993448 [0,2,0,0,0,0|2,0,0]=4 12222 B12R1.497 CSCc1c(ccc(c1F)C)Cl 62a_100009813557_200000210301 [0,2,0,0,0,0|2,0,0]=4 12223 B12R1.497 CSCc1c(ccc(c1F)C)Cl 62a_200000210301_100009813557 [0,2,0,0,0,0|2,0,0]=4 12224 B12R1.497 CSCc1c(ccc(c1F)C)F 62a_100011217880_200000210301 [0,2,0,0,0,0|2,0,0]=4 12225 B12R1.497 CSCc1c(ccc(c1F)C)F 62a_200000210301_100011217880 [0,2,0,0,0,0|2,0,0]=4 12226 B12R1.497 CSCc1c(ccc(c1F)Cl)Br 62a_100011071994_200000210301 [0,2,0,0,0,0|2,0,0]=4 12227 B12R1.497 CSCc1c(ccc(c1F)Cl)Br 62a_200000210301_100011071994 [0,2,0,0,0,0|2,0,0]=4 12228 B12R1.497 CSCc1c(ccc(c1F)Cl)Cl 62a_100009814555_200000210301 [0,2,0,0,0,0|2,0,0]=4 12229 B12R1.497 CSCc1c(ccc(c1F)Cl)Cl 62a_200000210301_100009814555 [0,2,0,0,0,0|2,0,0]=4 12230 B12R1.497 CSCc1c(ccc(c1F)Cl)F 62a_100009813610_200000210301 [0,2,0,0,0,0|2,0,0]=4 12231 B12R1.497 CSCc1c(ccc(c1F)Cl)F 62a_200000210301_100009813610 [0,2,0,0,0,0|2,0,0]=4 12232 B12R1.497 CSCc1c(ccc(c1F)F)Br 62a_100011070584_200000210301 [0,2,0,0,0,0|2,0,0]=4 12233 B12R1.497 CSCc1c(ccc(c1F)F)Br 62a_200000210301_100011070584 [0,2,0,0,0,0|2,0,0]=4 12234 B12R1.497 CSCc1c(ccc(c1F)F)Cl 62a_100010381632_200000210301 [0,2,0,0,0,0|2,0,0]=4 12235 B12R1.497 CSCc1c(ccc(c1F)F)Cl 62a_200000210301_100010381632 [0,2,0,0,0,0|2,0,0]=4 12236 B12R1.497 CSCc1c(ccc(c1F)F)F 62a_100009813269_200000210301 [0,2,0,0,0,0|2,0,0]=4 12237 B12R1.497 CSCc1c(ccc(c1F)F)F 62a_200000210301_100009813269 [0,2,0,0,0,0|2,0,0]=4 12238 B12R1.497 Cc1c(ccc(c1NCF)O)Br 34a_100013039247_100015361967 [0,2,0,0,0,0|2,0,0]=4 12239 B12R1.497 Cc1ccc(c(c1Br)CO[13CH3])F 34a_100010365568_200025704644 [0,2,0,0,0,0|2,0,0]=4 12240 B12R1.497 Cc1ccc(c(c1Br)CO[13CH3])F 7a_100010365568_200025704644 [0,2,0,0,0,0|2,0,0]=4 12241 B12R1.497 Cc1ccc(c(c1Cl)CN[13CH3])F 2230a_102235353916_200025704644 [0,2,0,0,0,0|2,0,0]=4 12242 B12R1.497 Cc1ccc(c(c1Cl)CN[13CH3])F 34a_102235353916_200025704644 [0,2,0,0,0,0|2,0,0]=4 12243 B12R1.497 Cc1ccc(c(c1Cl)CO[13CH3])Cl 34a_100009871603_200025704644 [0,2,0,0,0,0|2,0,0]=4 12244 B12R1.497 Cc1ccc(c(c1Cl)CO[13CH3])Cl 7a_100009871603_200025704644 [0,2,0,0,0,0|2,0,0]=4 12245 B12R1.497 Cc1ccc(c(c1Cl)CO[13CH3])F 34a_100000035582_200025704644 [0,2,0,0,0,0|2,0,0]=4 12246 B12R1.497 Cc1ccc(c(c1Cl)CO[13CH3])F 7a_100000035582_200025704644 [0,2,0,0,0,0|2,0,0]=4 12247 B12R1.497 Cc1ccc(c(c1Cl)CS[13CH3])Cl 62a_200010220899_200025704644 [0,2,0,0,0,0|2,0,0]=4 12248 B12R1.497 Cc1ccc(c(c1Cl)CS[13CH3])Cl 62a_200025704644_200010220899 [0,2,0,0,0,0|2,0,0]=4 12249 B12R1.497 Cc1ccc(c(c1Cl)CS[13CH3])F 62a_100009813558_200025704644 [0,2,0,0,0,0|2,0,0]=4 12250 B12R1.497 Cc1ccc(c(c1Cl)CS[13CH3])F 62a_200025704644_100009813558 [0,2,0,0,0,0|2,0,0]=4 12251 B12R1.497 Cc1ccc(c(c1F)CN[13CH3])Cl 2230a_100000039309_200025704644 [0,2,0,0,0,0|2,0,0]=4 12252 B12R1.497 Cc1ccc(c(c1F)CN[13CH3])Cl 34a_100000039309_200025704644 [0,2,0,0,0,0|2,0,0]=4 12253 B12R1.497 Cc1ccc(c(c1F)CN[13CH3])F 2230a_106354213922_200025704644 [0,2,0,0,0,0|2,0,0]=4 12254 B12R1.497 Cc1ccc(c(c1F)CN[13CH3])F 34a_106354213922_200025704644 [0,2,0,0,0,0|2,0,0]=4 12255 B12R1.497 Cc1ccc(c(c1F)CO[13CH3])Cl 34a_100000038635_200025704644 [0,2,0,0,0,0|2,0,0]=4 12256 B12R1.497 Cc1ccc(c(c1F)CO[13CH3])Cl 7a_100000038635_200025704644 [0,2,0,0,0,0|2,0,0]=4 12257 B12R1.497 Cc1ccc(c(c1F)CO[13CH3])F 34a_100011216594_200025704644 [0,2,0,0,0,0|2,0,0]=4 12258 B12R1.497 Cc1ccc(c(c1F)CO[13CH3])F 7a_100011216594_200025704644 [0,2,0,0,0,0|2,0,0]=4 12259 B12R1.497 Cc1ccc(c(c1F)CS[13CH3])Cl 62a_100009813557_200025704644 [0,2,0,0,0,0|2,0,0]=4 12260 B12R1.497 Cc1ccc(c(c1F)CS[13CH3])Cl 62a_200025704644_100009813557 [0,2,0,0,0,0|2,0,0]=4 12261 B12R1.497 Cc1ccc(c(c1F)CS[13CH3])F 62a_100011217880_200025704644 [0,2,0,0,0,0|2,0,0]=4 12262 B12R1.497 Cc1ccc(c(c1F)CS[13CH3])F 62a_200025704644_100011217880 [0,2,0,0,0,0|2,0,0]=4 12263 B12R1.497 Cc1ccc(c(c1SCF)O)F 62a_100015361967_200010223207 [0,2,0,0,0,0|2,0,0]=4 12264 B12R1.497 Cc1ccc(c(c1SCF)O)F 62a_200010223207_100015361967 [0,2,0,0,0,0|2,0,0]=4 12265 B12R1.497 N#CCc1c(ccc(c1F)F)O 271570a_203496583355_100010945798 [0,2,0,0,0,0|1,0,1]=4 12266 B12R1.497 Nc1ccc(c(c1O)SCF)F 62a_100010128263_100015361967 [0,2,0,0,0,0|2,0,0]=4 12267 B12R1.497 Nc1ccc(c(c1O)SCF)F 62a_100015361967_100010128263 [0,2,0,0,0,0|2,0,0]=4 12268 B12R1.497 Oc1c(ccc(c1SCF)F)F 62a_100010170822_100015361967 [0,2,0,0,0,0|2,0,0]=4 12269 B12R1.497 Oc1c(ccc(c1SCF)F)F 62a_100015361967_100010170822 [0,2,0,0,0,0|2,0,0]=4 12270 B12R1.497 [13CH3]NCc1c(ccc(c1Cl)Cl)Cl 2230a_100000705891_200025704644 [0,2,0,0,0,0|2,0,0]=4 12271 B12R1.497 [13CH3]NCc1c(ccc(c1Cl)Cl)Cl 34a_100000705891_200025704644 [0,2,0,0,0,0|2,0,0]=4 12272 B12R1.497 [13CH3]NCc1c(ccc(c1Cl)Cl)F 2230a_100000062004_200025704644 [0,2,0,0,0,0|2,0,0]=4 12273 B12R1.497 [13CH3]NCc1c(ccc(c1Cl)Cl)F 34a_100000062004_200025704644 [0,2,0,0,0,0|2,0,0]=4 12274 B12R1.497 [13CH3]NCc1c(ccc(c1Cl)F)F 2230a_100000035581_200025704644 [0,2,0,0,0,0|2,0,0]=4 12275 B12R1.497 [13CH3]NCc1c(ccc(c1Cl)F)F 34a_100000035581_200025704644 [0,2,0,0,0,0|2,0,0]=4 12276 B12R1.497 [13CH3]NCc1c(ccc(c1F)Cl)Cl 2230a_100000061714_200025704644 [0,2,0,0,0,0|2,0,0]=4 12277 B12R1.497 [13CH3]NCc1c(ccc(c1F)Cl)Cl 34a_100000061714_200025704644 [0,2,0,0,0,0|2,0,0]=4 12278 B12R1.497 [13CH3]NCc1c(ccc(c1F)Cl)F 2230a_100000036350_200025704644 [0,2,0,0,0,0|2,0,0]=4 12279 B12R1.497 [13CH3]NCc1c(ccc(c1F)Cl)F 34a_100000036350_200025704644 [0,2,0,0,0,0|2,0,0]=4 12280 B12R1.497 [13CH3]NCc1c(ccc(c1F)F)F 2230a_106430512890_200025704644 [0,2,0,0,0,0|2,0,0]=4 12281 B12R1.497 [13CH3]NCc1c(ccc(c1F)F)F 34a_106430512890_200025704644 [0,2,0,0,0,0|2,0,0]=4 12282 B12R1.497 [13CH3]OCc1c(ccc(c1Br)F)F 34a_100011071053_200025704644 [0,2,0,0,0,0|2,0,0]=4 12283 B12R1.497 [13CH3]OCc1c(ccc(c1Br)F)F 7a_100011071053_200025704644 [0,2,0,0,0,0|2,0,0]=4 12284 B12R1.497 [13CH3]OCc1c(ccc(c1Cl)Br)F 34a_100010289842_200025704644 [0,2,0,0,0,0|2,0,0]=4 12285 B12R1.497 [13CH3]OCc1c(ccc(c1Cl)Br)F 7a_100010289842_200025704644 [0,2,0,0,0,0|2,0,0]=4 12286 B12R1.497 [13CH3]OCc1c(ccc(c1Cl)F)F 34a_100000035659_200025704644 [0,2,0,0,0,0|2,0,0]=4 12287 B12R1.497 [13CH3]OCc1c(ccc(c1Cl)F)F 7a_100000035659_200025704644 [0,2,0,0,0,0|2,0,0]=4 12288 B12R1.497 [13CH3]OCc1c(ccc(c1F)Br)F 34a_100000725363_200025704644 [0,2,0,0,0,0|2,0,0]=4 12289 B12R1.497 [13CH3]OCc1c(ccc(c1F)Br)F 7a_100000725363_200025704644 [0,2,0,0,0,0|2,0,0]=4 12290 B12R1.497 [13CH3]OCc1c(ccc(c1F)Cl)Br 34a_100010782278_200025704644 [0,2,0,0,0,0|2,0,0]=4 12291 B12R1.497 [13CH3]OCc1c(ccc(c1F)Cl)Br 7a_100010782278_200025704644 [0,2,0,0,0,0|2,0,0]=4 12292 B12R1.497 [13CH3]OCc1c(ccc(c1F)Cl)F 34a_100000034541_200025704644 [0,2,0,0,0,0|2,0,0]=4 12293 B12R1.497 [13CH3]OCc1c(ccc(c1F)Cl)F 7a_100000034541_200025704644 [0,2,0,0,0,0|2,0,0]=4 12294 B12R1.497 [13CH3]OCc1c(ccc(c1F)F)Br 34a_100010177773_200025704644 [0,2,0,0,0,0|2,0,0]=4 12295 B12R1.497 [13CH3]OCc1c(ccc(c1F)F)Br 7a_100010177773_200025704644 [0,2,0,0,0,0|2,0,0]=4 12296 B12R1.497 [13CH3]OCc1c(ccc(c1F)F)Cl 34a_100011998155_200025704644 [0,2,0,0,0,0|2,0,0]=4 12297 B12R1.497 [13CH3]OCc1c(ccc(c1F)F)Cl 7a_100011998155_200025704644 [0,2,0,0,0,0|2,0,0]=4 12298 B12R1.497 [13CH3]OCc1c(ccc(c1F)F)F 34a_100000037964_200025704644 [0,2,0,0,0,0|2,0,0]=4 12299 B12R1.497 [13CH3]OCc1c(ccc(c1F)F)F 7a_100000037964_200025704644 [0,2,0,0,0,0|2,0,0]=4 12300 B12R1.497 [13CH3]OCc1c(ccc(c1F)I)Br 34a_200010782277_200025704644 [0,2,0,0,0,0|2,0,0]=4 12301 B12R1.497 [13CH3]OCc1c(ccc(c1F)I)Br 7a_200010782277_200025704644 [0,2,0,0,0,0|2,0,0]=4 12302 B12R1.497 [13CH3]SCc1c(ccc(c1Br)Cl)F 62a_100011099539_200025704644 [0,2,0,0,0,0|2,0,0]=4 12303 B12R1.497 [13CH3]SCc1c(ccc(c1Br)Cl)F 62a_200025704644_100011099539 [0,2,0,0,0,0|2,0,0]=4 12304 B12R1.497 [13CH3]SCc1c(ccc(c1Cl)F)F 62a_100009813715_200025704644 [0,2,0,0,0,0|2,0,0]=4 12305 B12R1.497 [13CH3]SCc1c(ccc(c1Cl)F)F 62a_200025704644_100009813715 [0,2,0,0,0,0|2,0,0]=4 12306 B12R1.497 [13CH3]SCc1c(ccc(c1F)Br)Cl 62a_100010993448_200025704644 [0,2,0,0,0,0|2,0,0]=4 12307 B12R1.497 [13CH3]SCc1c(ccc(c1F)Br)Cl 62a_200025704644_100010993448 [0,2,0,0,0,0|2,0,0]=4 12308 B12R1.497 [13CH3]SCc1c(ccc(c1F)Cl)Br 62a_100011071994_200025704644 [0,2,0,0,0,0|2,0,0]=4 12309 B12R1.497 [13CH3]SCc1c(ccc(c1F)Cl)Br 62a_200025704644_100011071994 [0,2,0,0,0,0|2,0,0]=4 12310 B12R1.497 [13CH3]SCc1c(ccc(c1F)Cl)Cl 62a_100009814555_200025704644 [0,2,0,0,0,0|2,0,0]=4 12311 B12R1.497 [13CH3]SCc1c(ccc(c1F)Cl)Cl 62a_200025704644_100009814555 [0,2,0,0,0,0|2,0,0]=4 12312 B12R1.497 [13CH3]SCc1c(ccc(c1F)Cl)F 62a_100009813610_200025704644 [0,2,0,0,0,0|2,0,0]=4 12313 B12R1.497 [13CH3]SCc1c(ccc(c1F)Cl)F 62a_200025704644_100009813610 [0,2,0,0,0,0|2,0,0]=4 12314 B12R1.497 [13CH3]SCc1c(ccc(c1F)F)Br 62a_100011070584_200025704644 [0,2,0,0,0,0|2,0,0]=4 12315 B12R1.497 [13CH3]SCc1c(ccc(c1F)F)Br 62a_200025704644_100011070584 [0,2,0,0,0,0|2,0,0]=4 12316 B12R1.497 [13CH3]SCc1c(ccc(c1F)F)Cl 62a_100010381632_200025704644 [0,2,0,0,0,0|2,0,0]=4 12317 B12R1.497 [13CH3]SCc1c(ccc(c1F)F)Cl 62a_200025704644_100010381632 [0,2,0,0,0,0|2,0,0]=4 12318 B12R1.497 [13CH3]SCc1c(ccc(c1F)F)F 62a_100009813269_200025704644 [0,2,0,0,0,0|2,0,0]=4 12319 B12R1.497 [13CH3]SCc1c(ccc(c1F)F)F 62a_200025704644_100009813269 [0,2,0,0,0,0|2,0,0]=4 12320 B12R1.542 C=CCc1cccc(c1OC)C 34a_200011218211_200000210301 [0,2,0,0,0,0|0,0,2]=4 12321 B12R1.542 C=CCc1cccc(c1OC)C 7a_200011218211_200000210301 [0,2,0,0,0,0|0,0,2]=4 12322 B12R1.542 C=CCc1cccc(c1O[13CH3])C 34a_200011218211_200025704644 [0,2,0,0,0,0|0,0,2]=4 12323 B12R1.542 C=CCc1cccc(c1O[13CH3])C 7a_200011218211_200025704644 [0,2,0,0,0,0|0,0,2]=4 12324 B12R1.542 CC=Cc1cccc(c1CO)F 271570a_100016259895_100012355691 [0,2,0,0,0,0|0,0,2]=4 12325 B12R1.542 CC=Cc1cccc(c1CO)N 271570a_100016259895_100000747656 [0,2,0,0,0,0|0,0,2]=4 12326 B12R1.542 CC=Cc1cccc(c1OC)Br 271570a_100016259895_100010146560 [0,2,0,0,0,0|0,0,2]=4 12327 B12R1.542 CC=Cc1cccc(c1OC)C 271570a_100016259895_100010141385 [0,2,0,0,0,0|0,0,2]=4 12328 B12R1.542 CC=Cc1cccc(c1OC)Cl 271570a_100016259895_100010147678 [0,2,0,0,0,0|0,0,2]=4 12329 B12R1.542 CC=Cc1cccc(c1OC)F 271570a_100016259895_100009816759 [0,2,0,0,0,0|0,0,2]=4 12330 B12R1.542 CC=Cc1cccc(c1OC)N 271570a_100016259895_100011935253 [0,2,0,0,0,0|0,0,2]=4 12331 B12R1.542 CC=Cc1cccc(c1OC)O 271570a_100016259895_100010234590 [0,2,0,0,0,0|0,0,2]=4 12332 B12R1.542 CCNc1cccc(c1C#N)Br 27a_100015525214_100010071968 [0,2,0,0,0,0|2,0,0]=4 12333 B12R1.542 CCNc1cccc(c1C#N)Br 7a_100011935054_100000210202 [0,2,0,0,0,0|2,0,0]=4 12334 B12R1.542 CCNc1cccc(c1C#N)C 2230a_100000763283_100000210202 [0,2,0,0,0,0|2,0,0]=4 12335 B12R1.542 CCNc1cccc(c1C#N)C 34a_100000763283_100000210202 [0,2,0,0,0,0|2,0,0]=4 12336 B12R1.542 CCNc1cccc(c1C#N)C 7a_100000763283_100000210202 [0,2,0,0,0,0|2,0,0]=4 12337 B12R1.542 CCNc1cccc(c1C#N)Cl 2230a_100000236969_100000210202 [0,2,0,0,0,0|2,0,0]=4 12338 B12R1.542 CCNc1cccc(c1C#N)Cl 27a_100015525214_200000049503 [0,2,0,0,0,0|2,0,0]=4 12339 B12R1.542 CCNc1cccc(c1C#N)Cl 7a_100000236969_100000210202 [0,2,0,0,0,0|2,0,0]=4 12340 B12R1.542 CCNc1cccc(c1C#N)F 2230a_100000236971_100000210202 [0,2,0,0,0,0|2,0,0]=4 12341 B12R1.542 CCNc1cccc(c1C#N)F 27a_100015525214_100000039607 [0,2,0,0,0,0|2,0,0]=4 12342 B12R1.542 CCNc1cccc(c1C#N)F 34a_100000236971_100000210202 [0,2,0,0,0,0|2,0,0]=4 12343 B12R1.542 CCNc1cccc(c1C#N)F 7a_100000236971_100000210202 [0,2,0,0,0,0|2,0,0]=4 12344 B12R1.542 CCNc1cccc(c1CO)Br 34a_100000747656_100000210202 [0,2,0,0,0,0|1,0,0]=3 12345 B12R1.542 CCNc1cccc(c1CO)Cl 34a_100011916388_100000210202 [0,2,0,0,0,0|1,0,0]=3 12346 B12R1.542 CCNc1cccc(c1CO)F 34a_100011846719_100000210202 [0,2,0,0,0,0|1,0,0]=3 12347 B12R1.542 CCNc1cccc(c1OC)Br 34a_100011935253_100000210202 [0,2,0,0,0,0|1,0,0]=3 12348 B12R1.542 CCNc1cccc(c1OC)C 34a_100012017360_100000210202 [0,2,0,0,0,0|1,0,0]=3 12349 B12R1.542 CCNc1cccc(c1OC)Cl 2230a_100000743799_100000210202 [0,2,0,0,0,0|1,0,0]=3 12350 B12R1.542 CCNc1cccc(c1OC)Cl 34a_100000743799_100000210202 [0,2,0,0,0,0|1,0,0]=3 12351 B12R1.542 CCNc1cccc(c1OC)F 34a_100011215007_100000210202 [0,2,0,0,0,0|1,0,0]=3 12352 B12R1.542 CCOc1cccc(c1C#N)Br 34a_100012180507_100000210202 [0,2,0,0,0,0|2,0,0]=4 12353 B12R1.542 CCOc1cccc(c1C#N)Br 7a_100012180507_100000210202 [0,2,0,0,0,0|2,0,0]=4 12354 B12R1.542 CCOc1cccc(c1C#N)C 34a_100000079363_100000210202 [0,2,0,0,0,0|2,0,0]=4 12355 B12R1.542 CCOc1cccc(c1C#N)C 7a_100000079363_100000210202 [0,2,0,0,0,0|2,0,0]=4 12356 B12R1.542 CCOc1cccc(c1C#N)Cl 34a_100000764475_100000210202 [0,2,0,0,0,0|2,0,0]=4 12357 B12R1.542 CCOc1cccc(c1C#N)Cl 7a_100000764475_100000210202 [0,2,0,0,0,0|2,0,0]=4 12358 B12R1.542 CCOc1cccc(c1C#N)F 34a_100000741147_100000210202 [0,2,0,0,0,0|2,0,0]=4 12359 B12R1.542 CCOc1cccc(c1C#N)F 7a_100000741147_100000210202 [0,2,0,0,0,0|2,0,0]=4 12360 B12R1.542 CCOc1cccc(c1CO)C 34a_200009874777_100000210202 [0,2,0,0,0,0|1,0,0]=3 12361 B12R1.542 CCOc1cccc(c1CO)C 7a_200009874777_100000210202 [0,2,0,0,0,0|1,0,0]=3 12362 B12R1.542 CCOc1cccc(c1NC)Br 34a_200103155331_200000210301 [0,2,0,0,0,0|2,0,0]=4 12363 B12R1.542 CCOc1cccc(c1NC)Cl 34a_100012284057_200000210301 [0,2,0,0,0,0|2,0,0]=4 12364 B12R1.542 CCOc1cccc(c1N[13CH3])Br 34a_200103155331_200025704644 [0,2,0,0,0,0|2,0,0]=4 12365 B12R1.542 CCOc1cccc(c1N[13CH3])Cl 34a_100012284057_200025704644 [0,2,0,0,0,0|2,0,0]=4 12366 B12R1.542 CCOc1cccc(c1OC)Br 34a_100010234590_100000210202 [0,2,0,0,0,0|1,0,0]=3 12367 B12R1.542 CCOc1cccc(c1OC)Cl 34a_200009886253_100000210202 [0,2,0,0,0,0|1,0,0]=3 12368 B12R1.542 CCOc1cccc(c1OC)Cl 7a_200009886253_100000210202 [0,2,0,0,0,0|1,0,0]=3 12369 B12R1.542 CCOc1cccc(c1SC)C 34a_200000099257_100000210202 [0,2,0,0,0,0|1,1,0]=4 12370 B12R1.542 CCOc1cccc(c1SC)C 7a_200000099257_100000210202 [0,2,0,0,0,0|1,1,0]=4 12371 B12R1.542 CCOc1ccnc(c1OC)Cl 34a_100000104430_100000210202 [0,2,0,0,0,0|2,0,0]=4 12372 B12R1.542 CCSc1cccc(c1C#N)Br 62a_100000210202_100010071968 [0,2,0,0,0,0|2,0,0]=4 12373 B12R1.542 CCSc1cccc(c1C#N)Br 62a_100010071968_100000210202 [0,2,0,0,0,0|2,0,0]=4 12374 B12R1.542 CCSc1cccc(c1C#N)C 62a_100000210202_100009819585 [0,2,0,0,0,0|2,0,0]=4 12375 B12R1.542 CCSc1cccc(c1C#N)Cl 62a_100000210202_200000049503 [0,2,0,0,0,0|2,0,0]=4 12376 B12R1.542 CCSc1cccc(c1C#N)F 62a_100000210202_100000039607 [0,2,0,0,0,0|2,0,0]=4 12377 B12R1.542 CCSc1cccc(c1C#N)N 62a_100000210202_100011935054 [0,2,0,0,0,0|2,0,0]=4 12378 B12R1.542 CCSc1cccc(c1C#N)O 62a_100000210202_100012180507 [0,2,0,0,0,0|2,0,0]=4 12379 B12R1.542 CCSc1cccc(c1C=O)C 62a_100000041122_100000210202 [0,2,0,0,0,0|1,0,1]=4 12380 B12R1.542 CCSc1cccc(c1C=O)C 62a_100000210202_100000041122 [0,2,0,0,0,0|1,0,1]=4 12381 B12R1.542 CCSc1cccc(c1C=O)Cl 62a_100000210202_100010147682 [0,2,0,0,0,0|1,0,1]=4 12382 B12R1.542 CCSc1cccc(c1C=O)Cl 62a_100010147682_100000210202 [0,2,0,0,0,0|1,0,1]=4 12383 B12R1.542 CCSc1cccc(c1C=O)F 62a_100000210083_100000210202 [0,2,0,0,0,0|1,0,1]=4 12384 B12R1.542 CCSc1cccc(c1C=O)F 62a_100000210202_100000210083 [0,2,0,0,0,0|1,0,1]=4 12385 B12R1.542 CCSc1cccc(c1C=O)N 62a_100010232536_100000210202 [0,2,0,0,0,0|1,0,1]=4 12386 B12R1.542 CCSc1cccc(c1C=O)O 62a_100000210202_100010193437 [0,2,0,0,0,0|1,0,1]=4 12387 B12R1.542 CCSc1cccc(c1CN)F 62a_100000210202_100012349121 [0,2,0,0,0,0|2,0,0]=4 12388 B12R1.542 CCSc1cccc(c1CN)F 62a_100012349121_100000210202 [0,2,0,0,0,0|2,0,0]=4 12389 B12R1.542 CCSc1cccc(c1CO)F 62a_100000210202_100012355691 [0,2,0,0,0,0|1,0,0]=3 12390 B12R1.542 CCSc1cccc(c1CO)F 62a_100012355691_100000210202 [0,2,0,0,0,0|1,0,0]=3 12391 B12R1.542 CCSc1cccc(c1CO)N 62a_100000210202_100000747656 [0,2,0,0,0,0|1,0,0]=3 12392 B12R1.542 CCSc1cccc(c1CO)N 62a_100000747656_100000210202 [0,2,0,0,0,0|1,0,0]=3 12393 B12R1.542 CCSc1cccc(c1NC)N 62a_100010510394_100000210202 [0,2,0,0,0,0|2,0,0]=4 12394 B12R1.542 CCSc1cccc(c1NN)F 62a_100000210202_100016994982 [0,2,0,0,0,0|2,0,0]=4 12395 B12R1.542 CCSc1cccc(c1NN)F 62a_100016994982_100000210202 [0,2,0,0,0,0|2,0,0]=4 12396 B12R1.542 CCSc1cccc(c1OC)Br 62a_100000210202_100010146560 [0,2,0,0,0,0|1,0,0]=3 12397 B12R1.542 CCSc1cccc(c1OC)Br 62a_100010146560_100000210202 [0,2,0,0,0,0|1,0,0]=3 12398 B12R1.542 CCSc1cccc(c1OC)C 62a_100000210202_100010141385 [0,2,0,0,0,0|1,0,0]=3 12399 B12R1.542 CCSc1cccc(c1OC)C 62a_100010141385_100000210202 [0,2,0,0,0,0|1,0,0]=3 12400 B12R1.542 CCSc1cccc(c1OC)Cl 62a_100000210202_100010147678 [0,2,0,0,0,0|1,0,0]=3 12401 B12R1.542 CCSc1cccc(c1OC)Cl 62a_100010147678_100000210202 [0,2,0,0,0,0|1,0,0]=3 12402 B12R1.542 CCSc1cccc(c1OC)F 62a_100000210202_100009816759 [0,2,0,0,0,0|1,0,0]=3 12403 B12R1.542 CCSc1cccc(c1OC)F 62a_100009816759_100000210202 [0,2,0,0,0,0|1,0,0]=3 12404 B12R1.542 CCSc1cccc(c1OC)N 62a_100011935253_100000210202 [0,2,0,0,0,0|1,0,0]=3 12405 B12R1.542 CCSc1cccc(c1OC)O 62a_100000210202_100010234590 [0,2,0,0,0,0|1,0,0]=3 12406 B12R1.542 CCSc1cccc(c1SC)F 62a_100000210202_200010709249 [0,2,0,0,0,0|1,1,0]=4 12407 B12R1.542 CCSc1cccc(c1SC)F 62a_200010709249_100000210202 [0,2,0,0,0,0|1,1,0]=4 12408 B12R1.542 CCSc1ccnc(c1CO)Cl 62a_100000047008_100000210202 [0,2,0,0,0,0|2,0,0]=4 12409 B12R1.542 CCSc1ccnc(c1CO)Cl 62a_100000210202_100000047008 [0,2,0,0,0,0|2,0,0]=4 12410 B12R1.542 CCSc1ccnc(c1CO)F 62a_100000050056_100000210202 [0,2,0,0,0,0|2,0,0]=4 12411 B12R1.542 CCSc1ccnc(c1CO)F 62a_100000210202_100000050056 [0,2,0,0,0,0|2,0,0]=4 12412 B12R1.542 CCSc1ccnc(c1OC)C 62a_100000210202_100000685116 [0,2,0,0,0,0|2,0,0]=4 12413 B12R1.542 CCSc1ccnc(c1OC)C 62a_100000685116_100000210202 [0,2,0,0,0,0|2,0,0]=4 12414 B12R1.542 CCSc1ccnc(c1OC)Cl 62a_100000210202_100010068014 [0,2,0,0,0,0|2,0,0]=4 12415 B12R1.542 CCSc1ccnc(c1OC)Cl 62a_100010068014_100000210202 [0,2,0,0,0,0|2,0,0]=4 12416 B12R1.542 CCSc1ccnc(c1OC)N 62a_100000210202_100009880012 [0,2,0,0,0,0|2,0,0]=4 12417 B12R1.542 CCSc1ccnc(c1OC)N 62a_100009880012_100000210202 [0,2,0,0,0,0|2,0,0]=4 12418 B12R1.542 CCSc1cncc(c1OC)N 62a_100000210202_100012359933 [0,2,0,0,0,0|2,0,0]=4 12419 B12R1.542 CCSc1cncc(c1OC)N 62a_100012359933_100000210202 [0,2,0,0,0,0|2,0,0]=4 12420 B12R1.542 CCSc1nccc(c1OC)N 62a_100000104429_100000210202 [0,2,0,0,0,0|2,0,0]=4 12421 B12R1.542 CCSc1nccc(c1OC)N 62a_100000210202_100000104429 [0,2,0,0,0,0|2,0,0]=4 12422 B12R1.542 CCSc1nccc(c1OC)O 62a_100000210202_100000104430 [0,2,0,0,0,0|2,0,0]=4 12423 B12R1.542 CNCc1cccc(c1C#N)Br 2230a_106832991635_200010145453 [0,2,0,0,0,0|2,0,0]=4 12424 B12R1.542 CNCc1cccc(c1C#N)Br 34a_100102657272_200010145453 [0,2,0,0,0,0|2,0,0]=4 12425 B12R1.542 CNCc1cccc(c1C#N)Br 7a_106832991635_200010145453 [0,2,0,0,0,0|2,0,0]=4 12426 B12R1.542 CNCc1cccc(c1C#N)F 2230a_106832991635_100000707650 [0,2,0,0,0,0|2,0,0]=4 12427 B12R1.542 CNCc1cccc(c1C#N)F 34a_100102657272_100000707650 [0,2,0,0,0,0|2,0,0]=4 12428 B12R1.542 CNCc1cccc(c1C#N)F 7a_106832991635_100000707650 [0,2,0,0,0,0|2,0,0]=4 12429 B12R1.542 CNCc1cccc(c1OC)Br 207a_100102657272_100000692592 [0,2,0,0,0,0|1,0,0]=3 12430 B12R1.542 CNCc1cccc(c1OC)Br 2230a_106832991635_100011470457 [0,2,0,0,0,0|1,0,0]=3 12431 B12R1.542 CNCc1cccc(c1OC)Br 26a_100102657272_100010234590 [0,2,0,0,0,0|1,0,0]=3 12432 B12R1.542 CNCc1cccc(c1OC)Br 270004a_106832991635_100000692592 [0,2,0,0,0,0|1,0,0]=3 12433 B12R1.542 CNCc1cccc(c1OC)Br 34a_100102657272_100011470457 [0,2,0,0,0,0|1,0,0]=3 12434 B12R1.542 CNCc1cccc(c1OC)Br 7a_106832991635_100011470457 [0,2,0,0,0,0|1,0,0]=3 12435 B12R1.542 CNCc1cccc(c1OC)C 207a_100102657272_100011361485 [0,2,0,0,0,0|1,0,0]=3 12436 B12R1.542 CNCc1cccc(c1OC)C 2230a_106832991635_100012349798 [0,2,0,0,0,0|1,0,0]=3 12437 B12R1.542 CNCc1cccc(c1OC)C 270004a_106832991635_100011361485 [0,2,0,0,0,0|1,0,0]=3 12438 B12R1.542 CNCc1cccc(c1OC)C 34a_100102657272_100012349798 [0,2,0,0,0,0|1,0,0]=3 12439 B12R1.542 CNCc1cccc(c1OC)C 7a_106832991635_100012349798 [0,2,0,0,0,0|1,0,0]=3 12440 B12R1.542 CNCc1cccc(c1OC)Cl 207a_100102657272_100011466644 [0,2,0,0,0,0|1,0,0]=3 12441 B12R1.542 CNCc1cccc(c1OC)Cl 26a_100102657272_200009886253 [0,2,0,0,0,0|1,0,0]=3 12442 B12R1.542 CNCc1cccc(c1OC)Cl 270004a_106832991635_100011466644 [0,2,0,0,0,0|1,0,0]=3 12443 B12R1.542 CNCc1cccc(c1OC)F 207a_100102657272_100011830294 [0,2,0,0,0,0|1,0,0]=3 12444 B12R1.542 CNCc1cccc(c1OC)F 270004a_106832991635_100011830294 [0,2,0,0,0,0|1,0,0]=3 12445 B12R1.542 CNCc1cccc(c1OC)F 34a_100137345168_200000210301 [0,2,0,0,0,0|1,0,0]=3 12446 B12R1.542 CNCc1ccnc(c1OC)Br 270004a_106832991635_200009814792 [0,2,0,0,0,0|2,0,0]=4 12447 B12R1.542 CNCc1ccnc(c1OC)Cl 207a_100102657272_100009863717 [0,2,0,0,0,0|2,0,0]=4 12448 B12R1.542 CNCc1ccnc(c1OC)Cl 270004a_106832991635_100009863717 [0,2,0,0,0,0|2,0,0]=4 12449 B12R1.542 CNCc1cncc(c1OC)Br 207a_100102657272_100015834815 [0,2,0,0,0,0|2,0,0]=4 12450 B12R1.542 CNCc1cncc(c1OC)Br 270004a_106832991635_100015834815 [0,2,0,0,0,0|2,0,0]=4 12451 B12R1.542 CNCc1nccc(c1OC)Cl 2230a_106832991635_100015371371 [0,2,0,0,0,0|2,0,0]=4 12452 B12R1.542 CNCc1nccc(c1OC)Cl 34a_100102657272_100015371371 [0,2,0,0,0,0|2,0,0]=4 12453 B12R1.542 CNCc1nccc(c1OC)Cl 7a_106832991635_100015371371 [0,2,0,0,0,0|2,0,0]=4 12454 B12R1.542 COCc1cccc(c1C#N)Br 34a_100138415774_200010145453 [0,2,0,0,0,0|2,0,0]=4 12455 B12R1.542 COCc1cccc(c1C#N)F 34a_100138415774_100000707650 [0,2,0,0,0,0|2,0,0]=4 12456 B12R1.542 COCc1cccc(c1OC)Br 34a_100000704359_200000210301 [0,2,0,0,0,0|1,0,0]=3 12457 B12R1.542 COCc1cccc(c1OC)Br 34a_100138415774_100011470457 [0,2,0,0,0,0|1,0,0]=3 12458 B12R1.542 COCc1cccc(c1OC)Br 7a_100000704359_200000210301 [0,2,0,0,0,0|1,0,0]=3 12459 B12R1.542 COCc1cccc(c1OC)C 34a_100012184769_200000210301 [0,2,0,0,0,0|1,0,0]=3 12460 B12R1.542 COCc1cccc(c1OC)C 34a_100138415774_100012349798 [0,2,0,0,0,0|1,0,0]=3 12461 B12R1.542 COCc1cccc(c1OC)C 7a_100012184769_200000210301 [0,2,0,0,0,0|1,0,0]=3 12462 B12R1.542 COCc1cccc(c1OC)F 34a_100011830279_200000210301 [0,2,0,0,0,0|1,0,0]=3 12463 B12R1.542 COCc1cccc(c1OC)F 7a_100011830279_200000210301 [0,2,0,0,0,0|1,0,0]=3 12464 B12R1.542 COCc1nccc(c1OC)Cl 34a_100009869429_200000210301 [0,2,0,0,0,0|2,0,0]=4 12465 B12R1.542 COCc1nccc(c1OC)Cl 34a_100138415774_100015371371 [0,2,0,0,0,0|2,0,0]=4 12466 B12R1.542 COc1c(cccc1CC#N)O 271570a_203496583355_100010146820 [0,2,0,0,0,0|1,0,1]=4 12467 B12R1.542 COc1c(cccc1CN[13CH3])F 34a_100137345168_200025704644 [0,2,0,0,0,0|1,0,0]=3 12468 B12R1.542 COc1c(cccc1CO[13CH3])Br 34a_100000704359_200025704644 [0,2,0,0,0,0|1,0,0]=3 12469 B12R1.542 COc1c(cccc1CO[13CH3])Br 7a_100000704359_200025704644 [0,2,0,0,0,0|1,0,0]=3 12470 B12R1.542 COc1c(cccc1CO[13CH3])C 34a_100012184769_200025704644 [0,2,0,0,0,0|1,0,0]=3 12471 B12R1.542 COc1c(cccc1CO[13CH3])C 7a_100012184769_200025704644 [0,2,0,0,0,0|1,0,0]=3 12472 B12R1.542 COc1c(cccc1CO[13CH3])F 34a_100011830279_200025704644 [0,2,0,0,0,0|1,0,0]=3 12473 B12R1.542 COc1c(cccc1CO[13CH3])F 7a_100011830279_200025704644 [0,2,0,0,0,0|1,0,0]=3 12474 B12R1.542 COc1c(cccc1CSC)Br 62a_100011470457_200000210301 [0,2,0,0,0,0|1,0,0]=3 12475 B12R1.542 COc1c(cccc1CSC)Br 62a_200000210301_100011470457 [0,2,0,0,0,0|1,0,0]=3 12476 B12R1.542 COc1c(cccc1CSC)C 62a_100012349798_200000210301 [0,2,0,0,0,0|1,0,0]=3 12477 B12R1.542 COc1c(cccc1CSC)C 62a_200000210301_100012349798 [0,2,0,0,0,0|1,0,0]=3 12478 B12R1.542 COc1c(cccc1CS[13CH3])Br 62a_100011470457_200025704644 [0,2,0,0,0,0|1,0,0]=3 12479 B12R1.542 COc1c(cccc1CS[13CH3])Br 62a_200025704644_100011470457 [0,2,0,0,0,0|1,0,0]=3 12480 B12R1.542 COc1c(cccc1CS[13CH3])C 62a_100012349798_200025704644 [0,2,0,0,0,0|1,0,0]=3 12481 B12R1.542 COc1c(cccc1CS[13CH3])C 62a_200025704644_100012349798 [0,2,0,0,0,0|1,0,0]=3 12482 B12R1.542 COc1c(cccc1NCF)Br 34a_100011935253_100015361967 [0,2,0,0,0,0|2,0,0]=4 12483 B12R1.542 COc1c(cccc1NCF)C 34a_100012017360_100015361967 [0,2,0,0,0,0|2,0,0]=4 12484 B12R1.542 COc1c(cccc1NCF)Cl 34a_100000743799_100015361967 [0,2,0,0,0,0|2,0,0]=4 12485 B12R1.542 COc1c(cccc1NCF)F 34a_100011215007_100015361967 [0,2,0,0,0,0|2,0,0]=4 12486 B12R1.542 COc1c(cccc1OCF)Br 34a_100010234590_100015361967 [0,2,0,0,0,0|2,0,0]=4 12487 B12R1.542 COc1c(cccc1OCF)Cl 34a_200009886253_100015361967 [0,2,0,0,0,0|2,0,0]=4 12488 B12R1.542 COc1c(cccc1OCF)Cl 7a_200009886253_100015361967 [0,2,0,0,0,0|2,0,0]=4 12489 B12R1.542 COc1c(cccc1SCF)Br 62a_100010146560_100015361967 [0,2,0,0,0,0|2,0,0]=4 12490 B12R1.542 COc1c(cccc1SCF)Br 62a_100015361967_100010146560 [0,2,0,0,0,0|2,0,0]=4 12491 B12R1.542 COc1c(cccc1SCF)C 62a_100010141385_100015361967 [0,2,0,0,0,0|2,0,0]=4 12492 B12R1.542 COc1c(cccc1SCF)C 62a_100015361967_100010141385 [0,2,0,0,0,0|2,0,0]=4 12493 B12R1.542 COc1c(cccc1SCF)Cl 62a_100010147678_100015361967 [0,2,0,0,0,0|2,0,0]=4 12494 B12R1.542 COc1c(cccc1SCF)Cl 62a_100015361967_100010147678 [0,2,0,0,0,0|2,0,0]=4 12495 B12R1.542 COc1c(cccc1SCF)F 62a_100009816759_100015361967 [0,2,0,0,0,0|2,0,0]=4 12496 B12R1.542 COc1c(cccc1SCF)F 62a_100015361967_100009816759 [0,2,0,0,0,0|2,0,0]=4 12497 B12R1.542 COc1c(cccc1SCF)N 62a_100011935253_100015361967 [0,2,0,0,0,0|2,0,0]=4 12498 B12R1.542 COc1c(cccc1SCF)O 62a_100015361967_100010234590 [0,2,0,0,0,0|2,0,0]=4 12499 B12R1.542 COc1c(ccnc1CO[13CH3])Cl 34a_100009869429_200025704644 [0,2,0,0,0,0|2,0,0]=4 12500 B12R1.542 COc1c(ccnc1CSC)Cl 62a_100015371371_200000210301 [0,2,0,0,0,0|2,0,0]=4 12501 B12R1.542 COc1c(ccnc1CSC)Cl 62a_200000210301_100015371371 [0,2,0,0,0,0|2,0,0]=4 12502 B12R1.542 COc1c(ccnc1CS[13CH3])Cl 62a_100015371371_200025704644 [0,2,0,0,0,0|2,0,0]=4 12503 B12R1.542 COc1c(ccnc1CS[13CH3])Cl 62a_200025704644_100015371371 [0,2,0,0,0,0|2,0,0]=4 12504 B12R1.542 CSCc1cccc(c1C#N)Br 62a_200000210301_200010145453 [0,2,0,0,0,0|2,0,0]=4 12505 B12R1.542 CSCc1cccc(c1C#N)Br 62a_200010145453_200000210301 [0,2,0,0,0,0|2,0,0]=4 12506 B12R1.542 CSCc1cccc(c1C#N)F 62a_100000707650_200000210301 [0,2,0,0,0,0|2,0,0]=4 12507 B12R1.542 CSCc1cccc(c1C#N)F 62a_200000210301_100000707650 [0,2,0,0,0,0|2,0,0]=4 12508 B12R1.542 Cc1cccc(c1CO)OCF 34a_200009874777_100015361967 [0,2,0,0,0,0|2,0,0]=4 12509 B12R1.542 Cc1cccc(c1CO)OCF 7a_200009874777_100015361967 [0,2,0,0,0,0|2,0,0]=4 12510 B12R1.542 Nc1cccc(c1CO)SCF 62a_100000747656_100015361967 [0,2,0,0,0,0|2,0,0]=4 12511 B12R1.542 Nc1cccc(c1CO)SCF 62a_100015361967_100000747656 [0,2,0,0,0,0|2,0,0]=4 12512 B12R1.542 OCc1c(cccc1NCF)Br 34a_100000747656_100015361967 [0,2,0,0,0,0|2,0,0]=4 12513 B12R1.542 OCc1c(cccc1NCF)Cl 34a_100011916388_100015361967 [0,2,0,0,0,0|2,0,0]=4 12514 B12R1.542 OCc1c(cccc1NCF)F 34a_100011846719_100015361967 [0,2,0,0,0,0|2,0,0]=4 12515 B12R1.542 OCc1c(cccc1SCF)F 62a_100012355691_100015361967 [0,2,0,0,0,0|2,0,0]=4 12516 B12R1.542 OCc1c(cccc1SCF)F 62a_100015361967_100012355691 [0,2,0,0,0,0|2,0,0]=4 12517 B12R1.542 [13CH3]SCc1cccc(c1C#N)Br 62a_200010145453_200025704644 [0,2,0,0,0,0|2,0,0]=4 12518 B12R1.542 [13CH3]SCc1cccc(c1C#N)Br 62a_200025704644_200010145453 [0,2,0,0,0,0|2,0,0]=4 12519 B12R1.542 [13CH3]SCc1cccc(c1C#N)F 62a_100000707650_200025704644 [0,2,0,0,0,0|2,0,0]=4 12520 B12R1.542 [13CH3]SCc1cccc(c1C#N)F 62a_200025704644_100000707650 [0,2,0,0,0,0|2,0,0]=4 12521 B12R1.544 CC=Cc1ccc(c(c1O)C)F 271570a_100016259895_200010391124 [0,2,0,0,0,0|0,0,2]=4 12522 B12R1.544 CC=Cc1ccc(c(c1O)F)C 271570a_100016259895_100000722096 [0,2,0,0,0,0|0,0,2]=4 12523 B12R1.544 CC=Cc1ccc(c(c1O)F)F 271570a_100016259895_100010243909 [0,2,0,0,0,0|0,0,2]=4 12524 B12R1.544 CCNc1ccc(c(c1Br)Br)Br 34a_100010151465_100000210202 [0,2,0,0,0,0|2,0,0]=4 12525 B12R1.544 CCNc1ccc(c(c1Br)Cl)Cl 34a_100021501213_100000210202 [0,2,0,0,0,0|2,0,0]=4 12526 B12R1.544 CCNc1ccc(c(c1Br)F)F 2230a_100010232473_100000210202 [0,2,0,0,0,0|2,0,0]=4 12527 B12R1.544 CCNc1ccc(c(c1Br)F)F 34a_100010232473_100000210202 [0,2,0,0,0,0|2,0,0]=4 12528 B12R1.544 CCNc1ccc(c(c1Br)F)F 7a_100010232473_100000210202 [0,2,0,0,0,0|2,0,0]=4 12529 B12R1.544 CCNc1ccc(c(c1Br)F)I 34a_100015781493_100000210202 [0,2,0,0,0,0|2,0,0]=4 12530 B12R1.544 CCNc1ccc(c(c1C)Br)Br 2230a_100010244494_100000210202 [0,2,0,0,0,0|2,0,0]=4 12531 B12R1.544 CCNc1ccc(c(c1C)Br)Br 34a_100010244494_100000210202 [0,2,0,0,0,0|2,0,0]=4 12532 B12R1.544 CCNc1ccc(c(c1C)Br)Br 7a_100010244494_100000210202 [0,2,0,0,0,0|2,0,0]=4 12533 B12R1.544 CCNc1ccc(c(c1C)Br)C 2230a_106354213274_100000210202 [0,2,0,0,0,0|2,0,0]=4 12534 B12R1.544 CCNc1ccc(c(c1C)Br)C 34a_106354213274_100000210202 [0,2,0,0,0,0|2,0,0]=4 12535 B12R1.544 CCNc1ccc(c(c1C)Br)C 7a_106354213274_100000210202 [0,2,0,0,0,0|2,0,0]=4 12536 B12R1.544 CCNc1ccc(c(c1C)Br)Cl 2230a_100016073598_100000210202 [0,2,0,0,0,0|2,0,0]=4 12537 B12R1.544 CCNc1ccc(c(c1C)Br)Cl 34a_100016073598_100000210202 [0,2,0,0,0,0|2,0,0]=4 12538 B12R1.544 CCNc1ccc(c(c1C)Br)Cl 7a_100016073598_100000210202 [0,2,0,0,0,0|2,0,0]=4 12539 B12R1.544 CCNc1ccc(c(c1C)C)Br 2230a_100009816967_100000210202 [0,2,0,0,0,0|2,0,0]=4 12540 B12R1.544 CCNc1ccc(c(c1C)C)Br 34a_100009816967_100000210202 [0,2,0,0,0,0|2,0,0]=4 12541 B12R1.544 CCNc1ccc(c(c1C)C)Br 7a_100009816967_100000210202 [0,2,0,0,0,0|2,0,0]=4 12542 B12R1.544 CCNc1ccc(c(c1C)C)C 2230a_100000116900_100000210202 [0,2,0,0,0,0|2,0,0]=4 12543 B12R1.544 CCNc1ccc(c(c1C)C)C 34a_100000116900_100000210202 [0,2,0,0,0,0|2,0,0]=4 12544 B12R1.544 CCNc1ccc(c(c1C)C)C 7a_100000116900_100000210202 [0,2,0,0,0,0|2,0,0]=4 12545 B12R1.544 CCNc1ccc(c(c1C)C)F 2230a_100000062172_100000210202 [0,2,0,0,0,0|2,0,0]=4 12546 B12R1.544 CCNc1ccc(c(c1C)C)F 34a_100000062172_100000210202 [0,2,0,0,0,0|2,0,0]=4 12547 B12R1.544 CCNc1ccc(c(c1C)C)F 7a_100000062172_100000210202 [0,2,0,0,0,0|2,0,0]=4 12548 B12R1.544 CCNc1ccc(c(c1C)C)O 34a_200011216674_100000210202 [0,2,0,0,0,0|2,0,0]=4 12549 B12R1.544 CCNc1ccc(c(c1C)C)O 7a_200011216674_100000210202 [0,2,0,0,0,0|2,0,0]=4 12550 B12R1.544 CCNc1ccc(c(c1C)Cl)Br 2230a_100009816872_100000210202 [0,2,0,0,0,0|2,0,0]=4 12551 B12R1.544 CCNc1ccc(c(c1C)Cl)Br 34a_100009816872_100000210202 [0,2,0,0,0,0|2,0,0]=4 12552 B12R1.544 CCNc1ccc(c(c1C)Cl)Br 7a_100009816872_100000210202 [0,2,0,0,0,0|2,0,0]=4 12553 B12R1.544 CCNc1ccc(c(c1C)Cl)C 2230a_100009954856_100000210202 [0,2,0,0,0,0|2,0,0]=4 12554 B12R1.544 CCNc1ccc(c(c1C)Cl)C 34a_100009954856_100000210202 [0,2,0,0,0,0|2,0,0]=4 12555 B12R1.544 CCNc1ccc(c(c1C)Cl)C 7a_100009954856_100000210202 [0,2,0,0,0,0|2,0,0]=4 12556 B12R1.544 CCNc1ccc(c(c1C)Cl)Cl 2230a_114948340058_100000210202 [0,2,0,0,0,0|2,0,0]=4 12557 B12R1.544 CCNc1ccc(c(c1C)Cl)Cl 34a_114948340058_100000210202 [0,2,0,0,0,0|2,0,0]=4 12558 B12R1.544 CCNc1ccc(c(c1C)Cl)Cl 7a_114948340058_100000210202 [0,2,0,0,0,0|2,0,0]=4 12559 B12R1.544 CCNc1ccc(c(c1C)F)Br 2230a_100010208198_100000210202 [0,2,0,0,0,0|2,0,0]=4 12560 B12R1.544 CCNc1ccc(c(c1C)F)Br 34a_100010208198_100000210202 [0,2,0,0,0,0|2,0,0]=4 12561 B12R1.544 CCNc1ccc(c(c1C)F)Br 7a_100010208198_100000210202 [0,2,0,0,0,0|2,0,0]=4 12562 B12R1.544 CCNc1ccc(c(c1C)F)I 34a_100010291050_100000210202 [0,2,0,0,0,0|2,0,0]=4 12563 B12R1.544 CCNc1ccc(c(c1C)F)I 7a_100010291050_100000210202 [0,2,0,0,0,0|2,0,0]=4 12564 B12R1.544 CCNc1ccc(c(c1C)I)C 34a_100011170560_100000210202 [0,2,0,0,0,0|2,0,0]=4 12565 B12R1.544 CCNc1ccc(c(c1C)I)C 7a_100011170560_100000210202 [0,2,0,0,0,0|2,0,0]=4 12566 B12R1.544 CCNc1ccc(c(c1Cl)C)Cl 34a_100011935240_100000210202 [0,2,0,0,0,0|2,0,0]=4 12567 B12R1.544 CCNc1ccc(c(c1Cl)C)Cl 7a_100011935240_100000210202 [0,2,0,0,0,0|2,0,0]=4 12568 B12R1.544 CCNc1ccc(c(c1Cl)C)F 2230a_100009863382_100000210202 [0,2,0,0,0,0|2,0,0]=4 12569 B12R1.544 CCNc1ccc(c(c1Cl)C)F 34a_100009863382_100000210202 [0,2,0,0,0,0|2,0,0]=4 12570 B12R1.544 CCNc1ccc(c(c1Cl)C)F 7a_100009863382_100000210202 [0,2,0,0,0,0|2,0,0]=4 12571 B12R1.544 CCNc1ccc(c(c1Cl)Cl)Br 34a_100000701039_100000210202 [0,2,0,0,0,0|2,0,0]=4 12572 B12R1.544 CCNc1ccc(c(c1Cl)Cl)Cl 34a_200000033989_100000210202 [0,2,0,0,0,0|2,0,0]=4 12573 B12R1.544 CCNc1ccc(c(c1Cl)Cl)F 2230a_100000068956_100000210202 [0,2,0,0,0,0|2,0,0]=4 12574 B12R1.544 CCNc1ccc(c(c1Cl)Cl)F 34a_100000068956_100000210202 [0,2,0,0,0,0|2,0,0]=4 12575 B12R1.544 CCNc1ccc(c(c1Cl)Cl)F 7a_100000068956_100000210202 [0,2,0,0,0,0|2,0,0]=4 12576 B12R1.544 CCNc1ccc(c(c1Cl)Cl)O 34a_100012017499_100000210202 [0,2,0,0,0,0|2,0,0]=4 12577 B12R1.544 CCNc1ccc(c(c1Cl)Cl)O 7a_100012017499_100000210202 [0,2,0,0,0,0|2,0,0]=4 12578 B12R1.544 CCNc1ccc(c(c1Cl)F)Br 2230a_100010109752_100000210202 [0,2,0,0,0,0|2,0,0]=4 12579 B12R1.544 CCNc1ccc(c(c1Cl)F)Br 34a_100010109752_100000210202 [0,2,0,0,0,0|2,0,0]=4 12580 B12R1.544 CCNc1ccc(c(c1Cl)F)Cl 2230a_100000069711_100000210202 [0,2,0,0,0,0|2,0,0]=4 12581 B12R1.544 CCNc1ccc(c(c1Cl)F)Cl 34a_100000069711_100000210202 [0,2,0,0,0,0|2,0,0]=4 12582 B12R1.544 CCNc1ccc(c(c1Cl)F)Cl 7a_100000069711_100000210202 [0,2,0,0,0,0|2,0,0]=4 12583 B12R1.544 CCNc1ccc(c(c1Cl)F)F 2230a_100000101296_100000210202 [0,2,0,0,0,0|2,0,0]=4 12584 B12R1.544 CCNc1ccc(c(c1Cl)F)F 34a_100000101296_100000210202 [0,2,0,0,0,0|2,0,0]=4 12585 B12R1.544 CCNc1ccc(c(c1Cl)F)F 7a_100000101296_100000210202 [0,2,0,0,0,0|2,0,0]=4 12586 B12R1.544 CCNc1ccc(c(c1Cl)O)C 34a_100000036876_100000210202 [0,2,0,0,0,0|2,0,0]=4 12587 B12R1.544 CCNc1ccc(c(c1Cl)O)C 7a_100000036876_100000210202 [0,2,0,0,0,0|2,0,0]=4 12588 B12R1.544 CCNc1ccc(c(c1F)Br)F 2230a_100010070858_100000210202 [0,2,0,0,0,0|2,0,0]=4 12589 B12R1.544 CCNc1ccc(c(c1F)Br)F 34a_100010070858_100000210202 [0,2,0,0,0,0|2,0,0]=4 12590 B12R1.544 CCNc1ccc(c(c1F)Br)F 7a_100010070858_100000210202 [0,2,0,0,0,0|2,0,0]=4 12591 B12R1.544 CCNc1ccc(c(c1F)C)Br 2230a_100000722916_100000210202 [0,2,0,0,0,0|2,0,0]=4 12592 B12R1.544 CCNc1ccc(c(c1F)C)Br 34a_100000722916_100000210202 [0,2,0,0,0,0|2,0,0]=4 12593 B12R1.544 CCNc1ccc(c(c1F)C)Br 7a_100000722916_100000210202 [0,2,0,0,0,0|2,0,0]=4 12594 B12R1.544 CCNc1ccc(c(c1F)C)F 2230a_102495366501_100000210202 [0,2,0,0,0,0|2,0,0]=4 12595 B12R1.544 CCNc1ccc(c(c1F)C)F 34a_102495366501_100000210202 [0,2,0,0,0,0|2,0,0]=4 12596 B12R1.544 CCNc1ccc(c(c1F)C)F 7a_102495366501_100000210202 [0,2,0,0,0,0|2,0,0]=4 12597 B12R1.544 CCNc1ccc(c(c1F)C)O 34a_200000126710_100000210202 [0,2,0,0,0,0|2,0,0]=4 12598 B12R1.544 CCNc1ccc(c(c1F)C)O 7a_200000126710_100000210202 [0,2,0,0,0,0|2,0,0]=4 12599 B12R1.544 CCNc1ccc(c(c1F)Cl)Br 2230a_100009813730_100000210202 [0,2,0,0,0,0|2,0,0]=4 12600 B12R1.544 CCNc1ccc(c(c1F)Cl)Br 34a_100009813730_100000210202 [0,2,0,0,0,0|2,0,0]=4 12601 B12R1.544 CCNc1ccc(c(c1F)Cl)Cl 2230a_100000036759_100000210202 [0,2,0,0,0,0|2,0,0]=4 12602 B12R1.544 CCNc1ccc(c(c1F)Cl)Cl 34a_100000036759_100000210202 [0,2,0,0,0,0|2,0,0]=4 12603 B12R1.544 CCNc1ccc(c(c1F)Cl)F 2230a_100000038966_100000210202 [0,2,0,0,0,0|2,0,0]=4 12604 B12R1.544 CCNc1ccc(c(c1F)Cl)F 34a_100000038966_100000210202 [0,2,0,0,0,0|2,0,0]=4 12605 B12R1.544 CCNc1ccc(c(c1F)Cl)F 7a_100000038966_100000210202 [0,2,0,0,0,0|2,0,0]=4 12606 B12R1.544 CCNc1ccc(c(c1F)Cl)O 34a_200000098347_100000210202 [0,2,0,0,0,0|2,0,0]=4 12607 B12R1.544 CCNc1ccc(c(c1F)Cl)O 7a_200000098347_100000210202 [0,2,0,0,0,0|2,0,0]=4 12608 B12R1.544 CCNc1ccc(c(c1F)F)Br 2230a_100010200256_100000210202 [0,2,0,0,0,0|2,0,0]=4 12609 B12R1.544 CCNc1ccc(c(c1F)F)Br 34a_100010200256_100000210202 [0,2,0,0,0,0|2,0,0]=4 12610 B12R1.544 CCNc1ccc(c(c1F)F)C 2230a_100000062217_100000210202 [0,2,0,0,0,0|2,0,0]=4 12611 B12R1.544 CCNc1ccc(c(c1F)F)C 34a_100000062217_100000210202 [0,2,0,0,0,0|2,0,0]=4 12612 B12R1.544 CCNc1ccc(c(c1F)F)C 7a_100000062217_100000210202 [0,2,0,0,0,0|2,0,0]=4 12613 B12R1.544 CCNc1ccc(c(c1F)F)Cl 2230a_100000088996_100000210202 [0,2,0,0,0,0|2,0,0]=4 12614 B12R1.544 CCNc1ccc(c(c1F)F)Cl 34a_100000088996_100000210202 [0,2,0,0,0,0|2,0,0]=4 12615 B12R1.544 CCNc1ccc(c(c1F)F)Cl 7a_100000088996_100000210202 [0,2,0,0,0,0|2,0,0]=4 12616 B12R1.544 CCNc1ccc(c(c1F)F)F 2230a_100000210235_100000210202 [0,2,0,0,0,0|2,0,0]=4 12617 B12R1.544 CCNc1ccc(c(c1F)F)F 34a_100000210235_100000210202 [0,2,0,0,0,0|2,0,0]=4 12618 B12R1.544 CCNc1ccc(c(c1F)F)F 7a_100000210235_100000210202 [0,2,0,0,0,0|2,0,0]=4 12619 B12R1.544 CCNc1ccc(c(c1F)F)I 34a_100010291506_100000210202 [0,2,0,0,0,0|2,0,0]=4 12620 B12R1.544 CCNc1ccc(c(c1F)F)I 7a_100010291506_100000210202 [0,2,0,0,0,0|2,0,0]=4 12621 B12R1.544 CCNc1ccc(c(c1F)F)O 34a_100015204651_100000210202 [0,2,0,0,0,0|2,0,0]=4 12622 B12R1.544 CCNc1ccc(c(c1F)F)O 7a_100015204651_100000210202 [0,2,0,0,0,0|2,0,0]=4 12623 B12R1.544 CCNc1ccc(c(c1F)I)F 34a_100015510717_100000210202 [0,2,0,0,0,0|2,0,0]=4 12624 B12R1.544 CCNc1ccc(c(c1I)Br)F 34a_100020765651_100000210202 [0,2,0,0,0,0|2,0,0]=4 12625 B12R1.544 CCNc1ccc(c(c1I)Cl)Br 34a_200010779962_100000210202 [0,2,0,0,0,0|2,0,0]=4 12626 B12R1.544 CCNc1ccc(c(c1I)Cl)Cl 34a_200011093878_100000210202 [0,2,0,0,0,0|2,0,0]=4 12627 B12R1.544 CCNc1ccc(c(c1I)F)Cl 34a_100010134325_100000210202 [0,2,0,0,0,0|2,0,0]=4 12628 B12R1.544 CCNc1ccc(c(c1O)Br)F 34a_100010128263_100000210202 [0,2,0,0,0,0|1,0,0]=3 12629 B12R1.544 CCNc1ccc(c(c1O)F)F 34a_100015205010_100000210202 [0,2,0,0,0,0|1,0,0]=3 12630 B12R1.544 CCOc1ccc(c(c1C)Br)C 34a_100010659238_100000210202 [0,2,0,0,0,0|2,0,0]=4 12631 B12R1.544 CCOc1ccc(c(c1C)Br)C 7a_100010659238_100000210202 [0,2,0,0,0,0|2,0,0]=4 12632 B12R1.544 CCOc1ccc(c(c1C)C)Br 34a_100012353674_100000210202 [0,2,0,0,0,0|2,0,0]=4 12633 B12R1.544 CCOc1ccc(c(c1C)C)Br 7a_100012353674_100000210202 [0,2,0,0,0,0|2,0,0]=4 12634 B12R1.544 CCOc1ccc(c(c1C)C)F 34a_100009847123_100000210202 [0,2,0,0,0,0|2,0,0]=4 12635 B12R1.544 CCOc1ccc(c(c1C)C)F 7a_100009847123_100000210202 [0,2,0,0,0,0|2,0,0]=4 12636 B12R1.544 CCOc1ccc(c(c1C)C)I 34a_100011356951_100000210202 [0,2,0,0,0,0|2,0,0]=4 12637 B12R1.544 CCOc1ccc(c(c1C)C)I 7a_100011356951_100000210202 [0,2,0,0,0,0|2,0,0]=4 12638 B12R1.544 CCOc1ccc(c(c1C)C)N 34a_200011216674_100000210202 [0,2,0,0,0,0|2,0,0]=4 12639 B12R1.544 CCOc1ccc(c(c1C)C)N 7a_200011216674_100000210202 [0,2,0,0,0,0|2,0,0]=4 12640 B12R1.544 CCOc1ccc(c(c1C)F)Br 34a_100010390934_100000210202 [0,2,0,0,0,0|2,0,0]=4 12641 B12R1.544 CCOc1ccc(c(c1C)F)Br 7a_100010390934_100000210202 [0,2,0,0,0,0|2,0,0]=4 12642 B12R1.544 CCOc1ccc(c(c1C)F)N 34a_200000126710_100000210202 [0,2,0,0,0,0|2,0,0]=4 12643 B12R1.544 CCOc1ccc(c(c1C)F)N 7a_200000126710_100000210202 [0,2,0,0,0,0|2,0,0]=4 12644 B12R1.544 CCOc1ccc(c(c1Cl)C)Br 34a_100021574527_100000210202 [0,2,0,0,0,0|2,0,0]=4 12645 B12R1.544 CCOc1ccc(c(c1Cl)C)Br 7a_100021574527_100000210202 [0,2,0,0,0,0|2,0,0]=4 12646 B12R1.544 CCOc1ccc(c(c1Cl)Cl)Br 34a_100011988769_100000210202 [0,2,0,0,0,0|2,0,0]=4 12647 B12R1.544 CCOc1ccc(c(c1Cl)Cl)Br 7a_100011988769_100000210202 [0,2,0,0,0,0|2,0,0]=4 12648 B12R1.544 CCOc1ccc(c(c1Cl)Cl)Cl 34a_200011215298_100000210202 [0,2,0,0,0,0|2,0,0]=4 12649 B12R1.544 CCOc1ccc(c(c1Cl)Cl)Cl 7a_200011215298_100000210202 [0,2,0,0,0,0|2,0,0]=4 12650 B12R1.544 CCOc1ccc(c(c1Cl)Cl)N 34a_100012017499_100000210202 [0,2,0,0,0,0|2,0,0]=4 12651 B12R1.544 CCOc1ccc(c(c1Cl)Cl)N 7a_100012017499_100000210202 [0,2,0,0,0,0|2,0,0]=4 12652 B12R1.544 CCOc1ccc(c(c1Cl)F)Br 34a_100010245746_100000210202 [0,2,0,0,0,0|2,0,0]=4 12653 B12R1.544 CCOc1ccc(c(c1Cl)F)Br 7a_100010245746_100000210202 [0,2,0,0,0,0|2,0,0]=4 12654 B12R1.544 CCOc1ccc(c(c1Cl)F)N 34a_200000098347_100000210202 [0,2,0,0,0,0|2,0,0]=4 12655 B12R1.544 CCOc1ccc(c(c1Cl)F)N 7a_200000098347_100000210202 [0,2,0,0,0,0|2,0,0]=4 12656 B12R1.544 CCOc1ccc(c(c1Cl)N)Cl 34a_100016988457_100000210202 [0,2,0,0,0,0|2,0,0]=4 12657 B12R1.544 CCOc1ccc(c(c1Cl)N)Cl 7a_100016988457_100000210202 [0,2,0,0,0,0|2,0,0]=4 12658 B12R1.544 CCOc1ccc(c(c1F)F)Br 34a_100011830415_100000210202 [0,2,0,0,0,0|2,0,0]=4 12659 B12R1.544 CCOc1ccc(c(c1F)F)Br 7a_100011830415_100000210202 [0,2,0,0,0,0|2,0,0]=4 12660 B12R1.544 CCOc1ccc(c(c1F)F)C 34a_100000036877_100000210202 [0,2,0,0,0,0|2,0,0]=4 12661 B12R1.544 CCOc1ccc(c(c1F)F)C 7a_100000036877_100000210202 [0,2,0,0,0,0|2,0,0]=4 12662 B12R1.544 CCOc1ccc(c(c1F)F)F 34a_100000230025_100000210202 [0,2,0,0,0,0|2,0,0]=4 12663 B12R1.544 CCOc1ccc(c(c1F)F)F 7a_100000230025_100000210202 [0,2,0,0,0,0|2,0,0]=4 12664 B12R1.544 CCOc1ccc(c(c1F)F)I 34a_200011356956_100000210202 [0,2,0,0,0,0|2,0,0]=4 12665 B12R1.544 CCOc1ccc(c(c1F)F)I 7a_200011356956_100000210202 [0,2,0,0,0,0|2,0,0]=4 12666 B12R1.544 CCOc1ccc(c(c1F)F)N 34a_100015204651_100000210202 [0,2,0,0,0,0|2,0,0]=4 12667 B12R1.544 CCOc1ccc(c(c1F)F)N 7a_100015204651_100000210202 [0,2,0,0,0,0|2,0,0]=4 12668 B12R1.544 CCOc1ccc(c(c1F)F)O 271570a_203496583355_100010177744 [0,2,0,0,0,0|2,0,0]=4 12669 B12R1.544 CCOc1ccc(c(c1N)C)Br 34a_100013039247_100000210202 [0,2,0,0,0,0|2,0,0]=4 12670 B12R1.544 CCOc1ccc(c(c1N)C)Br 7a_100013039247_100000210202 [0,2,0,0,0,0|2,0,0]=4 12671 B12R1.544 CCSc1ccc(c(c1C)C)Br 62a_100000210202_200010185626 [0,2,0,0,0,0|2,0,0]=4 12672 B12R1.544 CCSc1ccc(c(c1C)C)Br 62a_200010185626_100000210202 [0,2,0,0,0,0|2,0,0]=4 12673 B12R1.544 CCSc1ccc(c(c1C)C)F 62a_100000210202_100009816033 [0,2,0,0,0,0|2,0,0]=4 12674 B12R1.544 CCSc1ccc(c(c1C)C)F 62a_100009816033_100000210202 [0,2,0,0,0,0|2,0,0]=4 12675 B12R1.544 CCSc1ccc(c(c1C)C)N 62a_100000210202_100009816967 [0,2,0,0,0,0|2,0,0]=4 12676 B12R1.544 CCSc1ccc(c(c1C)C)N 62a_100009816967_100000210202 [0,2,0,0,0,0|2,0,0]=4 12677 B12R1.544 CCSc1ccc(c(c1C)C)O 62a_100000210202_100012353674 [0,2,0,0,0,0|2,0,0]=4 12678 B12R1.544 CCSc1ccc(c(c1C)C)O 62a_100012353674_100000210202 [0,2,0,0,0,0|2,0,0]=4 12679 B12R1.544 CCSc1ccc(c(c1C)Cl)Br 62a_100000210202_200010212245 [0,2,0,0,0,0|2,0,0]=4 12680 B12R1.544 CCSc1ccc(c(c1C)Cl)Br 62a_200010212245_100000210202 [0,2,0,0,0,0|2,0,0]=4 12681 B12R1.544 CCSc1ccc(c(c1C)F)Br 62a_100000210202_100010208201 [0,2,0,0,0,0|2,0,0]=4 12682 B12R1.544 CCSc1ccc(c(c1C)F)Br 62a_100010208201_100000210202 [0,2,0,0,0,0|2,0,0]=4 12683 B12R1.544 CCSc1ccc(c(c1C)F)F 62a_100000210202_100009815991 [0,2,0,0,0,0|2,0,0]=4 12684 B12R1.544 CCSc1ccc(c(c1C)F)F 62a_100009815991_100000210202 [0,2,0,0,0,0|2,0,0]=4 12685 B12R1.544 CCSc1ccc(c(c1C)F)N 62a_100000210202_100000722916 [0,2,0,0,0,0|2,0,0]=4 12686 B12R1.544 CCSc1ccc(c(c1C)F)N 62a_100000722916_100000210202 [0,2,0,0,0,0|2,0,0]=4 12687 B12R1.544 CCSc1ccc(c(c1C)N)C 62a_100000210202_200010074581 [0,2,0,0,0,0|2,0,0]=4 12688 B12R1.544 CCSc1ccc(c(c1C)N)C 62a_200010074581_100000210202 [0,2,0,0,0,0|2,0,0]=4 12689 B12R1.544 CCSc1ccc(c(c1C)N)F 62a_100000210202_100010588651 [0,2,0,0,0,0|2,0,0]=4 12690 B12R1.544 CCSc1ccc(c(c1C)N)F 62a_100010588651_100000210202 [0,2,0,0,0,0|2,0,0]=4 12691 B12R1.544 CCSc1ccc(c(c1C)N)N 62a_100010009725_100000210202 [0,2,0,0,0,0|2,0,0]=4 12692 B12R1.544 CCSc1ccc(c(c1C)N)O 62a_100000210202_100013039247 [0,2,0,0,0,0|2,0,0]=4 12693 B12R1.544 CCSc1ccc(c(c1C)N)O 62a_100013039247_100000210202 [0,2,0,0,0,0|2,0,0]=4 12694 B12R1.544 CCSc1ccc(c(c1Cl)C)Br 62a_100000210202_100055076181 [0,2,0,0,0,0|2,0,0]=4 12695 B12R1.544 CCSc1ccc(c(c1Cl)C)Br 62a_100055076181_100000210202 [0,2,0,0,0,0|2,0,0]=4 12696 B12R1.544 CCSc1ccc(c(c1Cl)C)Cl 62a_100000210202_100010730154 [0,2,0,0,0,0|2,0,0]=4 12697 B12R1.544 CCSc1ccc(c(c1Cl)C)Cl 62a_100010730154_100000210202 [0,2,0,0,0,0|2,0,0]=4 12698 B12R1.544 CCSc1ccc(c(c1Cl)Cl)Br 62a_100000210202_200012356690 [0,2,0,0,0,0|2,0,0]=4 12699 B12R1.544 CCSc1ccc(c(c1Cl)Cl)Br 62a_200012356690_100000210202 [0,2,0,0,0,0|2,0,0]=4 12700 B12R1.544 CCSc1ccc(c(c1F)Br)F 62a_100000210202_100010167943 [0,2,0,0,0,0|2,0,0]=4 12701 B12R1.544 CCSc1ccc(c(c1F)Br)F 62a_100010167943_100000210202 [0,2,0,0,0,0|2,0,0]=4 12702 B12R1.544 CCSc1ccc(c(c1F)Br)N 62a_100000210202_100015781493 [0,2,0,0,0,0|2,0,0]=4 12703 B12R1.544 CCSc1ccc(c(c1F)Br)N 62a_100015781493_100000210202 [0,2,0,0,0,0|2,0,0]=4 12704 B12R1.544 CCSc1ccc(c(c1F)C)C 62a_100000210202_200015555822 [0,2,0,0,0,0|2,0,0]=4 12705 B12R1.544 CCSc1ccc(c(c1F)C)C 62a_200015555822_100000210202 [0,2,0,0,0,0|2,0,0]=4 12706 B12R1.544 CCSc1ccc(c(c1F)C)F 62a_100000210202_100009815987 [0,2,0,0,0,0|2,0,0]=4 12707 B12R1.544 CCSc1ccc(c(c1F)C)F 62a_100009815987_100000210202 [0,2,0,0,0,0|2,0,0]=4 12708 B12R1.544 CCSc1ccc(c(c1F)C)N 62a_100000210202_100010208198 [0,2,0,0,0,0|2,0,0]=4 12709 B12R1.544 CCSc1ccc(c(c1F)C)N 62a_100010208198_100000210202 [0,2,0,0,0,0|2,0,0]=4 12710 B12R1.544 CCSc1ccc(c(c1F)C)O 62a_100000210202_100010390934 [0,2,0,0,0,0|2,0,0]=4 12711 B12R1.544 CCSc1ccc(c(c1F)C)O 62a_100010390934_100000210202 [0,2,0,0,0,0|2,0,0]=4 12712 B12R1.544 CCSc1ccc(c(c1F)Cl)Br 62a_100000210202_100010212236 [0,2,0,0,0,0|2,0,0]=4 12713 B12R1.544 CCSc1ccc(c(c1F)Cl)Br 62a_100010212236_100000210202 [0,2,0,0,0,0|2,0,0]=4 12714 B12R1.544 CCSc1ccc(c(c1F)Cl)F 62a_100000210202_200000038702 [0,2,0,0,0,0|2,0,0]=4 12715 B12R1.544 CCSc1ccc(c(c1F)Cl)F 62a_200000038702_100000210202 [0,2,0,0,0,0|2,0,0]=4 12716 B12R1.544 CCSc1ccc(c(c1F)F)Br 62a_100000210202_100010212264 [0,2,0,0,0,0|2,0,0]=4 12717 B12R1.544 CCSc1ccc(c(c1F)F)Br 62a_100010212264_100000210202 [0,2,0,0,0,0|2,0,0]=4 12718 B12R1.544 CCSc1ccc(c(c1F)F)C 62a_100000210202_100012766498 [0,2,0,0,0,0|2,0,0]=4 12719 B12R1.544 CCSc1ccc(c(c1F)F)C 62a_100012766498_100000210202 [0,2,0,0,0,0|2,0,0]=4 12720 B12R1.544 CCSc1ccc(c(c1F)F)F 62a_100000210202_100000750562 [0,2,0,0,0,0|2,0,0]=4 12721 B12R1.544 CCSc1ccc(c(c1F)F)F 62a_100000750562_100000210202 [0,2,0,0,0,0|2,0,0]=4 12722 B12R1.544 CCSc1ccc(c(c1F)F)N 62a_100000210202_100010200256 [0,2,0,0,0,0|2,0,0]=4 12723 B12R1.544 CCSc1ccc(c(c1F)F)N 62a_100010200256_100000210202 [0,2,0,0,0,0|2,0,0]=4 12724 B12R1.544 CCSc1ccc(c(c1F)F)O 62a_100000210202_100011830415 [0,2,0,0,0,0|2,0,0]=4 12725 B12R1.544 CCSc1ccc(c(c1F)F)O 62a_100011830415_100000210202 [0,2,0,0,0,0|2,0,0]=4 12726 B12R1.544 CCSc1ccc(c(c1F)N)F 62a_100000210202_100025793129 [0,2,0,0,0,0|2,0,0]=4 12727 B12R1.544 CCSc1ccc(c(c1F)N)F 62a_100025793129_100000210202 [0,2,0,0,0,0|2,0,0]=4 12728 B12R1.544 CCSc1ccc(c(c1F)N)N 62a_100009814308_100000210202 [0,2,0,0,0,0|2,0,0]=4 12729 B12R1.544 CCSc1ccc(c(c1F)O)Br 62a_100000210202_200010782288 [0,2,0,0,0,0|2,0,0]=4 12730 B12R1.544 CCSc1ccc(c(c1F)O)Br 62a_200010782288_100000210202 [0,2,0,0,0,0|2,0,0]=4 12731 B12R1.544 CCSc1ccc(c(c1F)O)F 62a_100000210202_100010167067 [0,2,0,0,0,0|2,0,0]=4 12732 B12R1.544 CCSc1ccc(c(c1F)O)F 62a_100010167067_100000210202 [0,2,0,0,0,0|2,0,0]=4 12733 B12R1.544 CCSc1ccc(c(c1N)C)F 62a_100000210202_100011009917 [0,2,0,0,0,0|2,0,0]=4 12734 B12R1.544 CCSc1ccc(c(c1N)C)F 62a_100011009917_100000210202 [0,2,0,0,0,0|2,0,0]=4 12735 B12R1.544 CCSc1ccc(c(c1N)F)F 62a_100000210202_100010008850 [0,2,0,0,0,0|2,0,0]=4 12736 B12R1.544 CCSc1ccc(c(c1N)F)F 62a_100010008850_100000210202 [0,2,0,0,0,0|2,0,0]=4 12737 B12R1.544 CCSc1ccc(c(c1N)N)F 62a_100011102919_100000210202 [0,2,0,0,0,0|2,0,0]=4 12738 B12R1.544 CCSc1ccc(c(c1N)O)Br 62a_100020748643_100000210202 [0,2,0,0,0,0|2,0,0]=4 12739 B12R1.544 CCSc1ccc(c(c1O)C)F 62a_100000210202_200010391124 [0,2,0,0,0,0|1,0,0]=3 12740 B12R1.544 CCSc1ccc(c(c1O)C)F 62a_200010391124_100000210202 [0,2,0,0,0,0|1,0,0]=3 12741 B12R1.544 CCSc1ccc(c(c1O)F)C 62a_100000210202_100000722096 [0,2,0,0,0,0|1,0,0]=3 12742 B12R1.544 CCSc1ccc(c(c1O)F)C 62a_100000722096_100000210202 [0,2,0,0,0,0|1,0,0]=3 12743 B12R1.544 CCSc1ccc(c(c1O)F)F 62a_100000210202_100010243909 [0,2,0,0,0,0|1,0,0]=3 12744 B12R1.544 CCSc1ccc(c(c1O)F)F 62a_100010243909_100000210202 [0,2,0,0,0,0|1,0,0]=3 12745 B12R1.544 CNCc1ccc(c(c1Br)F)F 207a_100102657272_100015087033 [0,2,0,0,0,0|2,0,0]=4 12746 B12R1.544 CNCc1ccc(c(c1Br)F)F 2230a_106832991635_100016216887 [0,2,0,0,0,0|2,0,0]=4 12747 B12R1.544 CNCc1ccc(c(c1Br)F)F 34a_100102657272_100016216887 [0,2,0,0,0,0|2,0,0]=4 12748 B12R1.544 CNCc1ccc(c(c1Br)F)F 7a_106832991635_100016216887 [0,2,0,0,0,0|2,0,0]=4 12749 B12R1.544 CNCc1ccc(c(c1C)Br)C 26a_100102657272_100010659238 [0,2,0,0,0,0|2,0,0]=4 12750 B12R1.544 CNCc1ccc(c(c1C)F)Br 26a_100102657272_100010390934 [0,2,0,0,0,0|2,0,0]=4 12751 B12R1.544 CNCc1ccc(c(c1C)F)F 207a_100102657272_100000070781 [0,2,0,0,0,0|2,0,0]=4 12752 B12R1.544 CNCc1ccc(c(c1C)F)F 2230a_103437846394_200000210301 [0,2,0,0,0,0|2,0,0]=4 12753 B12R1.544 CNCc1ccc(c(c1C)F)F 270004a_106832991635_100000070781 [0,2,0,0,0,0|2,0,0]=4 12754 B12R1.544 CNCc1ccc(c(c1C)F)F 34a_103437846394_200000210301 [0,2,0,0,0,0|2,0,0]=4 12755 B12R1.544 CNCc1ccc(c(c1Cl)C)Br 26a_100102657272_100021574527 [0,2,0,0,0,0|2,0,0]=4 12756 B12R1.544 CNCc1ccc(c(c1Cl)C)F 207a_100102657272_100009872231 [0,2,0,0,0,0|2,0,0]=4 12757 B12R1.544 CNCc1ccc(c(c1Cl)C)F 270004a_106832991635_100009872231 [0,2,0,0,0,0|2,0,0]=4 12758 B12R1.544 CNCc1ccc(c(c1Cl)Cl)Br 26a_100102657272_100011988769 [0,2,0,0,0,0|2,0,0]=4 12759 B12R1.544 CNCc1ccc(c(c1Cl)Cl)C 207a_100102657272_100009830617 [0,2,0,0,0,0|2,0,0]=4 12760 B12R1.544 CNCc1ccc(c(c1Cl)Cl)C 270004a_106832991635_100009830617 [0,2,0,0,0,0|2,0,0]=4 12761 B12R1.544 CNCc1ccc(c(c1Cl)Cl)Cl 207a_100102657272_100009994748 [0,2,0,0,0,0|2,0,0]=4 12762 B12R1.544 CNCc1ccc(c(c1Cl)Cl)Cl 26a_100102657272_200011215298 [0,2,0,0,0,0|2,0,0]=4 12763 B12R1.544 CNCc1ccc(c(c1Cl)Cl)Cl 270004a_106832991635_100009994748 [0,2,0,0,0,0|2,0,0]=4 12764 B12R1.544 CNCc1ccc(c(c1Cl)F)Br 26a_100102657272_100010245746 [0,2,0,0,0,0|2,0,0]=4 12765 B12R1.544 CNCc1ccc(c(c1Cl)F)Cl 207a_100102657272_100010892301 [0,2,0,0,0,0|2,0,0]=4 12766 B12R1.544 CNCc1ccc(c(c1Cl)F)Cl 270004a_106832991635_100010892301 [0,2,0,0,0,0|2,0,0]=4 12767 B12R1.544 CNCc1ccc(c(c1Cl)F)F 207a_100102657272_100009876578 [0,2,0,0,0,0|2,0,0]=4 12768 B12R1.544 CNCc1ccc(c(c1F)Br)C 207a_100102657272_100010381662 [0,2,0,0,0,0|2,0,0]=4 12769 B12R1.544 CNCc1ccc(c(c1F)Br)C 270004a_106832991635_100010381662 [0,2,0,0,0,0|2,0,0]=4 12770 B12R1.544 CNCc1ccc(c(c1F)Br)F 207a_100102657272_100010713142 [0,2,0,0,0,0|2,0,0]=4 12771 B12R1.544 CNCc1ccc(c(c1F)C)Br 207a_100102657272_100015546853 [0,2,0,0,0,0|2,0,0]=4 12772 B12R1.544 CNCc1ccc(c(c1F)C)Br 270004a_106832991635_100015546853 [0,2,0,0,0,0|2,0,0]=4 12773 B12R1.544 CNCc1ccc(c(c1F)C)F 207a_100102657272_100000068945 [0,2,0,0,0,0|2,0,0]=4 12774 B12R1.544 CNCc1ccc(c(c1F)C)F 2230a_200000062210_200000210301 [0,2,0,0,0,0|2,0,0]=4 12775 B12R1.544 CNCc1ccc(c(c1F)C)F 270004a_106832991635_100000068945 [0,2,0,0,0,0|2,0,0]=4 12776 B12R1.544 CNCc1ccc(c(c1F)C)F 34a_200000062210_200000210301 [0,2,0,0,0,0|2,0,0]=4 12777 B12R1.544 CNCc1ccc(c(c1F)Cl)Cl 207a_100102657272_100009892358 [0,2,0,0,0,0|2,0,0]=4 12778 B12R1.544 CNCc1ccc(c(c1F)Cl)Cl 270004a_106832991635_100009892358 [0,2,0,0,0,0|2,0,0]=4 12779 B12R1.544 CNCc1ccc(c(c1F)Cl)F 207a_100102657272_100000050342 [0,2,0,0,0,0|2,0,0]=4 12780 B12R1.544 CNCc1ccc(c(c1F)Cl)F 2230a_100000062223_200000210301 [0,2,0,0,0,0|2,0,0]=4 12781 B12R1.544 CNCc1ccc(c(c1F)Cl)F 2230a_106832991635_100009814552 [0,2,0,0,0,0|2,0,0]=4 12782 B12R1.544 CNCc1ccc(c(c1F)Cl)F 270004a_106832991635_100000050342 [0,2,0,0,0,0|2,0,0]=4 12783 B12R1.544 CNCc1ccc(c(c1F)Cl)F 34a_100000062223_200000210301 [0,2,0,0,0,0|2,0,0]=4 12784 B12R1.544 CNCc1ccc(c(c1F)Cl)F 34a_100102657272_100009814552 [0,2,0,0,0,0|2,0,0]=4 12785 B12R1.544 CNCc1ccc(c(c1F)Cl)F 7a_106832991635_100009814552 [0,2,0,0,0,0|2,0,0]=4 12786 B12R1.544 CNCc1ccc(c(c1F)F)Br 207a_100102657272_100011361484 [0,2,0,0,0,0|2,0,0]=4 12787 B12R1.544 CNCc1ccc(c(c1F)F)Br 2230a_100020621914_200000210301 [0,2,0,0,0,0|2,0,0]=4 12788 B12R1.544 CNCc1ccc(c(c1F)F)Br 26a_100102657272_100011830415 [0,2,0,0,0,0|2,0,0]=4 12789 B12R1.544 CNCc1ccc(c(c1F)F)Br 34a_100020621914_200000210301 [0,2,0,0,0,0|2,0,0]=4 12790 B12R1.544 CNCc1ccc(c(c1F)F)C 207a_100102657272_100011216850 [0,2,0,0,0,0|2,0,0]=4 12791 B12R1.544 CNCc1ccc(c(c1F)F)C 2230a_102516457222_200000210301 [0,2,0,0,0,0|2,0,0]=4 12792 B12R1.544 CNCc1ccc(c(c1F)F)C 2230a_106832991635_100009813564 [0,2,0,0,0,0|2,0,0]=4 12793 B12R1.544 CNCc1ccc(c(c1F)F)C 34a_100102657272_100009813564 [0,2,0,0,0,0|2,0,0]=4 12794 B12R1.544 CNCc1ccc(c(c1F)F)C 34a_102516457222_200000210301 [0,2,0,0,0,0|2,0,0]=4 12795 B12R1.544 CNCc1ccc(c(c1F)F)C 7a_106832991635_100009813564 [0,2,0,0,0,0|2,0,0]=4 12796 B12R1.544 CNCc1ccc(c(c1F)F)F 207a_100102657272_100011215601 [0,2,0,0,0,0|2,0,0]=4 12797 B12R1.544 CNCc1ccc(c(c1F)F)F 2230a_102516457209_200000210301 [0,2,0,0,0,0|2,0,0]=4 12798 B12R1.544 CNCc1ccc(c(c1F)F)F 2230a_106832991635_100011218744 [0,2,0,0,0,0|2,0,0]=4 12799 B12R1.544 CNCc1ccc(c(c1F)F)F 26a_100102657272_100000230025 [0,2,0,0,0,0|2,0,0]=4 12800 B12R1.544 CNCc1ccc(c(c1F)F)F 34a_100102657272_100011218744 [0,2,0,0,0,0|2,0,0]=4 12801 B12R1.544 CNCc1ccc(c(c1F)F)F 34a_102516457209_200000210301 [0,2,0,0,0,0|2,0,0]=4 12802 B12R1.544 CNCc1ccc(c(c1F)F)F 7a_106832991635_100011218744 [0,2,0,0,0,0|2,0,0]=4 12803 B12R1.544 CNCc1ccc(c(c1F)F)I 207a_100102657272_100010209662 [0,2,0,0,0,0|2,0,0]=4 12804 B12R1.544 COCc1ccc(c(c1Br)F)F 34a_100015087060_200000210301 [0,2,0,0,0,0|2,0,0]=4 12805 B12R1.544 COCc1ccc(c(c1Br)F)F 34a_100138415774_100016216887 [0,2,0,0,0,0|2,0,0]=4 12806 B12R1.544 COCc1ccc(c(c1Br)F)F 7a_100015087060_200000210301 [0,2,0,0,0,0|2,0,0]=4 12807 B12R1.544 COCc1ccc(c(c1Cl)F)Cl 34a_200015968052_200000210301 [0,2,0,0,0,0|2,0,0]=4 12808 B12R1.544 COCc1ccc(c(c1Cl)F)Cl 7a_200015968052_200000210301 [0,2,0,0,0,0|2,0,0]=4 12809 B12R1.544 COCc1ccc(c(c1Cl)F)F 34a_100015622271_200000210301 [0,2,0,0,0,0|2,0,0]=4 12810 B12R1.544 COCc1ccc(c(c1Cl)F)F 7a_100015622271_200000210301 [0,2,0,0,0,0|2,0,0]=4 12811 B12R1.544 COCc1ccc(c(c1F)Cl)Br 34a_100014105406_200000210301 [0,2,0,0,0,0|2,0,0]=4 12812 B12R1.544 COCc1ccc(c(c1F)Cl)Br 7a_100014105406_200000210301 [0,2,0,0,0,0|2,0,0]=4 12813 B12R1.544 COCc1ccc(c(c1F)Cl)F 34a_100138415774_100009814552 [0,2,0,0,0,0|2,0,0]=4 12814 B12R1.544 COCc1ccc(c(c1F)Cl)F 34a_200009882269_200000210301 [0,2,0,0,0,0|2,0,0]=4 12815 B12R1.544 COCc1ccc(c(c1F)Cl)F 7a_200009882269_200000210301 [0,2,0,0,0,0|2,0,0]=4 12816 B12R1.544 COCc1ccc(c(c1F)F)Br 34a_100010712623_200000210301 [0,2,0,0,0,0|2,0,0]=4 12817 B12R1.544 COCc1ccc(c(c1F)F)Br 7a_100010712623_200000210301 [0,2,0,0,0,0|2,0,0]=4 12818 B12R1.544 COCc1ccc(c(c1F)F)C 34a_100011216588_200000210301 [0,2,0,0,0,0|2,0,0]=4 12819 B12R1.544 COCc1ccc(c(c1F)F)C 34a_100138415774_100009813564 [0,2,0,0,0,0|2,0,0]=4 12820 B12R1.544 COCc1ccc(c(c1F)F)C 7a_100011216588_200000210301 [0,2,0,0,0,0|2,0,0]=4 12821 B12R1.544 COCc1ccc(c(c1F)F)F 34a_100000698974_200000210301 [0,2,0,0,0,0|2,0,0]=4 12822 B12R1.544 COCc1ccc(c(c1F)F)F 34a_100138415774_100011218744 [0,2,0,0,0,0|2,0,0]=4 12823 B12R1.544 COCc1ccc(c(c1F)F)F 7a_100000698974_200000210301 [0,2,0,0,0,0|2,0,0]=4 12824 B12R1.544 CSCc1ccc(c(c1Br)F)F 62a_100016216887_200000210301 [0,2,0,0,0,0|2,0,0]=4 12825 B12R1.544 CSCc1ccc(c(c1Br)F)F 62a_200000210301_100016216887 [0,2,0,0,0,0|2,0,0]=4 12826 B12R1.544 CSCc1ccc(c(c1F)Cl)F 62a_100009814552_200000210301 [0,2,0,0,0,0|2,0,0]=4 12827 B12R1.544 CSCc1ccc(c(c1F)Cl)F 62a_200000210301_100009814552 [0,2,0,0,0,0|2,0,0]=4 12828 B12R1.544 CSCc1ccc(c(c1F)F)C 62a_100009813564_200000210301 [0,2,0,0,0,0|2,0,0]=4 12829 B12R1.544 CSCc1ccc(c(c1F)F)C 62a_200000210301_100009813564 [0,2,0,0,0,0|2,0,0]=4 12830 B12R1.544 CSCc1ccc(c(c1F)F)F 62a_100011218744_200000210301 [0,2,0,0,0,0|2,0,0]=4 12831 B12R1.544 CSCc1ccc(c(c1F)F)F 62a_200000210301_100011218744 [0,2,0,0,0,0|2,0,0]=4 12832 B12R1.544 Cc1c(ccc(c1F)CN[13CH3])F 2230a_200000062210_200025704644 [0,2,0,0,0,0|2,0,0]=4 12833 B12R1.544 Cc1c(ccc(c1F)CN[13CH3])F 34a_200000062210_200025704644 [0,2,0,0,0,0|2,0,0]=4 12834 B12R1.544 Cc1c(ccc(c1F)F)CN[13CH3] 2230a_103437846394_200025704644 [0,2,0,0,0,0|2,0,0]=4 12835 B12R1.544 Cc1c(ccc(c1F)F)CN[13CH3] 34a_103437846394_200025704644 [0,2,0,0,0,0|2,0,0]=4 12836 B12R1.544 Cc1c(ccc(c1O)SCF)F 62a_100015361967_200010391124 [0,2,0,0,0,0|2,0,0]=4 12837 B12R1.544 Cc1c(ccc(c1O)SCF)F 62a_200010391124_100015361967 [0,2,0,0,0,0|2,0,0]=4 12838 B12R1.544 Cc1ccc(c(c1F)F)CN[13CH3] 2230a_102516457222_200025704644 [0,2,0,0,0,0|2,0,0]=4 12839 B12R1.544 Cc1ccc(c(c1F)F)CN[13CH3] 34a_102516457222_200025704644 [0,2,0,0,0,0|2,0,0]=4 12840 B12R1.544 Cc1ccc(c(c1F)F)CO[13CH3] 34a_100011216588_200025704644 [0,2,0,0,0,0|2,0,0]=4 12841 B12R1.544 Cc1ccc(c(c1F)F)CO[13CH3] 7a_100011216588_200025704644 [0,2,0,0,0,0|2,0,0]=4 12842 B12R1.544 Cc1ccc(c(c1F)F)CS[13CH3] 62a_100009813564_200025704644 [0,2,0,0,0,0|2,0,0]=4 12843 B12R1.544 Cc1ccc(c(c1F)F)CS[13CH3] 62a_200025704644_100009813564 [0,2,0,0,0,0|2,0,0]=4 12844 B12R1.544 Cc1ccc(c(c1F)O)SCF 62a_100000722096_100015361967 [0,2,0,0,0,0|2,0,0]=4 12845 B12R1.544 Cc1ccc(c(c1F)O)SCF 62a_100015361967_100000722096 [0,2,0,0,0,0|2,0,0]=4 12846 B12R1.544 Oc1c(ccc(c1Br)F)NCF 34a_100010128263_100015361967 [0,2,0,0,0,0|2,0,0]=4 12847 B12R1.544 Oc1c(ccc(c1F)F)NCF 34a_100015205010_100015361967 [0,2,0,0,0,0|2,0,0]=4 12848 B12R1.544 Oc1c(ccc(c1F)F)SCF 62a_100010243909_100015361967 [0,2,0,0,0,0|2,0,0]=4 12849 B12R1.544 Oc1c(ccc(c1F)F)SCF 62a_100015361967_100010243909 [0,2,0,0,0,0|2,0,0]=4 12850 B12R1.544 [13CH3]NCc1ccc(c(c1F)Cl)F 2230a_100000062223_200025704644 [0,2,0,0,0,0|2,0,0]=4 12851 B12R1.544 [13CH3]NCc1ccc(c(c1F)Cl)F 34a_100000062223_200025704644 [0,2,0,0,0,0|2,0,0]=4 12852 B12R1.544 [13CH3]NCc1ccc(c(c1F)F)Br 2230a_100020621914_200025704644 [0,2,0,0,0,0|2,0,0]=4 12853 B12R1.544 [13CH3]NCc1ccc(c(c1F)F)Br 34a_100020621914_200025704644 [0,2,0,0,0,0|2,0,0]=4 12854 B12R1.544 [13CH3]NCc1ccc(c(c1F)F)F 2230a_102516457209_200025704644 [0,2,0,0,0,0|2,0,0]=4 12855 B12R1.544 [13CH3]NCc1ccc(c(c1F)F)F 34a_102516457209_200025704644 [0,2,0,0,0,0|2,0,0]=4 12856 B12R1.544 [13CH3]OCc1ccc(c(c1Br)F)F 34a_100015087060_200025704644 [0,2,0,0,0,0|2,0,0]=4 12857 B12R1.544 [13CH3]OCc1ccc(c(c1Br)F)F 7a_100015087060_200025704644 [0,2,0,0,0,0|2,0,0]=4 12858 B12R1.544 [13CH3]OCc1ccc(c(c1Cl)F)Cl 34a_200015968052_200025704644 [0,2,0,0,0,0|2,0,0]=4 12859 B12R1.544 [13CH3]OCc1ccc(c(c1Cl)F)Cl 7a_200015968052_200025704644 [0,2,0,0,0,0|2,0,0]=4 12860 B12R1.544 [13CH3]OCc1ccc(c(c1Cl)F)F 34a_100015622271_200025704644 [0,2,0,0,0,0|2,0,0]=4 12861 B12R1.544 [13CH3]OCc1ccc(c(c1Cl)F)F 7a_100015622271_200025704644 [0,2,0,0,0,0|2,0,0]=4 12862 B12R1.544 [13CH3]OCc1ccc(c(c1F)Cl)Br 34a_100014105406_200025704644 [0,2,0,0,0,0|2,0,0]=4 12863 B12R1.544 [13CH3]OCc1ccc(c(c1F)Cl)Br 7a_100014105406_200025704644 [0,2,0,0,0,0|2,0,0]=4 12864 B12R1.544 [13CH3]OCc1ccc(c(c1F)Cl)F 34a_200009882269_200025704644 [0,2,0,0,0,0|2,0,0]=4 12865 B12R1.544 [13CH3]OCc1ccc(c(c1F)Cl)F 7a_200009882269_200025704644 [0,2,0,0,0,0|2,0,0]=4 12866 B12R1.544 [13CH3]OCc1ccc(c(c1F)F)Br 34a_100010712623_200025704644 [0,2,0,0,0,0|2,0,0]=4 12867 B12R1.544 [13CH3]OCc1ccc(c(c1F)F)Br 7a_100010712623_200025704644 [0,2,0,0,0,0|2,0,0]=4 12868 B12R1.544 [13CH3]OCc1ccc(c(c1F)F)F 34a_100000698974_200025704644 [0,2,0,0,0,0|2,0,0]=4 12869 B12R1.544 [13CH3]OCc1ccc(c(c1F)F)F 7a_100000698974_200025704644 [0,2,0,0,0,0|2,0,0]=4 12870 B12R1.544 [13CH3]SCc1ccc(c(c1Br)F)F 62a_100016216887_200025704644 [0,2,0,0,0,0|2,0,0]=4 12871 B12R1.544 [13CH3]SCc1ccc(c(c1Br)F)F 62a_200025704644_100016216887 [0,2,0,0,0,0|2,0,0]=4 12872 B12R1.544 [13CH3]SCc1ccc(c(c1F)Cl)F 62a_100009814552_200025704644 [0,2,0,0,0,0|2,0,0]=4 12873 B12R1.544 [13CH3]SCc1ccc(c(c1F)Cl)F 62a_200025704644_100009814552 [0,2,0,0,0,0|2,0,0]=4 12874 B12R1.544 [13CH3]SCc1ccc(c(c1F)F)F 62a_100011218744_200025704644 [0,2,0,0,0,0|2,0,0]=4 12875 B12R1.544 [13CH3]SCc1ccc(c(c1F)F)F 62a_200025704644_100011218744 [0,2,0,0,0,0|2,0,0]=4 12876 B12R1.69 C#CCNc1ccc(cc1O)Br 34a_100000739049_100000184674 [0,2,0,0,0,0|0,0,2]=4 12877 B12R1.69 C#CCNc1ccc(cc1O)C 34a_100000211527_100000184674 [0,2,0,0,0,0|0,0,2]=4 12878 B12R1.69 C#CCNc1ccc(cc1O)Cl 34a_100000185728_100000184674 [0,2,0,0,0,0|0,0,2]=4 12879 B12R1.69 C#CCNc1ccc(cc1O)F 34a_100000753323_100000184674 [0,2,0,0,0,0|0,0,2]=4 12880 B12R1.69 C#CCNc1ccc(cc1O)O 34a_100000106777_100000184674 [0,2,0,0,0,0|0,0,2]=4 12881 B12R1.69 C#CCSc1ccc(cc1O)Br 62a_100000038162_100012344904 [0,2,0,0,0,0|0,0,2]=4 12882 B12R1.69 C#CCSc1ccc(cc1O)C 62a_100000038162_100012002257 [0,2,0,0,0,0|0,0,2]=4 12883 B12R1.69 C#CCSc1ccc(cc1O)Cl 62a_100000038162_100000050036 [0,2,0,0,0,0|0,0,2]=4 12884 B12R1.69 C#CCSc1ccc(cc1O)F 62a_100000038162_100000690578 [0,2,0,0,0,0|0,0,2]=4 12885 B12R1.69 C#CCSc1ccc(cc1O)O 62a_100000038162_100009813921 [0,2,0,0,0,0|0,0,2]=4 12886 B12R1.69 C=CCNc1ccc(cc1O)Br 34a_100000739049_100015514636 [0,2,0,0,0,0|0,0,2]=4 12887 B12R1.69 C=CCNc1ccc(cc1O)C 34a_100000211527_100015514636 [0,2,0,0,0,0|0,0,2]=4 12888 B12R1.69 C=CCNc1ccc(cc1O)Cl 34a_100000185728_100015514636 [0,2,0,0,0,0|0,0,2]=4 12889 B12R1.69 C=CCNc1ccc(cc1O)F 34a_100000753323_100015514636 [0,2,0,0,0,0|0,0,2]=4 12890 B12R1.69 C=CCNc1ccc(cc1O)O 34a_100000106777_100015514636 [0,2,0,0,0,0|0,0,2]=4 12891 B12R1.69 C=CCSc1ccc(cc1O)Br 62a_100000210623_100012344904 [0,2,0,0,0,0|0,0,2]=4 12892 B12R1.69 C=CCSc1ccc(cc1O)Br 62a_100012344904_100000210623 [0,2,0,0,0,0|0,0,2]=4 12893 B12R1.69 C=CCSc1ccc(cc1O)C 62a_100000210623_100012002257 [0,2,0,0,0,0|0,0,2]=4 12894 B12R1.69 C=CCSc1ccc(cc1O)C 62a_100012002257_100000210623 [0,2,0,0,0,0|0,0,2]=4 12895 B12R1.69 C=CCSc1ccc(cc1O)Cl 62a_100000050036_100000210623 [0,2,0,0,0,0|0,0,2]=4 12896 B12R1.69 C=CCSc1ccc(cc1O)Cl 62a_100000210623_100000050036 [0,2,0,0,0,0|0,0,2]=4 12897 B12R1.69 C=CCSc1ccc(cc1O)F 62a_100000210623_100000690578 [0,2,0,0,0,0|0,0,2]=4 12898 B12R1.69 C=CCSc1ccc(cc1O)F 62a_100000690578_100000210623 [0,2,0,0,0,0|0,0,2]=4 12899 B12R1.69 C=CCSc1ccc(cc1O)O 62a_100000210623_100009813921 [0,2,0,0,0,0|0,0,2]=4 12900 B12R1.69 CCCCc1c[nH]c(=O)cc1F 271570a_100020621405_100015631685 [0,2,0,0,0,0|2,0,0]=4 12901 B12R1.69 CCCCc1cc[n+](cc1C)[O-] 271570a_100020621405_100000074940 [0,2,0,0,0,0|2,0,0]=4 12902 B12R1.69 CCCCc1ccc(=O)[nH]c1N 271570a_100020621405_100009884077 [0,2,0,0,0,0|2,0,0]=4 12903 B12R1.69 CCCCc1ccc(c[n+]1[O-])C 271570a_100020621405_100009819918 [0,2,0,0,0,0|1,0,1]=4 12904 B12R1.69 CCCCc1ccc(c[n+]1[O-])F 271570a_100020621405_100009817261 [0,2,0,0,0,0|1,0,1]=4 12905 B12R1.69 CCCCc1ccc(cc1Br)Br 271570a_100020621405_100011484698 [0,2,0,0,0,0|1,0,0]=3 12906 B12R1.69 CCCCc1ccc(cc1Br)C 271570a_100020621405_100009813563 [0,2,0,0,0,0|1,0,0]=3 12907 B12R1.69 CCCCc1ccc(cc1Br)Cl 271570a_100020621405_100011219703 [0,2,0,0,0,0|1,0,0]=3 12908 B12R1.69 CCCCc1ccc(cc1Br)F 271570a_100020621405_100011217111 [0,2,0,0,0,0|1,0,0]=3 12909 B12R1.69 CCCCc1ccc(cc1Br)N 271570a_100020621405_100000750458 [0,2,0,0,0,0|1,0,0]=3 12910 B12R1.69 CCCCc1ccc(cc1Br)O 271570a_100020621405_100000701344 [0,2,0,0,0,0|1,0,0]=3 12911 B12R1.69 CCCCc1ccc(cc1C)Br 271570a_100020621405_100000701812 [0,2,0,0,0,0|1,0,0]=3 12912 B12R1.69 CCCCc1ccc(cc1C)C 271570a_100020621405_100011217332 [0,2,0,0,0,0|1,0,0]=3 12913 B12R1.69 CCCCc1ccc(cc1C)Cl 271570a_100020621405_100011219607 [0,2,0,0,0,0|1,0,0]=3 12914 B12R1.69 CCCCc1ccc(cc1C)F 271570a_100020621405_100011205405 [0,2,0,0,0,0|1,0,0]=3 12915 B12R1.69 CCCCc1ccc(cc1C)N 271570a_100020621405_100000210723 [0,2,0,0,0,0|1,0,0]=3 12916 B12R1.69 CCCCc1ccc(cc1C)O 271570a_100020621405_100000729255 [0,2,0,0,0,0|1,0,0]=3 12917 B12R1.69 CCCCc1ccc(cc1Cl)Br 271570a_100020621405_100011216062 [0,2,0,0,0,0|1,0,0]=3 12918 B12R1.69 CCCCc1ccc(cc1Cl)C 271570a_100020621405_100011263221 [0,2,0,0,0,0|1,0,0]=3 12919 B12R1.69 CCCCc1ccc(cc1Cl)Cl 271570a_100020621405_100000699841 [0,2,0,0,0,0|1,0,0]=3 12920 B12R1.69 CCCCc1ccc(cc1Cl)F 271570a_100020621405_100000733362 [0,2,0,0,0,0|1,0,0]=3 12921 B12R1.69 CCCCc1ccc(cc1Cl)N 271570a_100020621405_100000761885 [0,2,0,0,0,0|1,0,0]=3 12922 B12R1.69 CCCCc1ccc(cc1Cl)O 271570a_100020621405_100000047559 [0,2,0,0,0,0|1,0,0]=3 12923 B12R1.69 CCCCc1ccc(cc1F)Br 271570a_100020621405_100009814013 [0,2,0,0,0,0|1,0,0]=3 12924 B12R1.69 CCCCc1ccc(cc1F)C 271570a_100020621405_100011216119 [0,2,0,0,0,0|1,0,0]=3 12925 B12R1.69 CCCCc1ccc(cc1F)Cl 271570a_100020621405_100011216042 [0,2,0,0,0,0|1,0,0]=3 12926 B12R1.69 CCCCc1ccc(cc1F)F 271570a_100020621405_100000750030 [0,2,0,0,0,0|1,0,0]=3 12927 B12R1.69 CCCCc1ccc(cc1F)N 271570a_100020621405_100011356925 [0,2,0,0,0,0|1,0,0]=3 12928 B12R1.69 CCCCc1ccc(cc1F)O 271570a_100020621405_100000755031 [0,2,0,0,0,0|1,0,0]=3 12929 B12R1.69 CCCCc1ccc(cc1N)Br 271570a_100020621405_100000743836 [0,2,0,0,0,0|1,0,0]=3 12930 B12R1.69 CCCCc1ccc(cc1N)C 271570a_100020621405_100011216686 [0,2,0,0,0,0|1,0,0]=3 12931 B12R1.69 CCCCc1ccc(cc1N)Cl 271570a_100020621405_100000761886 [0,2,0,0,0,0|1,0,0]=3 12932 B12R1.69 CCCCc1ccc(cc1N)F 271570a_100020621405_100011218093 [0,2,0,0,0,0|1,0,0]=3 12933 B12R1.69 CCCCc1ccc(cc1N)N 271570a_100020621405_200012175722 [0,2,0,0,0,0|1,0,0]=3 12934 B12R1.69 CCCCc1ccc(cc1N)O 271570a_100020621405_100011999798 [0,2,0,0,0,0|1,0,0]=3 12935 B12R1.69 CCCCc1ccc(cc1O)Br 271570a_100020621405_100012344904 [0,2,0,0,0,0|0,0,0]=2 12936 B12R1.69 CCCCc1ccc(cc1O)C 271570a_100020621405_100012002257 [0,2,0,0,0,0|0,0,0]=2 12937 B12R1.69 CCCCc1ccc(cc1O)Cl 271570a_100020621405_100000050036 [0,2,0,0,0,0|0,0,0]=2 12938 B12R1.69 CCCCc1ccc(cc1O)F 271570a_100020621405_100000690578 [0,2,0,0,0,0|0,0,0]=2 12939 B12R1.69 CCCCc1ccc(cc1O)O 271570a_100020621405_100009813921 [0,2,0,0,0,0|0,0,0]=2 12940 B12R1.69 CCCCc1ccc(nc1Br)N 271570a_100020621405_100010734177 [0,2,0,0,0,0|2,0,0]=4 12941 B12R1.69 CCCCc1ccc(nc1C)C 271570a_100020621405_100009813853 [0,2,0,0,0,0|2,0,0]=4 12942 B12R1.69 CCCCc1ccc(nc1C)Cl 271570a_100020621405_100000062408 [0,2,0,0,0,0|2,0,0]=4 12943 B12R1.69 CCCCc1ccc(nc1C)F 271570a_100020621405_100000688911 [0,2,0,0,0,0|2,0,0]=4 12944 B12R1.69 CCCCc1ccc(nc1C)N 271570a_100020621405_100000013003 [0,2,0,0,0,0|2,0,0]=4 12945 B12R1.69 CCCCc1ccc(nc1C)O 271570a_100020621405_100000691680 [0,2,0,0,0,0|2,0,0]=4 12946 B12R1.69 CCCCc1ccc(nc1Cl)Br 271570a_100020621405_100010246183 [0,2,0,0,0,0|2,0,0]=4 12947 B12R1.69 CCCCc1ccc(nc1Cl)N 271570a_100020621405_100010270343 [0,2,0,0,0,0|2,0,0]=4 12948 B12R1.69 CCCCc1ccc(nc1F)C 271570a_100020621405_100010006597 [0,2,0,0,0,0|2,0,0]=4 12949 B12R1.69 CCCCc1ccc(nc1F)Cl 271570a_100020621405_100010168078 [0,2,0,0,0,0|2,0,0]=4 12950 B12R1.69 CCCCc1ccc(nc1F)F 271570a_100020621405_100000070099 [0,2,0,0,0,0|2,0,0]=4 12951 B12R1.69 CCCCc1ccc(nc1F)N 271570a_100020621405_100009882772 [0,2,0,0,0,0|2,0,0]=4 12952 B12R1.69 CCCCc1ccc(nc1F)O 271570a_100020621405_100009879308 [0,2,0,0,0,0|2,0,0]=4 12953 B12R1.69 CCCCc1ccc(nc1N)C 271570a_100020621405_100009816662 [0,2,0,0,0,0|2,0,0]=4 12954 B12R1.69 CCCCc1ccc(nc1N)Cl 271570a_100020621405_100010171640 [0,2,0,0,0,0|2,0,0]=4 12955 B12R1.69 CCCCc1ccc(nc1N)F 271570a_100020621405_100009854977 [0,2,0,0,0,0|2,0,0]=4 12956 B12R1.69 CCCCc1ccc(nc1N)N 271570a_100020621405_100011356871 [0,2,0,0,0,0|2,0,0]=4 12957 B12R1.69 CCCCc1ccc(nc1O)C 271570a_100020621405_100009817604 [0,2,0,0,0,0|1,0,0]=3 12958 B12R1.69 CCCCc1cnc(cc1Br)F 271570a_100020621405_100015451857 [0,2,0,0,0,0|2,0,0]=4 12959 B12R1.69 CCCCc1cnc(cc1Br)N 271570a_100020621405_100010074611 [0,2,0,0,0,0|2,0,0]=4 12960 B12R1.69 CCCCc1cnc(cc1C)Br 271570a_100020621405_100009816104 [0,2,0,0,0,0|2,0,0]=4 12961 B12R1.69 CCCCc1cnc(cc1C)C 271570a_100020621405_100009819613 [0,2,0,0,0,0|2,0,0]=4 12962 B12R1.69 CCCCc1cnc(cc1C)Cl 271570a_100020621405_100010172789 [0,2,0,0,0,0|2,0,0]=4 12963 B12R1.69 CCCCc1cnc(cc1C)F 271570a_100020621405_100009820716 [0,2,0,0,0,0|2,0,0]=4 12964 B12R1.69 CCCCc1cnc(cc1C)N 271570a_100020621405_100000050067 [0,2,0,0,0,0|2,0,0]=4 12965 B12R1.69 CCCCc1cnc(cc1C)O 271570a_100020621405_100010114363 [0,2,0,0,0,0|2,0,0]=4 12966 B12R1.69 CCCCc1cnc(cc1Cl)Br 271570a_100020621405_100010381092 [0,2,0,0,0,0|2,0,0]=4 12967 B12R1.69 CCCCc1cnc(cc1Cl)Cl 271570a_100020621405_100010200927 [0,2,0,0,0,0|2,0,0]=4 12968 B12R1.69 CCCCc1cnc(cc1Cl)N 271570a_100020621405_100000694920 [0,2,0,0,0,0|2,0,0]=4 12969 B12R1.69 CCCCc1cnc(cc1F)Cl 271570a_100020621405_100010128100 [0,2,0,0,0,0|2,0,0]=4 12970 B12R1.69 CCCCc1cnc(cc1F)N 271570a_100020621405_100009844730 [0,2,0,0,0,0|2,0,0]=4 12971 B12R1.69 CCCCc1cnc(cc1N)C 271570a_100020621405_100009817891 [0,2,0,0,0,0|2,0,0]=4 12972 B12R1.69 CCCCc1cnc(cc1N)N 271570a_100020621405_200009857908 [0,2,0,0,0,0|2,0,0]=4 12973 B12R1.69 CCCCc1cnc(cc1O)C 271570a_100020621405_100011016184 [0,2,0,0,0,0|1,0,0]=3 12974 B12R1.69 CCCCc1ncc(cc1Br)Cl 271570a_100020621405_100012154958 [0,2,0,0,0,0|2,0,0]=4 12975 B12R1.69 CCCCc1ncc(cc1C)Br 271570a_100020621405_100012353652 [0,2,0,0,0,0|2,0,0]=4 12976 B12R1.69 CCCCc1ncc(cc1C)C 271570a_100020621405_100009864548 [0,2,0,0,0,0|2,0,0]=4 12977 B12R1.69 CCCCc1ncc(cc1C)F 271570a_100020621405_100009817009 [0,2,0,0,0,0|2,0,0]=4 12978 B12R1.69 CCCCc1ncc(cc1C)N 271570a_100020621405_100000761747 [0,2,0,0,0,0|2,0,0]=4 12979 B12R1.69 CCCCc1ncc(cc1C)O 271570a_100020621405_100012000486 [0,2,0,0,0,0|2,0,0]=4 12980 B12R1.69 CCCCc1ncc(cc1F)Br 271570a_100020621405_100012348576 [0,2,0,0,0,0|2,0,0]=4 12981 B12R1.69 CCCCc1ncc(cc1F)C 271570a_100020621405_100009819633 [0,2,0,0,0,0|2,0,0]=4 12982 B12R1.69 CCCCc1ncc(cc1F)Cl 271570a_100020621405_100012348686 [0,2,0,0,0,0|2,0,0]=4 12983 B12R1.69 CCCCc1ncc(cc1F)F 271570a_100020621405_100011219543 [0,2,0,0,0,0|2,0,0]=4 12984 B12R1.69 CCCCc1ncc(cc1F)N 271570a_100020621405_100010280766 [0,2,0,0,0,0|2,0,0]=4 12985 B12R1.69 CCCCc1ncc(cc1F)O 271570a_100020621405_100000063512 [0,2,0,0,0,0|2,0,0]=4 12986 B12R1.69 CCCCc1ncc(cc1N)Br 271570a_100020621405_100010090555 [0,2,0,0,0,0|2,0,0]=4 12987 B12R1.69 CCCCc1ncc(cc1N)C 271570a_100020621405_100000733613 [0,2,0,0,0,0|2,0,0]=4 12988 B12R1.69 CCCCc1ncc(cc1N)F 271570a_100020621405_100009817643 [0,2,0,0,0,0|2,0,0]=4 12989 B12R1.69 CCCCc1ncc(cc1N)N 271570a_100020621405_200000093520 [0,2,0,0,0,0|2,0,0]=4 12990 B12R1.69 CCCCc1ncc(cc1O)Br 271570a_100020621405_100010210634 [0,2,0,0,0,0|1,0,0]=3 12991 B12R1.69 CCCCc1ncc(cc1O)C 271570a_100020621405_100012000487 [0,2,0,0,0,0|1,0,0]=3 12992 B12R1.69 CCCCc1ncc(cc1O)Cl 271570a_100020621405_100010233512 [0,2,0,0,0,0|1,0,0]=3 12993 B12R1.69 CCCCc1ncc(cc1O)F 271570a_100020621405_100000079967 [0,2,0,0,0,0|1,0,0]=3 12994 B12R1.69 CCCNc1ccc(cc1Br)Br 34a_100000211012_100000210303 [0,2,0,0,0,0|1,0,0]=3 12995 B12R1.69 CCCNc1ccc(cc1Br)C 34a_100000210942_100000210303 [0,2,0,0,0,0|1,0,0]=3 12996 B12R1.69 CCCNc1ccc(cc1Br)Cl 34a_100000752454_100000210303 [0,2,0,0,0,0|1,0,0]=3 12997 B12R1.69 CCCNc1ccc(cc1Br)F 34a_100000738039_100000210303 [0,2,0,0,0,0|1,0,0]=3 12998 B12R1.69 CCCNc1ccc(cc1Br)O 34a_100012001276_100000210303 [0,2,0,0,0,0|1,0,0]=3 12999 B12R1.69 CCCNc1ccc(cc1C)Br 34a_100000211769_100000210303 [0,2,0,0,0,0|1,0,0]=3 13000 B12R1.69 CCCNc1ccc(cc1C)Br 7a_100000211769_100000210303 [0,2,0,0,0,0|1,0,0]=3 13001 B12R1.69 CCCNc1ccc(cc1C)C 34a_100000736561_100000210303 [0,2,0,0,0,0|1,0,0]=3 13002 B12R1.69 CCCNc1ccc(cc1C)C 7a_100000736561_100000210303 [0,2,0,0,0,0|1,0,0]=3 13003 B12R1.69 CCCNc1ccc(cc1C)Cl 34a_100000210418_100000210303 [0,2,0,0,0,0|1,0,0]=3 13004 B12R1.69 CCCNc1ccc(cc1C)Cl 7a_100000210418_100000210303 [0,2,0,0,0,0|1,0,0]=3 13005 B12R1.69 CCCNc1ccc(cc1C)F 34a_100000211637_100000210303 [0,2,0,0,0,0|1,0,0]=3 13006 B12R1.69 CCCNc1ccc(cc1C)F 7a_100000211637_100000210303 [0,2,0,0,0,0|1,0,0]=3 13007 B12R1.69 CCCNc1ccc(cc1C)I 34a_100000184554_100000210303 [0,2,0,0,0,0|1,0,0]=3 13008 B12R1.69 CCCNc1ccc(cc1C)I 7a_100000184554_100000210303 [0,2,0,0,0,0|1,0,0]=3 13009 B12R1.69 CCCNc1ccc(cc1C)O 34a_100000756630_100000210303 [0,2,0,0,0,0|1,0,0]=3 13010 B12R1.69 CCCNc1ccc(cc1Cl)Br 34a_100000211467_100000210303 [0,2,0,0,0,0|1,0,0]=3 13011 B12R1.69 CCCNc1ccc(cc1Cl)C 34a_100000210522_100000210303 [0,2,0,0,0,0|1,0,0]=3 13012 B12R1.69 CCCNc1ccc(cc1Cl)Cl 34a_100000185861_100000210303 [0,2,0,0,0,0|1,0,0]=3 13013 B12R1.69 CCCNc1ccc(cc1Cl)F 34a_100000212003_100000210303 [0,2,0,0,0,0|1,0,0]=3 13014 B12R1.69 CCCNc1ccc(cc1Cl)I 34a_100011218065_100000210303 [0,2,0,0,0,0|1,0,0]=3 13015 B12R1.69 CCCNc1ccc(cc1Cl)O 34a_100011215599_100000210303 [0,2,0,0,0,0|1,0,0]=3 13016 B12R1.69 CCCNc1ccc(cc1F)Br 34a_100000210722_100000210303 [0,2,0,0,0,0|1,0,0]=3 13017 B12R1.69 CCCNc1ccc(cc1F)C 34a_100000211023_100000210303 [0,2,0,0,0,0|1,0,0]=3 13018 B12R1.69 CCCNc1ccc(cc1F)Cl 34a_100000211020_100000210303 [0,2,0,0,0,0|1,0,0]=3 13019 B12R1.69 CCCNc1ccc(cc1F)F 34a_100000210720_100000210303 [0,2,0,0,0,0|1,0,0]=3 13020 B12R1.69 CCCNc1ccc(cc1F)I 34a_100011215594_100000210303 [0,2,0,0,0,0|1,0,0]=3 13021 B12R1.69 CCCNc1ccc(cc1F)O 34a_100000759473_100000210303 [0,2,0,0,0,0|1,0,0]=3 13022 B12R1.69 CCCNc1ccc(cc1I)Br 34a_100000187925_100000210303 [0,2,0,0,0,0|1,0,0]=3 13023 B12R1.69 CCCNc1ccc(cc1I)C 34a_100011356834_100000210303 [0,2,0,0,0,0|1,0,0]=3 13024 B12R1.69 CCCNc1ccc(cc1I)Cl 34a_100000761889_100000210303 [0,2,0,0,0,0|1,0,0]=3 13025 B12R1.69 CCCNc1ccc(cc1I)F 34a_100000760547_100000210303 [0,2,0,0,0,0|1,0,0]=3 13026 B12R1.69 CCCNc1ccc(cc1I)O 34a_100010084370_100000210303 [0,2,0,0,0,0|1,0,0]=3 13027 B12R1.69 CCCNc1ccc(cc1O)Br 34a_100000739049_100000210303 [0,2,0,0,0,0|0,0,0]=2 13028 B12R1.69 CCCNc1ccc(cc1O)C 34a_100000211527_100000210303 [0,2,0,0,0,0|0,0,0]=2 13029 B12R1.69 CCCNc1ccc(cc1O)Cl 34a_100000185728_100000210303 [0,2,0,0,0,0|0,0,0]=2 13030 B12R1.69 CCCNc1ccc(cc1O)F 34a_100000753323_100000210303 [0,2,0,0,0,0|0,0,0]=2 13031 B12R1.69 CCCNc1ccc(cc1O)O 34a_100000106777_100000210303 [0,2,0,0,0,0|0,0,0]=2 13032 B12R1.69 CCCOc1ccc(cc1Br)Br 34a_100000188717_100000210303 [0,2,0,0,0,0|1,0,0]=3 13033 B12R1.69 CCCOc1ccc(cc1Br)Br 7a_100000188717_100000210303 [0,2,0,0,0,0|1,0,0]=3 13034 B12R1.69 CCCOc1ccc(cc1Br)C 34a_100000210800_100000210303 [0,2,0,0,0,0|1,0,0]=3 13035 B12R1.69 CCCOc1ccc(cc1Br)C 7a_100000210800_100000210303 [0,2,0,0,0,0|1,0,0]=3 13036 B12R1.69 CCCOc1ccc(cc1Br)Cl 34a_100000211998_100000210303 [0,2,0,0,0,0|1,0,0]=3 13037 B12R1.69 CCCOc1ccc(cc1Br)Cl 7a_100000211998_100000210303 [0,2,0,0,0,0|1,0,0]=3 13038 B12R1.69 CCCOc1ccc(cc1Br)F 34a_100000211999_100000210303 [0,2,0,0,0,0|1,0,0]=3 13039 B12R1.69 CCCOc1ccc(cc1Br)F 7a_100000211999_100000210303 [0,2,0,0,0,0|1,0,0]=3 13040 B12R1.69 CCCOc1ccc(cc1Br)I 34a_100012361655_100000210303 [0,2,0,0,0,0|1,0,0]=3 13041 B12R1.69 CCCOc1ccc(cc1Br)I 7a_100012361655_100000210303 [0,2,0,0,0,0|1,0,0]=3 13042 B12R1.69 CCCOc1ccc(cc1Br)N 34a_100011534360_100000210303 [0,2,0,0,0,0|1,0,0]=3 13043 B12R1.69 CCCOc1ccc(cc1Br)N 7a_100011534360_100000210303 [0,2,0,0,0,0|1,0,0]=3 13044 B12R1.69 CCCOc1ccc(cc1C)Br 34a_100000186361_100000210303 [0,2,0,0,0,0|1,0,0]=3 13045 B12R1.69 CCCOc1ccc(cc1C)Br 7a_100000186361_100000210303 [0,2,0,0,0,0|1,0,0]=3 13046 B12R1.69 CCCOc1ccc(cc1C)C 34a_100000211776_100000210303 [0,2,0,0,0,0|1,0,0]=3 13047 B12R1.69 CCCOc1ccc(cc1C)C 7a_100000211776_100000210303 [0,2,0,0,0,0|1,0,0]=3 13048 B12R1.69 CCCOc1ccc(cc1C)Cl 34a_100000211091_100000210303 [0,2,0,0,0,0|1,0,0]=3 13049 B12R1.69 CCCOc1ccc(cc1C)Cl 7a_100000211091_100000210303 [0,2,0,0,0,0|1,0,0]=3 13050 B12R1.69 CCCOc1ccc(cc1C)F 34a_100000764316_100000210303 [0,2,0,0,0,0|1,0,0]=3 13051 B12R1.69 CCCOc1ccc(cc1C)F 7a_100000764316_100000210303 [0,2,0,0,0,0|1,0,0]=3 13052 B12R1.69 CCCOc1ccc(cc1C)I 34a_100011218673_100000210303 [0,2,0,0,0,0|1,0,0]=3 13053 B12R1.69 CCCOc1ccc(cc1C)I 7a_100011218673_100000210303 [0,2,0,0,0,0|1,0,0]=3 13054 B12R1.69 CCCOc1ccc(cc1C)N 34a_100011218179_100000210303 [0,2,0,0,0,0|1,0,0]=3 13055 B12R1.69 CCCOc1ccc(cc1C)N 7a_100011218179_100000210303 [0,2,0,0,0,0|1,0,0]=3 13056 B12R1.69 CCCOc1ccc(cc1Cl)Br 34a_100000186472_100000210303 [0,2,0,0,0,0|1,0,0]=3 13057 B12R1.69 CCCOc1ccc(cc1Cl)Br 7a_100000186472_100000210303 [0,2,0,0,0,0|1,0,0]=3 13058 B12R1.69 CCCOc1ccc(cc1Cl)C 34a_100000749699_100000210303 [0,2,0,0,0,0|1,0,0]=3 13059 B12R1.69 CCCOc1ccc(cc1Cl)C 7a_100000749699_100000210303 [0,2,0,0,0,0|1,0,0]=3 13060 B12R1.69 CCCOc1ccc(cc1Cl)Cl 34a_100015191787_100000210303 [0,2,0,0,0,0|1,0,0]=3 13061 B12R1.69 CCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000210303 [0,2,0,0,0,0|1,0,0]=3 13062 B12R1.69 CCCOc1ccc(cc1Cl)F 34a_100000212004_100000210303 [0,2,0,0,0,0|1,0,0]=3 13063 B12R1.69 CCCOc1ccc(cc1Cl)F 7a_100000212004_100000210303 [0,2,0,0,0,0|1,0,0]=3 13064 B12R1.69 CCCOc1ccc(cc1Cl)I 34a_100012360047_100000210303 [0,2,0,0,0,0|1,0,0]=3 13065 B12R1.69 CCCOc1ccc(cc1Cl)I 7a_100012360047_100000210303 [0,2,0,0,0,0|1,0,0]=3 13066 B12R1.69 CCCOc1ccc(cc1Cl)N 34a_100000744943_100000210303 [0,2,0,0,0,0|1,0,0]=3 13067 B12R1.69 CCCOc1ccc(cc1Cl)N 7a_100000744943_100000210303 [0,2,0,0,0,0|1,0,0]=3 13068 B12R1.69 CCCOc1ccc(cc1F)Br 34a_100000185481_100000210303 [0,2,0,0,0,0|1,0,0]=3 13069 B12R1.69 CCCOc1ccc(cc1F)Br 7a_100000185481_100000210303 [0,2,0,0,0,0|1,0,0]=3 13070 B12R1.69 CCCOc1ccc(cc1F)C 34a_100011216688_100000210303 [0,2,0,0,0,0|1,0,0]=3 13071 B12R1.69 CCCOc1ccc(cc1F)C 7a_100011216688_100000210303 [0,2,0,0,0,0|1,0,0]=3 13072 B12R1.69 CCCOc1ccc(cc1F)Cl 34a_100000230166_100000210303 [0,2,0,0,0,0|1,0,0]=3 13073 B12R1.69 CCCOc1ccc(cc1F)Cl 7a_100000230166_100000210303 [0,2,0,0,0,0|1,0,0]=3 13074 B12R1.69 CCCOc1ccc(cc1F)F 34a_100000230127_100000210303 [0,2,0,0,0,0|1,0,0]=3 13075 B12R1.69 CCCOc1ccc(cc1F)F 7a_100000230127_100000210303 [0,2,0,0,0,0|1,0,0]=3 13076 B12R1.69 CCCOc1ccc(cc1F)I 34a_100011356965_100000210303 [0,2,0,0,0,0|1,0,0]=3 13077 B12R1.69 CCCOc1ccc(cc1F)I 7a_100011356965_100000210303 [0,2,0,0,0,0|1,0,0]=3 13078 B12R1.69 CCCOc1ccc(cc1F)N 34a_100011220035_100000210303 [0,2,0,0,0,0|1,0,0]=3 13079 B12R1.69 CCCOc1ccc(cc1F)N 7a_100011220035_100000210303 [0,2,0,0,0,0|1,0,0]=3 13080 B12R1.69 CCCOc1ccc(cc1I)Br 34a_100012355227_100000210303 [0,2,0,0,0,0|1,0,0]=3 13081 B12R1.69 CCCOc1ccc(cc1I)Br 7a_100012355227_100000210303 [0,2,0,0,0,0|1,0,0]=3 13082 B12R1.69 CCCOc1ccc(cc1I)C 34a_100000765521_100000210303 [0,2,0,0,0,0|1,0,0]=3 13083 B12R1.69 CCCOc1ccc(cc1I)C 7a_100000765521_100000210303 [0,2,0,0,0,0|1,0,0]=3 13084 B12R1.69 CCCOc1ccc(cc1I)Cl 34a_100011356953_100000210303 [0,2,0,0,0,0|1,0,0]=3 13085 B12R1.69 CCCOc1ccc(cc1I)Cl 7a_100011356953_100000210303 [0,2,0,0,0,0|1,0,0]=3 13086 B12R1.69 CCCOc1ccc(cc1I)F 34a_100012355409_100000210303 [0,2,0,0,0,0|1,0,0]=3 13087 B12R1.69 CCCOc1ccc(cc1I)F 7a_100012355409_100000210303 [0,2,0,0,0,0|1,0,0]=3 13088 B12R1.69 CCCOc1ccc(cc1I)I 7a_100010001573_100000210303 [0,2,0,0,0,0|1,0,0]=3 13089 B12R1.69 CCCOc1ccc(cc1N)Br 34a_100000752626_100000210303 [0,2,0,0,0,0|1,0,0]=3 13090 B12R1.69 CCCOc1ccc(cc1N)Br 7a_100000752626_100000210303 [0,2,0,0,0,0|1,0,0]=3 13091 B12R1.69 CCCOc1ccc(cc1N)C 34a_100011215204_100000210303 [0,2,0,0,0,0|1,0,0]=3 13092 B12R1.69 CCCOc1ccc(cc1N)C 7a_100011215204_100000210303 [0,2,0,0,0,0|1,0,0]=3 13093 B12R1.69 CCCOc1ccc(cc1N)Cl 34a_100000210500_100000210303 [0,2,0,0,0,0|1,0,0]=3 13094 B12R1.69 CCCOc1ccc(cc1N)Cl 7a_100000210500_100000210303 [0,2,0,0,0,0|1,0,0]=3 13095 B12R1.69 CCCOc1ccc(cc1N)F 34a_100000759472_100000210303 [0,2,0,0,0,0|1,0,0]=3 13096 B12R1.69 CCCOc1ccc(cc1N)F 7a_100000759472_100000210303 [0,2,0,0,0,0|1,0,0]=3 13097 B12R1.69 CCCOc1ccc(cc1N)I 34a_100000753495_100000210303 [0,2,0,0,0,0|1,0,0]=3 13098 B12R1.69 CCCOc1ccc(cc1N)I 7a_100000753495_100000210303 [0,2,0,0,0,0|1,0,0]=3 13099 B12R1.69 CCCOc1ccc(cc1N)N 34a_100000725306_100000210303 [0,2,0,0,0,0|1,0,0]=3 13100 B12R1.69 CCCOc1ccc(cc1O)F 271570a_203496583355_200000171698 [0,2,0,0,0,0|0,0,0]=2 13101 B12R1.69 CCCOc1ccc(nc1Br)Br 34a_100009999766_100000210303 [0,2,0,0,0,0|2,0,0]=4 13102 B12R1.69 CCCOc1ccc(nc1Br)Br 7a_100009999766_100000210303 [0,2,0,0,0,0|2,0,0]=4 13103 B12R1.69 CCCOc1ccc(nc1Br)C 34a_100000702858_100000210303 [0,2,0,0,0,0|2,0,0]=4 13104 B12R1.69 CCCOc1ccc(nc1Br)C 7a_100000702858_100000210303 [0,2,0,0,0,0|2,0,0]=4 13105 B12R1.69 CCCOc1ccc(nc1Br)Cl 34a_100010219353_100000210303 [0,2,0,0,0,0|2,0,0]=4 13106 B12R1.69 CCCOc1ccc(nc1Br)Cl 7a_100010219353_100000210303 [0,2,0,0,0,0|2,0,0]=4 13107 B12R1.69 CCCOc1ccc(nc1Br)F 34a_100009887730_100000210303 [0,2,0,0,0,0|2,0,0]=4 13108 B12R1.69 CCCOc1ccc(nc1Br)F 7a_100009887730_100000210303 [0,2,0,0,0,0|2,0,0]=4 13109 B12R1.69 CCCOc1ccc(nc1Br)I 34a_100000725334_100000210303 [0,2,0,0,0,0|2,0,0]=4 13110 B12R1.69 CCCOc1ccc(nc1Br)I 7a_100000725334_100000210303 [0,2,0,0,0,0|2,0,0]=4 13111 B12R1.69 CCCOc1ccc(nc1C)Br 34a_100012002022_100000210303 [0,2,0,0,0,0|2,0,0]=4 13112 B12R1.69 CCCOc1ccc(nc1C)Br 7a_100012002022_100000210303 [0,2,0,0,0,0|2,0,0]=4 13113 B12R1.69 CCCOc1ccc(nc1C)C 34a_100011218912_100000210303 [0,2,0,0,0,0|2,0,0]=4 13114 B12R1.69 CCCOc1ccc(nc1C)C 7a_100011218912_100000210303 [0,2,0,0,0,0|2,0,0]=4 13115 B12R1.69 CCCOc1ccc(nc1C)Cl 34a_100012184626_100000210303 [0,2,0,0,0,0|2,0,0]=4 13116 B12R1.69 CCCOc1ccc(nc1C)Cl 7a_100012184626_100000210303 [0,2,0,0,0,0|2,0,0]=4 13117 B12R1.69 CCCOc1ccc(nc1C)F 34a_100009881036_100000210303 [0,2,0,0,0,0|2,0,0]=4 13118 B12R1.69 CCCOc1ccc(nc1C)F 7a_100009881036_100000210303 [0,2,0,0,0,0|2,0,0]=4 13119 B12R1.69 CCCOc1ccc(nc1C)I 34a_100010233687_100000210303 [0,2,0,0,0,0|2,0,0]=4 13120 B12R1.69 CCCOc1ccc(nc1C)I 7a_100010233687_100000210303 [0,2,0,0,0,0|2,0,0]=4 13121 B12R1.69 CCCOc1ccc(nc1Cl)Br 34a_100010246206_100000210303 [0,2,0,0,0,0|2,0,0]=4 13122 B12R1.69 CCCOc1ccc(nc1Cl)Br 7a_100010246206_100000210303 [0,2,0,0,0,0|2,0,0]=4 13123 B12R1.69 CCCOc1ccc(nc1Cl)C 34a_100000086286_100000210303 [0,2,0,0,0,0|2,0,0]=4 13124 B12R1.69 CCCOc1ccc(nc1Cl)C 7a_100000086286_100000210303 [0,2,0,0,0,0|2,0,0]=4 13125 B12R1.69 CCCOc1ccc(nc1Cl)Cl 34a_100000101165_100000210303 [0,2,0,0,0,0|2,0,0]=4 13126 B12R1.69 CCCOc1ccc(nc1Cl)Cl 7a_100000101165_100000210303 [0,2,0,0,0,0|2,0,0]=4 13127 B12R1.69 CCCOc1ccc(nc1Cl)I 34a_100000721234_100000210303 [0,2,0,0,0,0|2,0,0]=4 13128 B12R1.69 CCCOc1ccc(nc1Cl)I 7a_100000721234_100000210303 [0,2,0,0,0,0|2,0,0]=4 13129 B12R1.69 CCCOc1ccc(nc1F)Br 34a_100009819667_100000210303 [0,2,0,0,0,0|2,0,0]=4 13130 B12R1.69 CCCOc1ccc(nc1F)Br 7a_100009819667_100000210303 [0,2,0,0,0,0|2,0,0]=4 13131 B12R1.69 CCCOc1ccc(nc1F)C 34a_100000079963_100000210303 [0,2,0,0,0,0|2,0,0]=4 13132 B12R1.69 CCCOc1ccc(nc1F)C 7a_100000079963_100000210303 [0,2,0,0,0,0|2,0,0]=4 13133 B12R1.69 CCCOc1ccc(nc1F)Cl 34a_100009880201_100000210303 [0,2,0,0,0,0|2,0,0]=4 13134 B12R1.69 CCCOc1ccc(nc1F)Cl 7a_100009880201_100000210303 [0,2,0,0,0,0|2,0,0]=4 13135 B12R1.69 CCCOc1ccc(nc1F)F 34a_100000101184_100000210303 [0,2,0,0,0,0|2,0,0]=4 13136 B12R1.69 CCCOc1ccc(nc1F)F 7a_100000101184_100000210303 [0,2,0,0,0,0|2,0,0]=4 13137 B12R1.69 CCCOc1ccc(nc1I)Br 34a_100010253912_100000210303 [0,2,0,0,0,0|2,0,0]=4 13138 B12R1.69 CCCOc1ccc(nc1I)Br 7a_100010253912_100000210303 [0,2,0,0,0,0|2,0,0]=4 13139 B12R1.69 CCCOc1ccc(nc1I)C 34a_100000023897_100000210303 [0,2,0,0,0,0|2,0,0]=4 13140 B12R1.69 CCCOc1ccc(nc1I)C 7a_100000023897_100000210303 [0,2,0,0,0,0|2,0,0]=4 13141 B12R1.69 CCCOc1ccc(nc1I)Cl 34a_100000696390_100000210303 [0,2,0,0,0,0|2,0,0]=4 13142 B12R1.69 CCCOc1ccc(nc1I)Cl 7a_100000696390_100000210303 [0,2,0,0,0,0|2,0,0]=4 13143 B12R1.69 CCCOc1ccc(nc1I)F 34a_100010382442_100000210303 [0,2,0,0,0,0|2,0,0]=4 13144 B12R1.69 CCCOc1ccc(nc1I)F 7a_100010382442_100000210303 [0,2,0,0,0,0|2,0,0]=4 13145 B12R1.69 CCCOc1ccc(nc1N)Br 34a_100000685527_100000210303 [0,2,0,0,0,0|2,0,0]=4 13146 B12R1.69 CCCOc1ccc(nc1N)Br 7a_100000685527_100000210303 [0,2,0,0,0,0|2,0,0]=4 13147 B12R1.69 CCCOc1ccc(nc1N)C 34a_100000694039_100000210303 [0,2,0,0,0,0|2,0,0]=4 13148 B12R1.69 CCCOc1ccc(nc1N)C 7a_100000694039_100000210303 [0,2,0,0,0,0|2,0,0]=4 13149 B12R1.69 CCCOc1ccc(nc1N)Cl 34a_100000717809_100000210303 [0,2,0,0,0,0|2,0,0]=4 13150 B12R1.69 CCCOc1ccc(nc1N)Cl 7a_100000717809_100000210303 [0,2,0,0,0,0|2,0,0]=4 13151 B12R1.69 CCCOc1cnc(cc1Br)C 34a_100009843476_100000210303 [0,2,0,0,0,0|2,0,0]=4 13152 B12R1.69 CCCOc1cnc(cc1Br)C 7a_100009843476_100000210303 [0,2,0,0,0,0|2,0,0]=4 13153 B12R1.69 CCCOc1cnc(cc1C)C 34a_200000068632_100000210303 [0,2,0,0,0,0|2,0,0]=4 13154 B12R1.69 CCCOc1cnc(cc1C)C 7a_200000068632_100000210303 [0,2,0,0,0,0|2,0,0]=4 13155 B12R1.69 CCCOc1cnc(cc1C)Cl 34a_100000692680_100000210303 [0,2,0,0,0,0|2,0,0]=4 13156 B12R1.69 CCCOc1cnc(cc1C)Cl 7a_100000692680_100000210303 [0,2,0,0,0,0|2,0,0]=4 13157 B12R1.69 CCCOc1cnc(cc1C)F 34a_100009856773_100000210303 [0,2,0,0,0,0|2,0,0]=4 13158 B12R1.69 CCCOc1cnc(cc1C)F 7a_100009856773_100000210303 [0,2,0,0,0,0|2,0,0]=4 13159 B12R1.69 CCCOc1cnc(cc1Cl)Cl 34a_100009868576_100000210303 [0,2,0,0,0,0|2,0,0]=4 13160 B12R1.69 CCCOc1cnc(cc1Cl)Cl 7a_100009868576_100000210303 [0,2,0,0,0,0|2,0,0]=4 13161 B12R1.69 CCCOc1cnc(cc1F)F 34a_100009885687_100000210303 [0,2,0,0,0,0|2,0,0]=4 13162 B12R1.69 CCCOc1cnc(cc1F)F 7a_100009885687_100000210303 [0,2,0,0,0,0|2,0,0]=4 13163 B12R1.69 CCCOc1cnc(cc1I)Cl 34a_100000698892_100000210303 [0,2,0,0,0,0|2,0,0]=4 13164 B12R1.69 CCCOc1cnc(cc1I)Cl 7a_100000698892_100000210303 [0,2,0,0,0,0|2,0,0]=4 13165 B12R1.69 CCCOc1cnc(cc1N)Br 34a_100009819941_100000210303 [0,2,0,0,0,0|2,0,0]=4 13166 B12R1.69 CCCOc1cnc(cc1N)Br 7a_100009819941_100000210303 [0,2,0,0,0,0|2,0,0]=4 13167 B12R1.69 CCCOc1coc(cc1=O)C 34a_100000081520_100000210303 [0,2,0,0,0,0|1,0,1]=4 13168 B12R1.69 CCCOc1ncc(cc1Br)Br 34a_100000701035_100000210303 [0,2,0,0,0,0|2,0,0]=4 13169 B12R1.69 CCCOc1ncc(cc1Br)C 34a_100000719714_100000210303 [0,2,0,0,0,0|2,0,0]=4 13170 B12R1.69 CCCOc1ncc(cc1C)Br 34a_100000685391_100000210303 [0,2,0,0,0,0|2,0,0]=4 13171 B12R1.69 CCCOc1ncc(cc1C)O 271570a_203496583355_200012348856 [0,2,0,0,0,0|2,0,0]=4 13172 B12R1.69 CCCOc1ncc(cc1Cl)Br 34a_100012339560_100000210303 [0,2,0,0,0,0|2,0,0]=4 13173 B12R1.69 CCCOc1ncc(cc1Cl)F 34a_100009847679_100000210303 [0,2,0,0,0,0|2,0,0]=4 13174 B12R1.69 CCCOc1ncc(cc1F)Cl 34a_100011998252_100000210303 [0,2,0,0,0,0|2,0,0]=4 13175 B12R1.69 CCCOc1ncc(cc1F)F 34a_100012025737_100000210303 [0,2,0,0,0,0|2,0,0]=4 13176 B12R1.69 CCCOc1ncc(cc1N)Br 34a_100000743729_100000210303 [0,2,0,0,0,0|2,0,0]=4 13177 B12R1.69 CCCOc1ncc(cc1N)C 34a_100012000488_100000210303 [0,2,0,0,0,0|2,0,0]=4 13178 B12R1.69 CCCOc1ncc(cc1N)Cl 34a_100011998249_100000210303 [0,2,0,0,0,0|2,0,0]=4 13179 B12R1.69 CCCOc1ncc(cc1O)C 271570a_203496583355_100013847041 [0,2,0,0,0,0|1,0,0]=3 13180 B12R1.69 CCCSc1c[nH]c(=O)cc1F 62a_100000210303_100015631685 [0,2,0,0,0,0|2,0,0]=4 13181 B12R1.69 CCCSc1c[nH]c(=O)cc1F 62a_100015631685_100000210303 [0,2,0,0,0,0|2,0,0]=4 13182 B12R1.69 CCCSc1cc[n+](cc1C)[O-] 62a_100000210303_100000074940 [0,2,0,0,0,0|2,0,0]=4 13183 B12R1.69 CCCSc1ccc(=O)[nH]c1N 62a_100009884077_100000210303 [0,2,0,0,0,0|2,0,0]=4 13184 B12R1.69 CCCSc1ccc(c[n+]1[O-])C 62a_100000210303_100009819918 [0,2,0,0,0,0|1,0,1]=4 13185 B12R1.69 CCCSc1ccc(c[n+]1[O-])F 62a_100000210303_100009817261 [0,2,0,0,0,0|1,0,1]=4 13186 B12R1.69 CCCSc1ccc(c[n+]1[O-])F 62a_100009817261_100000210303 [0,2,0,0,0,0|1,0,1]=4 13187 B12R1.69 CCCSc1ccc(cc1Br)Br 62a_100000210303_100011484698 [0,2,0,0,0,0|1,0,0]=3 13188 B12R1.69 CCCSc1ccc(cc1Br)Br 62a_100011484698_100000210303 [0,2,0,0,0,0|1,0,0]=3 13189 B12R1.69 CCCSc1ccc(cc1Br)C 62a_100000210303_100009813563 [0,2,0,0,0,0|1,0,0]=3 13190 B12R1.69 CCCSc1ccc(cc1Br)C 62a_100009813563_100000210303 [0,2,0,0,0,0|1,0,0]=3 13191 B12R1.69 CCCSc1ccc(cc1Br)Cl 62a_100000210303_100011219703 [0,2,0,0,0,0|1,0,0]=3 13192 B12R1.69 CCCSc1ccc(cc1Br)Cl 62a_100011219703_100000210303 [0,2,0,0,0,0|1,0,0]=3 13193 B12R1.69 CCCSc1ccc(cc1Br)F 62a_100000210303_100011217111 [0,2,0,0,0,0|1,0,0]=3 13194 B12R1.69 CCCSc1ccc(cc1Br)F 62a_100011217111_100000210303 [0,2,0,0,0,0|1,0,0]=3 13195 B12R1.69 CCCSc1ccc(cc1Br)N 62a_100000210303_100000750458 [0,2,0,0,0,0|1,0,0]=3 13196 B12R1.69 CCCSc1ccc(cc1Br)N 62a_100000750458_100000210303 [0,2,0,0,0,0|1,0,0]=3 13197 B12R1.69 CCCSc1ccc(cc1Br)O 62a_100000210303_100000701344 [0,2,0,0,0,0|1,0,0]=3 13198 B12R1.69 CCCSc1ccc(cc1Br)O 62a_100000701344_100000210303 [0,2,0,0,0,0|1,0,0]=3 13199 B12R1.69 CCCSc1ccc(cc1C)Br 62a_100000210303_100000701812 [0,2,0,0,0,0|1,0,0]=3 13200 B12R1.69 CCCSc1ccc(cc1C)Br 62a_100000701812_100000210303 [0,2,0,0,0,0|1,0,0]=3 13201 B12R1.69 CCCSc1ccc(cc1C)C 62a_100000210303_100011217332 [0,2,0,0,0,0|1,0,0]=3 13202 B12R1.69 CCCSc1ccc(cc1C)C 62a_100011217332_100000210303 [0,2,0,0,0,0|1,0,0]=3 13203 B12R1.69 CCCSc1ccc(cc1C)Cl 62a_100000210303_100011219607 [0,2,0,0,0,0|1,0,0]=3 13204 B12R1.69 CCCSc1ccc(cc1C)Cl 62a_100011219607_100000210303 [0,2,0,0,0,0|1,0,0]=3 13205 B12R1.69 CCCSc1ccc(cc1C)F 62a_100000210303_100011205405 [0,2,0,0,0,0|1,0,0]=3 13206 B12R1.69 CCCSc1ccc(cc1C)F 62a_100011205405_100000210303 [0,2,0,0,0,0|1,0,0]=3 13207 B12R1.69 CCCSc1ccc(cc1C)N 62a_100000210303_100000210723 [0,2,0,0,0,0|1,0,0]=3 13208 B12R1.69 CCCSc1ccc(cc1C)N 62a_100000210723_100000210303 [0,2,0,0,0,0|1,0,0]=3 13209 B12R1.69 CCCSc1ccc(cc1C)O 62a_100000210303_100000690111 [0,2,0,0,0,0|1,0,0]=3 13210 B12R1.69 CCCSc1ccc(cc1Cl)Br 62a_100000210303_100011216062 [0,2,0,0,0,0|1,0,0]=3 13211 B12R1.69 CCCSc1ccc(cc1Cl)Br 62a_100011216062_100000210303 [0,2,0,0,0,0|1,0,0]=3 13212 B12R1.69 CCCSc1ccc(cc1Cl)C 62a_100000210303_100011263221 [0,2,0,0,0,0|1,0,0]=3 13213 B12R1.69 CCCSc1ccc(cc1Cl)C 62a_100011263221_100000210303 [0,2,0,0,0,0|1,0,0]=3 13214 B12R1.69 CCCSc1ccc(cc1Cl)Cl 62a_100000210303_100000699841 [0,2,0,0,0,0|1,0,0]=3 13215 B12R1.69 CCCSc1ccc(cc1Cl)Cl 62a_100000699841_100000210303 [0,2,0,0,0,0|1,0,0]=3 13216 B12R1.69 CCCSc1ccc(cc1Cl)F 62a_100000210303_100000733362 [0,2,0,0,0,0|1,0,0]=3 13217 B12R1.69 CCCSc1ccc(cc1Cl)F 62a_100000733362_100000210303 [0,2,0,0,0,0|1,0,0]=3 13218 B12R1.69 CCCSc1ccc(cc1Cl)N 62a_100000210303_100000761885 [0,2,0,0,0,0|1,0,0]=3 13219 B12R1.69 CCCSc1ccc(cc1Cl)N 62a_100000761885_100000210303 [0,2,0,0,0,0|1,0,0]=3 13220 B12R1.69 CCCSc1ccc(cc1Cl)O 62a_100000047559_100000210303 [0,2,0,0,0,0|1,0,0]=3 13221 B12R1.69 CCCSc1ccc(cc1Cl)O 62a_100000210303_100000047559 [0,2,0,0,0,0|1,0,0]=3 13222 B12R1.69 CCCSc1ccc(cc1F)Br 62a_100000210303_100009814013 [0,2,0,0,0,0|1,0,0]=3 13223 B12R1.69 CCCSc1ccc(cc1F)Br 62a_100009814013_100000210303 [0,2,0,0,0,0|1,0,0]=3 13224 B12R1.69 CCCSc1ccc(cc1F)C 62a_100000210303_100011216119 [0,2,0,0,0,0|1,0,0]=3 13225 B12R1.69 CCCSc1ccc(cc1F)C 62a_100011216119_100000210303 [0,2,0,0,0,0|1,0,0]=3 13226 B12R1.69 CCCSc1ccc(cc1F)Cl 62a_100000210303_100011216042 [0,2,0,0,0,0|1,0,0]=3 13227 B12R1.69 CCCSc1ccc(cc1F)Cl 62a_100011216042_100000210303 [0,2,0,0,0,0|1,0,0]=3 13228 B12R1.69 CCCSc1ccc(cc1F)F 62a_100000210303_100000750030 [0,2,0,0,0,0|1,0,0]=3 13229 B12R1.69 CCCSc1ccc(cc1F)F 62a_100000750030_100000210303 [0,2,0,0,0,0|1,0,0]=3 13230 B12R1.69 CCCSc1ccc(cc1F)N 62a_100000210303_100011356925 [0,2,0,0,0,0|1,0,0]=3 13231 B12R1.69 CCCSc1ccc(cc1F)N 62a_100011356925_100000210303 [0,2,0,0,0,0|1,0,0]=3 13232 B12R1.69 CCCSc1ccc(cc1F)O 62a_100000210303_100000755031 [0,2,0,0,0,0|1,0,0]=3 13233 B12R1.69 CCCSc1ccc(cc1F)O 62a_100000755031_100000210303 [0,2,0,0,0,0|1,0,0]=3 13234 B12R1.69 CCCSc1ccc(cc1N)Br 62a_100000210303_100000743836 [0,2,0,0,0,0|1,0,0]=3 13235 B12R1.69 CCCSc1ccc(cc1N)Br 62a_100000743836_100000210303 [0,2,0,0,0,0|1,0,0]=3 13236 B12R1.69 CCCSc1ccc(cc1N)C 62a_100000210303_100011216686 [0,2,0,0,0,0|1,0,0]=3 13237 B12R1.69 CCCSc1ccc(cc1N)C 62a_100011216686_100000210303 [0,2,0,0,0,0|1,0,0]=3 13238 B12R1.69 CCCSc1ccc(cc1N)Cl 62a_100000210303_100000761886 [0,2,0,0,0,0|1,0,0]=3 13239 B12R1.69 CCCSc1ccc(cc1N)Cl 62a_100000761886_100000210303 [0,2,0,0,0,0|1,0,0]=3 13240 B12R1.69 CCCSc1ccc(cc1N)F 62a_100000210303_100000687223 [0,2,0,0,0,0|1,0,0]=3 13241 B12R1.69 CCCSc1ccc(cc1N)F 62a_100000687223_100000210303 [0,2,0,0,0,0|1,0,0]=3 13242 B12R1.69 CCCSc1ccc(cc1N)N 62a_100000210303_200012175722 [0,2,0,0,0,0|1,0,0]=3 13243 B12R1.69 CCCSc1ccc(cc1N)N 62a_200012175722_100000210303 [0,2,0,0,0,0|1,0,0]=3 13244 B12R1.69 CCCSc1ccc(cc1N)O 62a_100000210303_100011999798 [0,2,0,0,0,0|1,0,0]=3 13245 B12R1.69 CCCSc1ccc(cc1N)O 62a_100011999798_100000210303 [0,2,0,0,0,0|1,0,0]=3 13246 B12R1.69 CCCSc1ccc(cc1O)Br 62a_100000210303_100012344904 [0,2,0,0,0,0|0,0,0]=2 13247 B12R1.69 CCCSc1ccc(cc1O)Br 62a_100012344904_100000210303 [0,2,0,0,0,0|0,0,0]=2 13248 B12R1.69 CCCSc1ccc(cc1O)C 62a_100000210303_100012002257 [0,2,0,0,0,0|0,0,0]=2 13249 B12R1.69 CCCSc1ccc(cc1O)C 62a_100012002257_100000210303 [0,2,0,0,0,0|0,0,0]=2 13250 B12R1.69 CCCSc1ccc(cc1O)Cl 62a_100000050036_100000210303 [0,2,0,0,0,0|0,0,0]=2 13251 B12R1.69 CCCSc1ccc(cc1O)Cl 62a_100000210303_100000050036 [0,2,0,0,0,0|0,0,0]=2 13252 B12R1.69 CCCSc1ccc(cc1O)F 62a_100000210303_100000690578 [0,2,0,0,0,0|0,0,0]=2 13253 B12R1.69 CCCSc1ccc(cc1O)F 62a_100000690578_100000210303 [0,2,0,0,0,0|0,0,0]=2 13254 B12R1.69 CCCSc1ccc(cc1O)O 62a_100000210303_100009813921 [0,2,0,0,0,0|0,0,0]=2 13255 B12R1.69 CCCSc1ccc(nc1Br)N 62a_100000210303_100010734177 [0,2,0,0,0,0|2,0,0]=4 13256 B12R1.69 CCCSc1ccc(nc1Br)N 62a_100010734177_100000210303 [0,2,0,0,0,0|2,0,0]=4 13257 B12R1.69 CCCSc1ccc(nc1C)C 62a_100000210303_100009813853 [0,2,0,0,0,0|2,0,0]=4 13258 B12R1.69 CCCSc1ccc(nc1C)C 62a_100009813853_100000210303 [0,2,0,0,0,0|2,0,0]=4 13259 B12R1.69 CCCSc1ccc(nc1C)Cl 62a_100000062408_100000210303 [0,2,0,0,0,0|2,0,0]=4 13260 B12R1.69 CCCSc1ccc(nc1C)Cl 62a_100000210303_100000062408 [0,2,0,0,0,0|2,0,0]=4 13261 B12R1.69 CCCSc1ccc(nc1C)F 62a_100000210303_100000688911 [0,2,0,0,0,0|2,0,0]=4 13262 B12R1.69 CCCSc1ccc(nc1C)F 62a_100000688911_100000210303 [0,2,0,0,0,0|2,0,0]=4 13263 B12R1.69 CCCSc1ccc(nc1C)N 62a_100000187202_100000210303 [0,2,0,0,0,0|2,0,0]=4 13264 B12R1.69 CCCSc1ccc(nc1C)N 62a_100000210303_100000187202 [0,2,0,0,0,0|2,0,0]=4 13265 B12R1.69 CCCSc1ccc(nc1C)O 62a_100000210303_100000691680 [0,2,0,0,0,0|2,0,0]=4 13266 B12R1.69 CCCSc1ccc(nc1C)O 62a_100000691680_100000210303 [0,2,0,0,0,0|2,0,0]=4 13267 B12R1.69 CCCSc1ccc(nc1Cl)Br 62a_100000210303_100010246183 [0,2,0,0,0,0|2,0,0]=4 13268 B12R1.69 CCCSc1ccc(nc1Cl)Br 62a_100010246183_100000210303 [0,2,0,0,0,0|2,0,0]=4 13269 B12R1.69 CCCSc1ccc(nc1Cl)Cl 62a_100000210303_100000043682 [0,2,0,0,0,0|2,0,0]=4 13270 B12R1.69 CCCSc1ccc(nc1Cl)N 62a_100000210303_100010270343 [0,2,0,0,0,0|2,0,0]=4 13271 B12R1.69 CCCSc1ccc(nc1Cl)N 62a_100010270343_100000210303 [0,2,0,0,0,0|2,0,0]=4 13272 B12R1.69 CCCSc1ccc(nc1F)C 62a_100000210303_100010006597 [0,2,0,0,0,0|2,0,0]=4 13273 B12R1.69 CCCSc1ccc(nc1F)C 62a_100010006597_100000210303 [0,2,0,0,0,0|2,0,0]=4 13274 B12R1.69 CCCSc1ccc(nc1F)Cl 62a_100000210303_100010168078 [0,2,0,0,0,0|2,0,0]=4 13275 B12R1.69 CCCSc1ccc(nc1F)Cl 62a_100010168078_100000210303 [0,2,0,0,0,0|2,0,0]=4 13276 B12R1.69 CCCSc1ccc(nc1F)F 62a_100000070099_100000210303 [0,2,0,0,0,0|2,0,0]=4 13277 B12R1.69 CCCSc1ccc(nc1F)F 62a_100000210303_100000070099 [0,2,0,0,0,0|2,0,0]=4 13278 B12R1.69 CCCSc1ccc(nc1F)N 62a_100000210303_100009882772 [0,2,0,0,0,0|2,0,0]=4 13279 B12R1.69 CCCSc1ccc(nc1F)N 62a_100009882772_100000210303 [0,2,0,0,0,0|2,0,0]=4 13280 B12R1.69 CCCSc1ccc(nc1F)O 62a_100000210303_100009879308 [0,2,0,0,0,0|2,0,0]=4 13281 B12R1.69 CCCSc1ccc(nc1F)O 62a_100009879308_100000210303 [0,2,0,0,0,0|2,0,0]=4 13282 B12R1.69 CCCSc1ccc(nc1N)C 62a_100000210303_100009816662 [0,2,0,0,0,0|2,0,0]=4 13283 B12R1.69 CCCSc1ccc(nc1N)C 62a_100009816662_100000210303 [0,2,0,0,0,0|2,0,0]=4 13284 B12R1.69 CCCSc1ccc(nc1N)Cl 62a_100000210303_100010171640 [0,2,0,0,0,0|2,0,0]=4 13285 B12R1.69 CCCSc1ccc(nc1N)Cl 62a_100010171640_100000210303 [0,2,0,0,0,0|2,0,0]=4 13286 B12R1.69 CCCSc1ccc(nc1N)F 62a_100000210303_100009854977 [0,2,0,0,0,0|2,0,0]=4 13287 B12R1.69 CCCSc1ccc(nc1N)F 62a_100009854977_100000210303 [0,2,0,0,0,0|2,0,0]=4 13288 B12R1.69 CCCSc1ccc(nc1N)N 62a_100011356871_100000210303 [0,2,0,0,0,0|2,0,0]=4 13289 B12R1.69 CCCSc1ccc(nc1O)C 62a_100000210303_100009817604 [0,2,0,0,0,0|1,0,0]=3 13290 B12R1.69 CCCSc1ccc(nc1O)C 62a_100009817604_100000210303 [0,2,0,0,0,0|1,0,0]=3 13291 B12R1.69 CCCSc1cnc(cc1Br)F 62a_100000210303_100015451857 [0,2,0,0,0,0|2,0,0]=4 13292 B12R1.69 CCCSc1cnc(cc1Br)F 62a_100015451857_100000210303 [0,2,0,0,0,0|2,0,0]=4 13293 B12R1.69 CCCSc1cnc(cc1Br)N 62a_100000210303_100010074611 [0,2,0,0,0,0|2,0,0]=4 13294 B12R1.69 CCCSc1cnc(cc1Br)N 62a_100010074611_100000210303 [0,2,0,0,0,0|2,0,0]=4 13295 B12R1.69 CCCSc1cnc(cc1C)Br 62a_100000210303_100009816104 [0,2,0,0,0,0|2,0,0]=4 13296 B12R1.69 CCCSc1cnc(cc1C)Br 62a_100009816104_100000210303 [0,2,0,0,0,0|2,0,0]=4 13297 B12R1.69 CCCSc1cnc(cc1C)C 62a_100000210303_100009819613 [0,2,0,0,0,0|2,0,0]=4 13298 B12R1.69 CCCSc1cnc(cc1C)C 62a_100009819613_100000210303 [0,2,0,0,0,0|2,0,0]=4 13299 B12R1.69 CCCSc1cnc(cc1C)Cl 62a_100000210303_100010172789 [0,2,0,0,0,0|2,0,0]=4 13300 B12R1.69 CCCSc1cnc(cc1C)Cl 62a_100010172789_100000210303 [0,2,0,0,0,0|2,0,0]=4 13301 B12R1.69 CCCSc1cnc(cc1C)F 62a_100000210303_100009820716 [0,2,0,0,0,0|2,0,0]=4 13302 B12R1.69 CCCSc1cnc(cc1C)F 62a_100009820716_100000210303 [0,2,0,0,0,0|2,0,0]=4 13303 B12R1.69 CCCSc1cnc(cc1C)N 62a_100000050067_100000210303 [0,2,0,0,0,0|2,0,0]=4 13304 B12R1.69 CCCSc1cnc(cc1C)N 62a_100000210303_100000050067 [0,2,0,0,0,0|2,0,0]=4 13305 B12R1.69 CCCSc1cnc(cc1C)O 62a_100000210303_100000766222 [0,2,0,0,0,0|2,0,0]=4 13306 B12R1.69 CCCSc1cnc(cc1C)O 62a_100000766222_100000210303 [0,2,0,0,0,0|2,0,0]=4 13307 B12R1.69 CCCSc1cnc(cc1Cl)Br 62a_100000210303_100010381092 [0,2,0,0,0,0|2,0,0]=4 13308 B12R1.69 CCCSc1cnc(cc1Cl)Br 62a_100010381092_100000210303 [0,2,0,0,0,0|2,0,0]=4 13309 B12R1.69 CCCSc1cnc(cc1Cl)Cl 62a_100000210303_100010200927 [0,2,0,0,0,0|2,0,0]=4 13310 B12R1.69 CCCSc1cnc(cc1Cl)Cl 62a_100010200927_100000210303 [0,2,0,0,0,0|2,0,0]=4 13311 B12R1.69 CCCSc1cnc(cc1Cl)N 62a_100000210303_100000694920 [0,2,0,0,0,0|2,0,0]=4 13312 B12R1.69 CCCSc1cnc(cc1Cl)N 62a_100000694920_100000210303 [0,2,0,0,0,0|2,0,0]=4 13313 B12R1.69 CCCSc1cnc(cc1F)Cl 62a_100000210303_100010128100 [0,2,0,0,0,0|2,0,0]=4 13314 B12R1.69 CCCSc1cnc(cc1F)Cl 62a_100010128100_100000210303 [0,2,0,0,0,0|2,0,0]=4 13315 B12R1.69 CCCSc1cnc(cc1F)N 62a_100000210303_100009844730 [0,2,0,0,0,0|2,0,0]=4 13316 B12R1.69 CCCSc1cnc(cc1F)N 62a_100009844730_100000210303 [0,2,0,0,0,0|2,0,0]=4 13317 B12R1.69 CCCSc1cnc(cc1N)C 62a_100000210303_100009817891 [0,2,0,0,0,0|2,0,0]=4 13318 B12R1.69 CCCSc1cnc(cc1N)C 62a_100009817891_100000210303 [0,2,0,0,0,0|2,0,0]=4 13319 B12R1.69 CCCSc1cnc(cc1N)Cl 62a_100000210303_100010209552 [0,2,0,0,0,0|2,0,0]=4 13320 B12R1.69 CCCSc1cnc(cc1N)Cl 62a_100010209552_100000210303 [0,2,0,0,0,0|2,0,0]=4 13321 B12R1.69 CCCSc1cnc(cc1N)N 62a_100000210303_200009857908 [0,2,0,0,0,0|2,0,0]=4 13322 B12R1.69 CCCSc1cnc(cc1N)N 62a_200009857908_100000210303 [0,2,0,0,0,0|2,0,0]=4 13323 B12R1.69 CCCSc1cnc(cc1O)C 62a_100000210303_100011016184 [0,2,0,0,0,0|1,0,0]=3 13324 B12R1.69 CCCSc1cnc(cc1O)C 62a_100011016184_100000210303 [0,2,0,0,0,0|1,0,0]=3 13325 B12R1.69 CCCSc1ncc(cc1Br)Cl 62a_100000210303_100012154958 [0,2,0,0,0,0|2,0,0]=4 13326 B12R1.69 CCCSc1ncc(cc1Br)Cl 62a_100012154958_100000210303 [0,2,0,0,0,0|2,0,0]=4 13327 B12R1.69 CCCSc1ncc(cc1C)Br 62a_100000210303_100012353652 [0,2,0,0,0,0|2,0,0]=4 13328 B12R1.69 CCCSc1ncc(cc1C)Br 62a_100012353652_100000210303 [0,2,0,0,0,0|2,0,0]=4 13329 B12R1.69 CCCSc1ncc(cc1C)C 62a_100000210303_100009864548 [0,2,0,0,0,0|2,0,0]=4 13330 B12R1.69 CCCSc1ncc(cc1C)C 62a_100009864548_100000210303 [0,2,0,0,0,0|2,0,0]=4 13331 B12R1.69 CCCSc1ncc(cc1C)F 62a_100000210303_100009817009 [0,2,0,0,0,0|2,0,0]=4 13332 B12R1.69 CCCSc1ncc(cc1C)F 62a_100009817009_100000210303 [0,2,0,0,0,0|2,0,0]=4 13333 B12R1.69 CCCSc1ncc(cc1C)N 62a_100000210303_100000761747 [0,2,0,0,0,0|2,0,0]=4 13334 B12R1.69 CCCSc1ncc(cc1C)N 62a_100000761747_100000210303 [0,2,0,0,0,0|2,0,0]=4 13335 B12R1.69 CCCSc1ncc(cc1C)O 62a_100000210303_100012000486 [0,2,0,0,0,0|2,0,0]=4 13336 B12R1.69 CCCSc1ncc(cc1C)O 62a_100012000486_100000210303 [0,2,0,0,0,0|2,0,0]=4 13337 B12R1.69 CCCSc1ncc(cc1F)Br 62a_100000210303_100012348576 [0,2,0,0,0,0|2,0,0]=4 13338 B12R1.69 CCCSc1ncc(cc1F)Br 62a_100012348576_100000210303 [0,2,0,0,0,0|2,0,0]=4 13339 B12R1.69 CCCSc1ncc(cc1F)C 62a_100000210303_100009819633 [0,2,0,0,0,0|2,0,0]=4 13340 B12R1.69 CCCSc1ncc(cc1F)C 62a_100009819633_100000210303 [0,2,0,0,0,0|2,0,0]=4 13341 B12R1.69 CCCSc1ncc(cc1F)Cl 62a_100000210303_100012348686 [0,2,0,0,0,0|2,0,0]=4 13342 B12R1.69 CCCSc1ncc(cc1F)Cl 62a_100012348686_100000210303 [0,2,0,0,0,0|2,0,0]=4 13343 B12R1.69 CCCSc1ncc(cc1F)F 62a_100000210303_100011219543 [0,2,0,0,0,0|2,0,0]=4 13344 B12R1.69 CCCSc1ncc(cc1F)F 62a_100011219543_100000210303 [0,2,0,0,0,0|2,0,0]=4 13345 B12R1.69 CCCSc1ncc(cc1F)N 62a_100000210303_100010280766 [0,2,0,0,0,0|2,0,0]=4 13346 B12R1.69 CCCSc1ncc(cc1F)N 62a_100010280766_100000210303 [0,2,0,0,0,0|2,0,0]=4 13347 B12R1.69 CCCSc1ncc(cc1F)O 62a_100000210303_100000063512 [0,2,0,0,0,0|2,0,0]=4 13348 B12R1.69 CCCSc1ncc(cc1N)Br 62a_100000210303_100010090555 [0,2,0,0,0,0|2,0,0]=4 13349 B12R1.69 CCCSc1ncc(cc1N)Br 62a_100010090555_100000210303 [0,2,0,0,0,0|2,0,0]=4 13350 B12R1.69 CCCSc1ncc(cc1N)C 62a_100000210303_100000733613 [0,2,0,0,0,0|2,0,0]=4 13351 B12R1.69 CCCSc1ncc(cc1N)C 62a_100000733613_100000210303 [0,2,0,0,0,0|2,0,0]=4 13352 B12R1.69 CCCSc1ncc(cc1N)F 62a_100000210303_100009817643 [0,2,0,0,0,0|2,0,0]=4 13353 B12R1.69 CCCSc1ncc(cc1N)F 62a_100009817643_100000210303 [0,2,0,0,0,0|2,0,0]=4 13354 B12R1.69 CCCSc1ncc(cc1N)N 62a_100000210303_200000093520 [0,2,0,0,0,0|2,0,0]=4 13355 B12R1.69 CCCSc1ncc(cc1N)N 62a_200000093520_100000210303 [0,2,0,0,0,0|2,0,0]=4 13356 B12R1.69 CCCSc1ncc(cc1O)Br 62a_100000210303_100010210634 [0,2,0,0,0,0|1,0,0]=3 13357 B12R1.69 CCCSc1ncc(cc1O)Br 62a_100010210634_100000210303 [0,2,0,0,0,0|1,0,0]=3 13358 B12R1.69 CCCSc1ncc(cc1O)C 62a_100000210303_100012000487 [0,2,0,0,0,0|1,0,0]=3 13359 B12R1.69 CCCSc1ncc(cc1O)Cl 62a_100000210303_100010233512 [0,2,0,0,0,0|1,0,0]=3 13360 B12R1.69 CCCSc1ncc(cc1O)Cl 62a_100010233512_100000210303 [0,2,0,0,0,0|1,0,0]=3 13361 B12R1.69 CCCSc1ncc(cc1O)F 62a_100000210303_100000079967 [0,2,0,0,0,0|1,0,0]=3 13362 B12R1.69 CCCSc1ncc(cc1O)F 62a_100009820119_100000210303 [0,2,0,0,0,0|1,0,0]=3 13363 B12R1.69 CCNCc1ccc(cc1Br)Br 207a_100015525214_100012351556 [0,2,0,0,0,0|1,0,0]=3 13364 B12R1.69 CCNCc1ccc(cc1Br)Br 2230a_100015525214_200012351560 [0,2,0,0,0,0|1,0,0]=3 13365 B12R1.69 CCNCc1ccc(cc1Br)Br 270004a_100015525214_100012351556 [0,2,0,0,0,0|1,0,0]=3 13366 B12R1.69 CCNCc1ccc(cc1Br)C 207a_100015525214_100000692596 [0,2,0,0,0,0|1,0,0]=3 13367 B12R1.69 CCNCc1ccc(cc1Br)C 270004a_100015525214_100000692596 [0,2,0,0,0,0|1,0,0]=3 13368 B12R1.69 CCNCc1ccc(cc1Br)Cl 207a_100015525214_100000687667 [0,2,0,0,0,0|1,0,0]=3 13369 B12R1.69 CCNCc1ccc(cc1Br)Cl 2230a_100015525214_100000755608 [0,2,0,0,0,0|1,0,0]=3 13370 B12R1.69 CCNCc1ccc(cc1Br)Cl 270004a_100015525214_100000687667 [0,2,0,0,0,0|1,0,0]=3 13371 B12R1.69 CCNCc1ccc(cc1Br)Cl 34a_100102692131_100000210202 [0,2,0,0,0,0|1,0,0]=3 13372 B12R1.69 CCNCc1ccc(cc1Br)F 207a_100015525214_100000685661 [0,2,0,0,0,0|1,0,0]=3 13373 B12R1.69 CCNCc1ccc(cc1Br)F 2230a_100015525214_100000243222 [0,2,0,0,0,0|1,0,0]=3 13374 B12R1.69 CCNCc1ccc(cc1Br)F 270004a_100015525214_100000685661 [0,2,0,0,0,0|1,0,0]=3 13375 B12R1.69 CCNCc1ccc(cc1Br)F 34a_100000708791_100000210202 [0,2,0,0,0,0|1,0,0]=3 13376 B12R1.69 CCNCc1ccc(cc1Br)I 207a_100015525214_100010185650 [0,2,0,0,0,0|1,0,0]=3 13377 B12R1.69 CCNCc1ccc(cc1Br)I 2230a_100015525214_100010146610 [0,2,0,0,0,0|1,0,0]=3 13378 B12R1.69 CCNCc1ccc(cc1C)Br 207a_100015525214_100000687586 [0,2,0,0,0,0|1,0,0]=3 13379 B12R1.69 CCNCc1ccc(cc1C)Br 2230a_100015525214_100000708836 [0,2,0,0,0,0|1,0,0]=3 13380 B12R1.69 CCNCc1ccc(cc1C)Br 270004a_100015525214_100000687586 [0,2,0,0,0,0|1,0,0]=3 13381 B12R1.69 CCNCc1ccc(cc1C)Br 34a_100000753881_100000210202 [0,2,0,0,0,0|1,0,0]=3 13382 B12R1.69 CCNCc1ccc(cc1C)C 207a_100015525214_100000211342 [0,2,0,0,0,0|1,0,0]=3 13383 B12R1.69 CCNCc1ccc(cc1C)C 2230a_100015525214_100011219618 [0,2,0,0,0,0|1,0,0]=3 13384 B12R1.69 CCNCc1ccc(cc1C)C 270004a_100015525214_100000211342 [0,2,0,0,0,0|1,0,0]=3 13385 B12R1.69 CCNCc1ccc(cc1C)C 34a_100000737523_100000210202 [0,2,0,0,0,0|1,0,0]=3 13386 B12R1.69 CCNCc1ccc(cc1C)Cl 207a_100015525214_100000766358 [0,2,0,0,0,0|1,0,0]=3 13387 B12R1.69 CCNCc1ccc(cc1C)Cl 2230a_100015525214_100012361307 [0,2,0,0,0,0|1,0,0]=3 13388 B12R1.69 CCNCc1ccc(cc1C)Cl 270004a_100015525214_100000766358 [0,2,0,0,0,0|1,0,0]=3 13389 B12R1.69 CCNCc1ccc(cc1C)Cl 34a_103436540063_100000210202 [0,2,0,0,0,0|1,0,0]=3 13390 B12R1.69 CCNCc1ccc(cc1C)F 207a_100015525214_100000745986 [0,2,0,0,0,0|1,0,0]=3 13391 B12R1.69 CCNCc1ccc(cc1C)F 2230a_100015525214_100000700533 [0,2,0,0,0,0|1,0,0]=3 13392 B12R1.69 CCNCc1ccc(cc1C)F 270004a_100015525214_100000745986 [0,2,0,0,0,0|1,0,0]=3 13393 B12R1.69 CCNCc1ccc(cc1C)F 34a_100137329023_100000210202 [0,2,0,0,0,0|1,0,0]=3 13394 B12R1.69 CCNCc1ccc(cc1Cl)Br 207a_100015525214_100000764164 [0,2,0,0,0,0|1,0,0]=3 13395 B12R1.69 CCNCc1ccc(cc1Cl)Br 2230a_100015525214_100011740631 [0,2,0,0,0,0|1,0,0]=3 13396 B12R1.69 CCNCc1ccc(cc1Cl)Br 270004a_100015525214_100000764164 [0,2,0,0,0,0|1,0,0]=3 13397 B12R1.69 CCNCc1ccc(cc1Cl)Br 34a_100020628970_100000210202 [0,2,0,0,0,0|1,0,0]=3 13398 B12R1.69 CCNCc1ccc(cc1Cl)C 207a_100015525214_100011935181 [0,2,0,0,0,0|1,0,0]=3 13399 B12R1.69 CCNCc1ccc(cc1Cl)C 2230a_100015525214_100012349684 [0,2,0,0,0,0|1,0,0]=3 13400 B12R1.69 CCNCc1ccc(cc1Cl)C 270004a_100015525214_100011935181 [0,2,0,0,0,0|1,0,0]=3 13401 B12R1.69 CCNCc1ccc(cc1Cl)C 34a_100011997539_100000210202 [0,2,0,0,0,0|1,0,0]=3 13402 B12R1.69 CCNCc1ccc(cc1Cl)Cl 207a_100015525214_100000188887 [0,2,0,0,0,0|1,0,0]=3 13403 B12R1.69 CCNCc1ccc(cc1Cl)Cl 2230a_100015525214_100000188473 [0,2,0,0,0,0|1,0,0]=3 13404 B12R1.69 CCNCc1ccc(cc1Cl)Cl 270004a_100015525214_100000188887 [0,2,0,0,0,0|1,0,0]=3 13405 B12R1.69 CCNCc1ccc(cc1Cl)Cl 34a_100000174880_100000210202 [0,2,0,0,0,0|1,0,0]=3 13406 B12R1.69 CCNCc1ccc(cc1Cl)F 207a_100015525214_100000752949 [0,2,0,0,0,0|1,0,0]=3 13407 B12R1.69 CCNCc1ccc(cc1Cl)F 2230a_100015525214_100011216360 [0,2,0,0,0,0|1,0,0]=3 13408 B12R1.69 CCNCc1ccc(cc1Cl)F 270004a_100015525214_100000752949 [0,2,0,0,0,0|1,0,0]=3 13409 B12R1.69 CCNCc1ccc(cc1Cl)F 34a_100000174946_100000210202 [0,2,0,0,0,0|1,0,0]=3 13410 B12R1.69 CCNCc1ccc(cc1Cl)I 207a_100015525214_100000727542 [0,2,0,0,0,0|1,0,0]=3 13411 B12R1.69 CCNCc1ccc(cc1Cl)O 34a_200161156549_100000210202 [0,2,0,0,0,0|1,0,0]=3 13412 B12R1.69 CCNCc1ccc(cc1F)Br 207a_100015525214_100000211676 [0,2,0,0,0,0|1,0,0]=3 13413 B12R1.69 CCNCc1ccc(cc1F)Br 2230a_100015525214_100000211606 [0,2,0,0,0,0|1,0,0]=3 13414 B12R1.69 CCNCc1ccc(cc1F)Br 270004a_100015525214_100000211676 [0,2,0,0,0,0|1,0,0]=3 13415 B12R1.69 CCNCc1ccc(cc1F)Br 34a_100000754580_100000210202 [0,2,0,0,0,0|1,0,0]=3 13416 B12R1.69 CCNCc1ccc(cc1F)C 207a_100015525214_100011217368 [0,2,0,0,0,0|1,0,0]=3 13417 B12R1.69 CCNCc1ccc(cc1F)C 2230a_100015525214_100011217900 [0,2,0,0,0,0|1,0,0]=3 13418 B12R1.69 CCNCc1ccc(cc1F)C 270004a_100015525214_100011217368 [0,2,0,0,0,0|1,0,0]=3 13419 B12R1.69 CCNCc1ccc(cc1F)C 34a_100102887089_100000210202 [0,2,0,0,0,0|1,0,0]=3 13420 B12R1.69 CCNCc1ccc(cc1F)Cl 207a_100015525214_100000697372 [0,2,0,0,0,0|1,0,0]=3 13421 B12R1.69 CCNCc1ccc(cc1F)Cl 2230a_100015525214_100000709361 [0,2,0,0,0,0|1,0,0]=3 13422 B12R1.69 CCNCc1ccc(cc1F)Cl 270004a_100015525214_100000697372 [0,2,0,0,0,0|1,0,0]=3 13423 B12R1.69 CCNCc1ccc(cc1F)Cl 34a_100000708496_100000210202 [0,2,0,0,0,0|1,0,0]=3 13424 B12R1.69 CCNCc1ccc(cc1F)F 207a_100015525214_100000211964 [0,2,0,0,0,0|1,0,0]=3 13425 B12R1.69 CCNCc1ccc(cc1F)F 2230a_100015525214_100000748237 [0,2,0,0,0,0|1,0,0]=3 13426 B12R1.69 CCNCc1ccc(cc1F)F 270004a_100015525214_100000211964 [0,2,0,0,0,0|1,0,0]=3 13427 B12R1.69 CCNCc1ccc(cc1F)F 34a_100000737868_100000210202 [0,2,0,0,0,0|1,0,0]=3 13428 B12R1.69 CCNCc1ccc(cc1F)I 207a_100015525214_100000050965 [0,2,0,0,0,0|1,0,0]=3 13429 B12R1.69 CCNCc1ccc(cc1F)I 2230a_100015525214_100010244991 [0,2,0,0,0,0|1,0,0]=3 13430 B12R1.69 CCNCc1ccc(cc1I)Br 207a_100015525214_100010146562 [0,2,0,0,0,0|1,0,0]=3 13431 B12R1.69 CCNCc1ccc(cc1I)Br 2230a_100015525214_100010146615 [0,2,0,0,0,0|1,0,0]=3 13432 B12R1.69 CCNCc1ccc(cc1I)Br 270004a_100015525214_100010146562 [0,2,0,0,0,0|1,0,0]=3 13433 B12R1.69 CCNCc1ccc(cc1I)C 207a_100015525214_100010150104 [0,2,0,0,0,0|1,0,0]=3 13434 B12R1.69 CCNCc1ccc(cc1I)C 270004a_100015525214_100010150104 [0,2,0,0,0,0|1,0,0]=3 13435 B12R1.69 CCNCc1ccc(cc1I)Cl 2230a_100015525214_100010254388 [0,2,0,0,0,0|1,0,0]=3 13436 B12R1.69 CCNCc1ccc(cc1I)F 207a_100015525214_100010254405 [0,2,0,0,0,0|1,0,0]=3 13437 B12R1.69 CCNCc1ccc(cc1I)F 2230a_100015525214_100012354799 [0,2,0,0,0,0|1,0,0]=3 13438 B12R1.69 CCNCc1ccc(nc1Br)C 2230a_100015525214_200010064658 [0,2,0,0,0,0|2,0,0]=4 13439 B12R1.69 CCNCc1ccc(nc1C)C 207a_100015525214_100011794427 [0,2,0,0,0,0|2,0,0]=4 13440 B12R1.69 CCNCc1ccc(nc1C)C 270004a_100015525214_100011794427 [0,2,0,0,0,0|2,0,0]=4 13441 B12R1.69 CCNCc1ccc(nc1Cl)Cl 2230a_100015525214_100000722033 [0,2,0,0,0,0|2,0,0]=4 13442 B12R1.69 CCNCc1cnc(cc1Br)Cl 270004a_100015525214_100009892795 [0,2,0,0,0,0|2,0,0]=4 13443 B12R1.69 CCNCc1cnc(cc1C)C 207a_100015525214_200009869383 [0,2,0,0,0,0|2,0,0]=4 13444 B12R1.69 CCNCc1cnc(cc1C)C 270004a_100015525214_200009869383 [0,2,0,0,0,0|2,0,0]=4 13445 B12R1.69 CCNCc1cnc(cc1C)F 2230a_100015525214_100010382440 [0,2,0,0,0,0|2,0,0]=4 13446 B12R1.69 CCNCc1cnc(cc1Cl)Cl 2230a_100015525214_100011997056 [0,2,0,0,0,0|2,0,0]=4 13447 B12R1.69 CCNCc1ncc(cc1Br)Br 207a_100015525214_100000688198 [0,2,0,0,0,0|2,0,0]=4 13448 B12R1.69 CCNCc1ncc(cc1Br)Br 270004a_100015525214_100000688198 [0,2,0,0,0,0|2,0,0]=4 13449 B12R1.69 CCNCc1ncc(cc1Br)Cl 207a_100015525214_100010064872 [0,2,0,0,0,0|2,0,0]=4 13450 B12R1.69 CCNCc1ncc(cc1Br)Cl 270004a_100015525214_100010064872 [0,2,0,0,0,0|2,0,0]=4 13451 B12R1.69 CCNCc1ncc(cc1C)Br 207a_100015525214_100010185443 [0,2,0,0,0,0|2,0,0]=4 13452 B12R1.69 CCNCc1ncc(cc1C)Br 270004a_100015525214_100010185443 [0,2,0,0,0,0|2,0,0]=4 13453 B12R1.69 CCNCc1ncc(cc1C)C 2230a_100015525214_100016990036 [0,2,0,0,0,0|2,0,0]=4 13454 B12R1.69 CCNCc1ncc(cc1C)Cl 207a_100015525214_200009887756 [0,2,0,0,0,0|2,0,0]=4 13455 B12R1.69 CCNCc1ncc(cc1C)Cl 270004a_100015525214_200009887756 [0,2,0,0,0,0|2,0,0]=4 13456 B12R1.69 CCNCc1ncc(cc1Cl)Br 207a_100015525214_100009814801 [0,2,0,0,0,0|2,0,0]=4 13457 B12R1.69 CCNCc1ncc(cc1Cl)Br 270004a_100015525214_100009814801 [0,2,0,0,0,0|2,0,0]=4 13458 B12R1.69 CCNCc1ncc(cc1Cl)Br 34a_100025703182_100000210202 [0,2,0,0,0,0|2,0,0]=4 13459 B12R1.69 CCNCc1ncc(cc1Cl)Cl 207a_100015525214_100011361609 [0,2,0,0,0,0|2,0,0]=4 13460 B12R1.69 CCNCc1ncc(cc1Cl)Cl 270004a_100015525214_100011361609 [0,2,0,0,0,0|2,0,0]=4 13461 B12R1.69 CCNCc1ncc(cc1Cl)F 34a_100020639648_100000210202 [0,2,0,0,0,0|2,0,0]=4 13462 B12R1.69 CCNCc1ncc(cc1F)Br 207a_100015525214_100010180630 [0,2,0,0,0,0|2,0,0]=4 13463 B12R1.69 CCNCc1ncc(cc1F)Br 270004a_100015525214_100010180630 [0,2,0,0,0,0|2,0,0]=4 13464 B12R1.69 CCNCc1ncc(cc1F)Br 34a_100015188786_100000210202 [0,2,0,0,0,0|2,0,0]=4 13465 B12R1.69 CCNCc1ncc(cc1F)C 207a_100015525214_100009845184 [0,2,0,0,0,0|2,0,0]=4 13466 B12R1.69 CCNCc1ncc(cc1F)C 270004a_100015525214_100009845184 [0,2,0,0,0,0|2,0,0]=4 13467 B12R1.69 CCNCc1ncc(cc1F)Cl 207a_100015525214_100009858488 [0,2,0,0,0,0|2,0,0]=4 13468 B12R1.69 CCNCc1ncc(cc1F)Cl 2230a_100015525214_200009879301 [0,2,0,0,0,0|2,0,0]=4 13469 B12R1.69 CCNCc1ncc(cc1F)Cl 270004a_100015525214_100009858488 [0,2,0,0,0,0|2,0,0]=4 13470 B12R1.69 CCNCc1ncc(cc1F)F 34a_100015188779_100000210202 [0,2,0,0,0,0|2,0,0]=4 13471 B12R1.69 CCOCc1ccc(cc1Br)Br 34a_100012357508_100000210202 [0,2,0,0,0,0|1,0,0]=3 13472 B12R1.69 CCOCc1ccc(cc1Br)Br 34a_100121572206_200012351560 [0,2,0,0,0,0|1,0,0]=3 13473 B12R1.69 CCOCc1ccc(cc1Br)Br 7a_100012357508_100000210202 [0,2,0,0,0,0|1,0,0]=3 13474 B12R1.69 CCOCc1ccc(cc1Br)Cl 34a_100000707881_100000210202 [0,2,0,0,0,0|1,0,0]=3 13475 B12R1.69 CCOCc1ccc(cc1Br)Cl 34a_100121572206_100000755608 [0,2,0,0,0,0|1,0,0]=3 13476 B12R1.69 CCOCc1ccc(cc1Br)Cl 7a_100000707881_100000210202 [0,2,0,0,0,0|1,0,0]=3 13477 B12R1.69 CCOCc1ccc(cc1Br)F 34a_100000744086_100000210202 [0,2,0,0,0,0|1,0,0]=3 13478 B12R1.69 CCOCc1ccc(cc1Br)F 34a_100121572206_100000243222 [0,2,0,0,0,0|1,0,0]=3 13479 B12R1.69 CCOCc1ccc(cc1Br)F 7a_100000744086_100000210202 [0,2,0,0,0,0|1,0,0]=3 13480 B12R1.69 CCOCc1ccc(cc1Br)I 34a_100121572206_100010146610 [0,2,0,0,0,0|1,0,0]=3 13481 B12R1.69 CCOCc1ccc(cc1Br)I 7a_100010240206_100000210202 [0,2,0,0,0,0|1,0,0]=3 13482 B12R1.69 CCOCc1ccc(cc1C)Br 34a_100000748258_100000210202 [0,2,0,0,0,0|1,0,0]=3 13483 B12R1.69 CCOCc1ccc(cc1C)Br 34a_100121572206_100000708836 [0,2,0,0,0,0|1,0,0]=3 13484 B12R1.69 CCOCc1ccc(cc1C)Br 7a_100000748258_100000210202 [0,2,0,0,0,0|1,0,0]=3 13485 B12R1.69 CCOCc1ccc(cc1C)C 34a_100011215341_100000210202 [0,2,0,0,0,0|1,0,0]=3 13486 B12R1.69 CCOCc1ccc(cc1C)C 34a_100121572206_100011219618 [0,2,0,0,0,0|1,0,0]=3 13487 B12R1.69 CCOCc1ccc(cc1C)C 7a_100011215341_100000210202 [0,2,0,0,0,0|1,0,0]=3 13488 B12R1.69 CCOCc1ccc(cc1C)Cl 34a_100000702939_100000210202 [0,2,0,0,0,0|1,0,0]=3 13489 B12R1.69 CCOCc1ccc(cc1C)Cl 34a_100121572206_100012361307 [0,2,0,0,0,0|1,0,0]=3 13490 B12R1.69 CCOCc1ccc(cc1C)Cl 7a_100000702939_100000210202 [0,2,0,0,0,0|1,0,0]=3 13491 B12R1.69 CCOCc1ccc(cc1C)F 34a_100000700136_100000210202 [0,2,0,0,0,0|1,0,0]=3 13492 B12R1.69 CCOCc1ccc(cc1C)F 34a_100121572206_100000700533 [0,2,0,0,0,0|1,0,0]=3 13493 B12R1.69 CCOCc1ccc(cc1C)F 7a_100000700136_100000210202 [0,2,0,0,0,0|1,0,0]=3 13494 B12R1.69 CCOCc1ccc(cc1C)N 34a_100000102464_100000210202 [0,2,0,0,0,0|1,0,0]=3 13495 B12R1.69 CCOCc1ccc(cc1C)N 7a_100000102464_100000210202 [0,2,0,0,0,0|1,0,0]=3 13496 B12R1.69 CCOCc1ccc(cc1Cl)Br 34a_100000756401_100000210202 [0,2,0,0,0,0|1,0,0]=3 13497 B12R1.69 CCOCc1ccc(cc1Cl)Br 34a_100121572206_100011740631 [0,2,0,0,0,0|1,0,0]=3 13498 B12R1.69 CCOCc1ccc(cc1Cl)Br 7a_100000756401_100000210202 [0,2,0,0,0,0|1,0,0]=3 13499 B12R1.69 CCOCc1ccc(cc1Cl)C 34a_100000720314_100000210202 [0,2,0,0,0,0|1,0,0]=3 13500 B12R1.69 CCOCc1ccc(cc1Cl)C 34a_100121572206_100012349684 [0,2,0,0,0,0|1,0,0]=3 13501 B12R1.69 CCOCc1ccc(cc1Cl)C 7a_100000720314_100000210202 [0,2,0,0,0,0|1,0,0]=3 13502 B12R1.69 CCOCc1ccc(cc1Cl)Cl 34a_100000215721_100000210202 [0,2,0,0,0,0|1,0,0]=3 13503 B12R1.69 CCOCc1ccc(cc1Cl)Cl 34a_100121572206_100000188473 [0,2,0,0,0,0|1,0,0]=3 13504 B12R1.69 CCOCc1ccc(cc1Cl)Cl 7a_100000215721_100000210202 [0,2,0,0,0,0|1,0,0]=3 13505 B12R1.69 CCOCc1ccc(cc1Cl)F 34a_100011219954_100000210202 [0,2,0,0,0,0|1,0,0]=3 13506 B12R1.69 CCOCc1ccc(cc1Cl)F 34a_100121572206_100011216360 [0,2,0,0,0,0|1,0,0]=3 13507 B12R1.69 CCOCc1ccc(cc1Cl)F 7a_100011219954_100000210202 [0,2,0,0,0,0|1,0,0]=3 13508 B12R1.69 CCOCc1ccc(cc1Cl)N 34a_100000689119_100000210202 [0,2,0,0,0,0|1,0,0]=3 13509 B12R1.69 CCOCc1ccc(cc1F)Br 34a_100011191541_100000210202 [0,2,0,0,0,0|1,0,0]=3 13510 B12R1.69 CCOCc1ccc(cc1F)Br 34a_100121572206_100000211606 [0,2,0,0,0,0|1,0,0]=3 13511 B12R1.69 CCOCc1ccc(cc1F)Br 7a_100011191541_100000210202 [0,2,0,0,0,0|1,0,0]=3 13512 B12R1.69 CCOCc1ccc(cc1F)C 34a_100011216587_100000210202 [0,2,0,0,0,0|1,0,0]=3 13513 B12R1.69 CCOCc1ccc(cc1F)C 34a_100121572206_100012002367 [0,2,0,0,0,0|1,0,0]=3 13514 B12R1.69 CCOCc1ccc(cc1F)C 7a_100011216587_100000210202 [0,2,0,0,0,0|1,0,0]=3 13515 B12R1.69 CCOCc1ccc(cc1F)Cl 34a_100011217562_100000210202 [0,2,0,0,0,0|1,0,0]=3 13516 B12R1.69 CCOCc1ccc(cc1F)Cl 34a_100121572206_100000709361 [0,2,0,0,0,0|1,0,0]=3 13517 B12R1.69 CCOCc1ccc(cc1F)Cl 7a_100011217562_100000210202 [0,2,0,0,0,0|1,0,0]=3 13518 B12R1.69 CCOCc1ccc(cc1F)F 34a_100011215441_100000210202 [0,2,0,0,0,0|1,0,0]=3 13519 B12R1.69 CCOCc1ccc(cc1F)F 34a_100121572206_100000748237 [0,2,0,0,0,0|1,0,0]=3 13520 B12R1.69 CCOCc1ccc(cc1F)F 7a_100011215441_100000210202 [0,2,0,0,0,0|1,0,0]=3 13521 B12R1.69 CCOCc1ccc(cc1F)I 34a_100121572206_100010244991 [0,2,0,0,0,0|1,0,0]=3 13522 B12R1.69 CCOCc1ccc(cc1F)I 34a_200010202041_100000210202 [0,2,0,0,0,0|1,0,0]=3 13523 B12R1.69 CCOCc1ccc(cc1F)I 7a_200010202041_100000210202 [0,2,0,0,0,0|1,0,0]=3 13524 B12R1.69 CCOCc1ccc(cc1I)Br 34a_100121572206_100010146615 [0,2,0,0,0,0|1,0,0]=3 13525 B12R1.69 CCOCc1ccc(cc1I)Br 7a_100010146605_100000210202 [0,2,0,0,0,0|1,0,0]=3 13526 B12R1.69 CCOCc1ccc(cc1I)Cl 34a_100000722340_100000210202 [0,2,0,0,0,0|1,0,0]=3 13527 B12R1.69 CCOCc1ccc(cc1I)Cl 34a_100121572206_100010254388 [0,2,0,0,0,0|1,0,0]=3 13528 B12R1.69 CCOCc1ccc(cc1I)Cl 7a_100000722340_100000210202 [0,2,0,0,0,0|1,0,0]=3 13529 B12R1.69 CCOCc1ccc(cc1I)F 34a_100011356828_100000210202 [0,2,0,0,0,0|1,0,0]=3 13530 B12R1.69 CCOCc1ccc(cc1I)F 34a_100121572206_100012354799 [0,2,0,0,0,0|1,0,0]=3 13531 B12R1.69 CCOCc1ccc(cc1I)F 7a_100011356828_100000210202 [0,2,0,0,0,0|1,0,0]=3 13532 B12R1.69 CCOCc1ccc(cc1N)Br 34a_100000718831_100000210202 [0,2,0,0,0,0|1,0,0]=3 13533 B12R1.69 CCOCc1ccc(cc1N)Br 7a_100000718831_100000210202 [0,2,0,0,0,0|1,0,0]=3 13534 B12R1.69 CCOCc1ccc(cc1N)C 34a_100000087799_100000210202 [0,2,0,0,0,0|1,0,0]=3 13535 B12R1.69 CCOCc1ccc(cc1N)C 7a_100000087799_100000210202 [0,2,0,0,0,0|1,0,0]=3 13536 B12R1.69 CCOCc1ccc(cc1N)Cl 34a_100000238622_100000210202 [0,2,0,0,0,0|1,0,0]=3 13537 B12R1.69 CCOCc1ccc(cc1N)Cl 7a_100000238622_100000210202 [0,2,0,0,0,0|1,0,0]=3 13538 B12R1.69 CCOCc1ccc(cc1N)F 34a_100011996588_100000210202 [0,2,0,0,0,0|1,0,0]=3 13539 B12R1.69 CCOCc1ccc(nc1Br)Br 34a_200010005763_100000210202 [0,2,0,0,0,0|2,0,0]=4 13540 B12R1.69 CCOCc1ccc(nc1Br)Br 7a_200010005763_100000210202 [0,2,0,0,0,0|2,0,0]=4 13541 B12R1.69 CCOCc1ccc(nc1Br)C 34a_100121572206_200010064658 [0,2,0,0,0,0|2,0,0]=4 13542 B12R1.69 CCOCc1ccc(nc1C)C 34a_100011756430_100000210202 [0,2,0,0,0,0|2,0,0]=4 13543 B12R1.69 CCOCc1ccc(nc1C)C 7a_100011756430_100000210202 [0,2,0,0,0,0|2,0,0]=4 13544 B12R1.69 CCOCc1ccc(nc1C)F 34a_100000081978_100000210202 [0,2,0,0,0,0|2,0,0]=4 13545 B12R1.69 CCOCc1ccc(nc1C)F 7a_100000081978_100000210202 [0,2,0,0,0,0|2,0,0]=4 13546 B12R1.69 CCOCc1ccc(nc1Cl)C 34a_102495338573_100000210202 [0,2,0,0,0,0|2,0,0]=4 13547 B12R1.69 CCOCc1ccc(nc1Cl)C 7a_102495338573_100000210202 [0,2,0,0,0,0|2,0,0]=4 13548 B12R1.69 CCOCc1ccc(nc1Cl)Cl 34a_100000720492_100000210202 [0,2,0,0,0,0|2,0,0]=4 13549 B12R1.69 CCOCc1ccc(nc1Cl)Cl 34a_100121572206_100000722033 [0,2,0,0,0,0|2,0,0]=4 13550 B12R1.69 CCOCc1ccc(nc1Cl)Cl 7a_100000720492_100000210202 [0,2,0,0,0,0|2,0,0]=4 13551 B12R1.69 CCOCc1ccc(nc1F)Br 34a_100010065253_100000210202 [0,2,0,0,0,0|2,0,0]=4 13552 B12R1.69 CCOCc1ccc(nc1F)Br 7a_100010065253_100000210202 [0,2,0,0,0,0|2,0,0]=4 13553 B12R1.69 CCOCc1ccc(nc1F)Cl 34a_100009870654_100000210202 [0,2,0,0,0,0|2,0,0]=4 13554 B12R1.69 CCOCc1ccc(nc1F)Cl 7a_100009870654_100000210202 [0,2,0,0,0,0|2,0,0]=4 13555 B12R1.69 CCOCc1cnc(cc1C)Cl 34a_100010277336_100000210202 [0,2,0,0,0,0|2,0,0]=4 13556 B12R1.69 CCOCc1cnc(cc1C)Cl 7a_100010277336_100000210202 [0,2,0,0,0,0|2,0,0]=4 13557 B12R1.69 CCOCc1cnc(cc1C)F 34a_100121572206_100010382440 [0,2,0,0,0,0|2,0,0]=4 13558 B12R1.69 CCOCc1cnc(cc1Cl)Cl 34a_100000702863_100000210202 [0,2,0,0,0,0|2,0,0]=4 13559 B12R1.69 CCOCc1cnc(cc1Cl)Cl 34a_100121572206_100011997056 [0,2,0,0,0,0|2,0,0]=4 13560 B12R1.69 CCOCc1cnc(cc1Cl)Cl 7a_100000702863_100000210202 [0,2,0,0,0,0|2,0,0]=4 13561 B12R1.69 CCOCc1cnc(cc1N)C 34a_200012022818_100000210202 [0,2,0,0,0,0|2,0,0]=4 13562 B12R1.69 CCOCc1cnc(cc1N)Cl 34a_100009830438_100000210202 [0,2,0,0,0,0|2,0,0]=4 13563 B12R1.69 CCOCc1ncc(cc1Br)Br 34a_100012354961_100000210202 [0,2,0,0,0,0|2,0,0]=4 13564 B12R1.69 CCOCc1ncc(cc1Br)Br 7a_100012354961_100000210202 [0,2,0,0,0,0|2,0,0]=4 13565 B12R1.69 CCOCc1ncc(cc1Br)Cl 34a_100010065237_100000210202 [0,2,0,0,0,0|2,0,0]=4 13566 B12R1.69 CCOCc1ncc(cc1Br)Cl 7a_100010065237_100000210202 [0,2,0,0,0,0|2,0,0]=4 13567 B12R1.69 CCOCc1ncc(cc1C)Br 34a_100010116297_100000210202 [0,2,0,0,0,0|2,0,0]=4 13568 B12R1.69 CCOCc1ncc(cc1C)Br 7a_100010116297_100000210202 [0,2,0,0,0,0|2,0,0]=4 13569 B12R1.69 CCOCc1ncc(cc1C)C 34a_100012000483_100000210202 [0,2,0,0,0,0|2,0,0]=4 13570 B12R1.69 CCOCc1ncc(cc1C)C 34a_100121572206_100016990036 [0,2,0,0,0,0|2,0,0]=4 13571 B12R1.69 CCOCc1ncc(cc1C)C 7a_100012000483_100000210202 [0,2,0,0,0,0|2,0,0]=4 13572 B12R1.69 CCOCc1ncc(cc1Cl)Br 34a_100010065239_100000210202 [0,2,0,0,0,0|2,0,0]=4 13573 B12R1.69 CCOCc1ncc(cc1Cl)Br 7a_100010065239_100000210202 [0,2,0,0,0,0|2,0,0]=4 13574 B12R1.69 CCOCc1ncc(cc1Cl)Cl 34a_100103146734_100000210202 [0,2,0,0,0,0|2,0,0]=4 13575 B12R1.69 CCOCc1ncc(cc1Cl)Cl 7a_100103146734_100000210202 [0,2,0,0,0,0|2,0,0]=4 13576 B12R1.69 CCOCc1ncc(cc1F)Br 34a_100010065252_100000210202 [0,2,0,0,0,0|2,0,0]=4 13577 B12R1.69 CCOCc1ncc(cc1F)Br 7a_100010065252_100000210202 [0,2,0,0,0,0|2,0,0]=4 13578 B12R1.69 CCOCc1ncc(cc1F)Cl 34a_100009885607_100000210202 [0,2,0,0,0,0|2,0,0]=4 13579 B12R1.69 CCOCc1ncc(cc1F)Cl 34a_100121572206_200009879301 [0,2,0,0,0,0|2,0,0]=4 13580 B12R1.69 CCOCc1ncc(cc1F)Cl 7a_100009885607_100000210202 [0,2,0,0,0,0|2,0,0]=4 13581 B12R1.69 CCOCc1ncc(cc1F)F 34a_100000104222_100000210202 [0,2,0,0,0,0|2,0,0]=4 13582 B12R1.69 CCOCc1ncc(cc1F)F 7a_100000104222_100000210202 [0,2,0,0,0,0|2,0,0]=4 13583 B12R1.69 CCSCc1ccc(cc1Br)Br 62a_100000210202_200012351560 [0,2,0,0,0,0|1,0,0]=3 13584 B12R1.69 CCSCc1ccc(cc1Br)Br 62a_200012351560_100000210202 [0,2,0,0,0,0|1,0,0]=3 13585 B12R1.69 CCSCc1ccc(cc1Br)Cl 62a_100000210202_100000755608 [0,2,0,0,0,0|1,0,0]=3 13586 B12R1.69 CCSCc1ccc(cc1Br)Cl 62a_100000755608_100000210202 [0,2,0,0,0,0|1,0,0]=3 13587 B12R1.69 CCSCc1ccc(cc1Br)F 62a_100000210202_100000243222 [0,2,0,0,0,0|1,0,0]=3 13588 B12R1.69 CCSCc1ccc(cc1Br)F 62a_100000243222_100000210202 [0,2,0,0,0,0|1,0,0]=3 13589 B12R1.69 CCSCc1ccc(cc1Br)I 62a_100000210202_100010146610 [0,2,0,0,0,0|1,0,0]=3 13590 B12R1.69 CCSCc1ccc(cc1Br)I 62a_100010146610_100000210202 [0,2,0,0,0,0|1,0,0]=3 13591 B12R1.69 CCSCc1ccc(cc1C)Br 62a_100000210202_100000708836 [0,2,0,0,0,0|1,0,0]=3 13592 B12R1.69 CCSCc1ccc(cc1C)Br 62a_100000708836_100000210202 [0,2,0,0,0,0|1,0,0]=3 13593 B12R1.69 CCSCc1ccc(cc1C)C 62a_100000210202_100011219618 [0,2,0,0,0,0|1,0,0]=3 13594 B12R1.69 CCSCc1ccc(cc1C)C 62a_100011219618_100000210202 [0,2,0,0,0,0|1,0,0]=3 13595 B12R1.69 CCSCc1ccc(cc1C)Cl 62a_100000210202_100012361307 [0,2,0,0,0,0|1,0,0]=3 13596 B12R1.69 CCSCc1ccc(cc1C)Cl 62a_100012361307_100000210202 [0,2,0,0,0,0|1,0,0]=3 13597 B12R1.69 CCSCc1ccc(cc1C)F 62a_100000210202_100000700533 [0,2,0,0,0,0|1,0,0]=3 13598 B12R1.69 CCSCc1ccc(cc1C)F 62a_100000700533_100000210202 [0,2,0,0,0,0|1,0,0]=3 13599 B12R1.69 CCSCc1ccc(cc1Cl)Br 62a_100000210202_100011740631 [0,2,0,0,0,0|1,0,0]=3 13600 B12R1.69 CCSCc1ccc(cc1Cl)Br 62a_100011740631_100000210202 [0,2,0,0,0,0|1,0,0]=3 13601 B12R1.69 CCSCc1ccc(cc1Cl)C 62a_100000210202_100012349684 [0,2,0,0,0,0|1,0,0]=3 13602 B12R1.69 CCSCc1ccc(cc1Cl)C 62a_100012349684_100000210202 [0,2,0,0,0,0|1,0,0]=3 13603 B12R1.69 CCSCc1ccc(cc1Cl)Cl 62a_100000188473_100000210202 [0,2,0,0,0,0|1,0,0]=3 13604 B12R1.69 CCSCc1ccc(cc1Cl)Cl 62a_100000210202_100000188473 [0,2,0,0,0,0|1,0,0]=3 13605 B12R1.69 CCSCc1ccc(cc1Cl)F 62a_100000187853_100000210202 [0,2,0,0,0,0|1,0,0]=3 13606 B12R1.69 CCSCc1ccc(cc1Cl)F 62a_100000210202_100000187853 [0,2,0,0,0,0|1,0,0]=3 13607 B12R1.69 CCSCc1ccc(cc1F)Br 62a_100000210202_100000211606 [0,2,0,0,0,0|1,0,0]=3 13608 B12R1.69 CCSCc1ccc(cc1F)Br 62a_100000211606_100000210202 [0,2,0,0,0,0|1,0,0]=3 13609 B12R1.69 CCSCc1ccc(cc1F)C 62a_100000210202_100011217900 [0,2,0,0,0,0|1,0,0]=3 13610 B12R1.69 CCSCc1ccc(cc1F)C 62a_100011217900_100000210202 [0,2,0,0,0,0|1,0,0]=3 13611 B12R1.69 CCSCc1ccc(cc1F)Cl 62a_100000210202_100000709361 [0,2,0,0,0,0|1,0,0]=3 13612 B12R1.69 CCSCc1ccc(cc1F)Cl 62a_100000709361_100000210202 [0,2,0,0,0,0|1,0,0]=3 13613 B12R1.69 CCSCc1ccc(cc1F)F 62a_100000210202_100000748237 [0,2,0,0,0,0|1,0,0]=3 13614 B12R1.69 CCSCc1ccc(cc1F)F 62a_100000748237_100000210202 [0,2,0,0,0,0|1,0,0]=3 13615 B12R1.69 CCSCc1ccc(cc1F)I 62a_100000210202_100010244991 [0,2,0,0,0,0|1,0,0]=3 13616 B12R1.69 CCSCc1ccc(cc1F)I 62a_100010244991_100000210202 [0,2,0,0,0,0|1,0,0]=3 13617 B12R1.69 CCSCc1ccc(cc1I)Br 62a_100000210202_100010146615 [0,2,0,0,0,0|1,0,0]=3 13618 B12R1.69 CCSCc1ccc(cc1I)Br 62a_100010146615_100000210202 [0,2,0,0,0,0|1,0,0]=3 13619 B12R1.69 CCSCc1ccc(cc1I)Cl 62a_100000210202_100010254388 [0,2,0,0,0,0|1,0,0]=3 13620 B12R1.69 CCSCc1ccc(cc1I)Cl 62a_100010254388_100000210202 [0,2,0,0,0,0|1,0,0]=3 13621 B12R1.69 CCSCc1ccc(cc1I)F 62a_100000210202_100012354799 [0,2,0,0,0,0|1,0,0]=3 13622 B12R1.69 CCSCc1ccc(cc1I)F 62a_100012354799_100000210202 [0,2,0,0,0,0|1,0,0]=3 13623 B12R1.69 CCSCc1ccc(nc1Br)C 62a_100000210202_200010064658 [0,2,0,0,0,0|2,0,0]=4 13624 B12R1.69 CCSCc1ccc(nc1Br)C 62a_200010064658_100000210202 [0,2,0,0,0,0|2,0,0]=4 13625 B12R1.69 CCSCc1ccc(nc1Cl)Cl 62a_100000210202_100000722033 [0,2,0,0,0,0|2,0,0]=4 13626 B12R1.69 CCSCc1ccc(nc1Cl)Cl 62a_100000722033_100000210202 [0,2,0,0,0,0|2,0,0]=4 13627 B12R1.69 CCSCc1cnc(cc1C)F 62a_100000210202_100010382440 [0,2,0,0,0,0|2,0,0]=4 13628 B12R1.69 CCSCc1cnc(cc1C)F 62a_100010382440_100000210202 [0,2,0,0,0,0|2,0,0]=4 13629 B12R1.69 CCSCc1cnc(cc1Cl)Cl 62a_100000210202_100011997056 [0,2,0,0,0,0|2,0,0]=4 13630 B12R1.69 CCSCc1cnc(cc1Cl)Cl 62a_100011997056_100000210202 [0,2,0,0,0,0|2,0,0]=4 13631 B12R1.69 CCSCc1ncc(cc1C)C 62a_100000210202_100016990036 [0,2,0,0,0,0|2,0,0]=4 13632 B12R1.69 CCSCc1ncc(cc1C)C 62a_100016990036_100000210202 [0,2,0,0,0,0|2,0,0]=4 13633 B12R1.69 CCSCc1ncc(cc1F)Cl 62a_100000210202_200009879301 [0,2,0,0,0,0|2,0,0]=4 13634 B12R1.69 CCSCc1ncc(cc1F)Cl 62a_200009879301_100000210202 [0,2,0,0,0,0|2,0,0]=4 13635 B12R1.69 CNCCc1ccc(cc1Br)Cl 2230a_106832991635_200012945151 [0,2,0,0,0,0|1,0,0]=3 13636 B12R1.69 CNCCc1ccc(cc1Br)Cl 34a_100102657272_200012945151 [0,2,0,0,0,0|1,0,0]=3 13637 B12R1.69 CNCCc1ccc(cc1Br)Cl 7a_106832991635_200012945151 [0,2,0,0,0,0|1,0,0]=3 13638 B12R1.69 CNCCc1ccc(cc1C)C 2230a_100000745621_200000210301 [0,2,0,0,0,0|1,0,0]=3 13639 B12R1.69 CNCCc1ccc(cc1C)C 270004a_106832991635_100011754701 [0,2,0,0,0,0|1,0,0]=3 13640 B12R1.69 CNCCc1ccc(cc1C)C 34a_100000745621_200000210301 [0,2,0,0,0,0|1,0,0]=3 13641 B12R1.69 CNCCc1ccc(cc1Cl)Cl 2230a_100000210994_200000210301 [0,2,0,0,0,0|1,0,0]=3 13642 B12R1.69 CNCCc1ccc(cc1Cl)Cl 2230a_106832991635_200012161198 [0,2,0,0,0,0|1,0,0]=3 13643 B12R1.69 CNCCc1ccc(cc1Cl)Cl 34a_100000210994_200000210301 [0,2,0,0,0,0|1,0,0]=3 13644 B12R1.69 CNCCc1ccc(cc1Cl)Cl 34a_100102657272_200012161198 [0,2,0,0,0,0|1,0,0]=3 13645 B12R1.69 CNCCc1ccc(cc1Cl)Cl 7a_106832991635_200012161198 [0,2,0,0,0,0|1,0,0]=3 13646 B12R1.69 CNCCc1ccc(cc1F)Cl 2230a_103496529009_200000210301 [0,2,0,0,0,0|1,0,0]=3 13647 B12R1.69 CNCCc1ccc(cc1F)Cl 34a_103496529009_200000210301 [0,2,0,0,0,0|1,0,0]=3 13648 B12R1.69 CNCCc1ccc(cc1F)F 2230a_100000754870_200000210301 [0,2,0,0,0,0|1,0,0]=3 13649 B12R1.69 CNCCc1ccc(cc1F)F 34a_100000754870_200000210301 [0,2,0,0,0,0|1,0,0]=3 13650 B12R1.69 COCCc1ccc(cc1Br)Cl 34a_100138415774_200012945151 [0,2,0,0,0,0|1,0,0]=3 13651 B12R1.69 COCCc1ccc(cc1Cl)Br 34a_100013445822_200000210301 [0,2,0,0,0,0|1,0,0]=3 13652 B12R1.69 COCCc1ccc(cc1Cl)Br 7a_100013445822_200000210301 [0,2,0,0,0,0|1,0,0]=3 13653 B12R1.69 COCCc1ccc(cc1Cl)Cl 34a_100011215701_200000210301 [0,2,0,0,0,0|1,0,0]=3 13654 B12R1.69 COCCc1ccc(cc1Cl)Cl 34a_100138415774_200012161198 [0,2,0,0,0,0|1,0,0]=3 13655 B12R1.69 COCCc1ccc(cc1Cl)Cl 7a_100011215701_200000210301 [0,2,0,0,0,0|1,0,0]=3 13656 B12R1.69 COCCc1ccc(cc1Cl)F 34a_100011962860_200000210301 [0,2,0,0,0,0|1,0,0]=3 13657 B12R1.69 COCCc1ccc(cc1Cl)F 7a_100011962860_200000210301 [0,2,0,0,0,0|1,0,0]=3 13658 B12R1.69 COCCc1ccc(cc1F)Br 34a_100011962869_200000210301 [0,2,0,0,0,0|1,0,0]=3 13659 B12R1.69 COCCc1ccc(cc1F)Br 7a_100011962869_200000210301 [0,2,0,0,0,0|1,0,0]=3 13660 B12R1.69 COCCc1ccc(cc1F)F 34a_100000697962_200000210301 [0,2,0,0,0,0|1,0,0]=3 13661 B12R1.69 COCCc1ccc(cc1F)F 7a_100000697962_200000210301 [0,2,0,0,0,0|1,0,0]=3 13662 B12R1.69 COCCn1ccc(cc1=O)O 271570a_203496583355_200015743058 [0,2,0,0,0,0|1,0,1]=4 13663 B12R1.69 COCOc1ccc(cc1F)O 271570a_203496583355_100009812708 [0,2,0,0,0,0|2,0,0]=4 13664 B12R1.69 COCOc1ccc(cc1O)C 271570a_203496583355_100012265689 [0,2,0,0,0,0|1,0,0]=3 13665 B12R1.69 COCOc1cnc(cc1O)F 271570a_203496583355_100010372047 [0,2,0,0,0,0|2,0,0]=4 13666 B12R1.69 COCSc1ccc(cc1Br)Br 62a_100000766300_100011484698 [0,2,0,0,0,0|2,0,0]=4 13667 B12R1.69 COCSc1ccc(cc1Br)Br 62a_100011484698_100000766300 [0,2,0,0,0,0|2,0,0]=4 13668 B12R1.69 COCSc1ccc(cc1Br)C 62a_100000766300_100009813563 [0,2,0,0,0,0|2,0,0]=4 13669 B12R1.69 COCSc1ccc(cc1Br)C 62a_100009813563_100000766300 [0,2,0,0,0,0|2,0,0]=4 13670 B12R1.69 COCSc1ccc(cc1Br)Cl 62a_100000766300_100011219703 [0,2,0,0,0,0|2,0,0]=4 13671 B12R1.69 COCSc1ccc(cc1Br)Cl 62a_100011219703_100000766300 [0,2,0,0,0,0|2,0,0]=4 13672 B12R1.69 COCSc1ccc(cc1Br)F 62a_100000766300_100011217111 [0,2,0,0,0,0|2,0,0]=4 13673 B12R1.69 COCSc1ccc(cc1Br)F 62a_100011217111_100000766300 [0,2,0,0,0,0|2,0,0]=4 13674 B12R1.69 COCSc1ccc(cc1Br)N 62a_100000750458_100000766300 [0,2,0,0,0,0|2,0,0]=4 13675 B12R1.69 COCSc1ccc(cc1Br)N 62a_100000766300_100000750458 [0,2,0,0,0,0|2,0,0]=4 13676 B12R1.69 COCSc1ccc(cc1Br)O 62a_100000701344_100000766300 [0,2,0,0,0,0|2,0,0]=4 13677 B12R1.69 COCSc1ccc(cc1Br)O 62a_100000766300_100000701344 [0,2,0,0,0,0|2,0,0]=4 13678 B12R1.69 COCSc1ccc(cc1C)Br 62a_100000701812_100000766300 [0,2,0,0,0,0|2,0,0]=4 13679 B12R1.69 COCSc1ccc(cc1C)Br 62a_100000766300_100000701812 [0,2,0,0,0,0|2,0,0]=4 13680 B12R1.69 COCSc1ccc(cc1C)C 62a_100000766300_100011217332 [0,2,0,0,0,0|2,0,0]=4 13681 B12R1.69 COCSc1ccc(cc1C)C 62a_100011217332_100000766300 [0,2,0,0,0,0|2,0,0]=4 13682 B12R1.69 COCSc1ccc(cc1C)Cl 62a_100000766300_100011219607 [0,2,0,0,0,0|2,0,0]=4 13683 B12R1.69 COCSc1ccc(cc1C)Cl 62a_100011219607_100000766300 [0,2,0,0,0,0|2,0,0]=4 13684 B12R1.69 COCSc1ccc(cc1C)F 62a_100000766300_100011205405 [0,2,0,0,0,0|2,0,0]=4 13685 B12R1.69 COCSc1ccc(cc1C)F 62a_100011205405_100000766300 [0,2,0,0,0,0|2,0,0]=4 13686 B12R1.69 COCSc1ccc(cc1C)N 62a_100000210723_100000766300 [0,2,0,0,0,0|2,0,0]=4 13687 B12R1.69 COCSc1ccc(cc1C)N 62a_100000766300_100000210723 [0,2,0,0,0,0|2,0,0]=4 13688 B12R1.69 COCSc1ccc(cc1C)O 62a_100000766300_100000690111 [0,2,0,0,0,0|2,0,0]=4 13689 B12R1.69 COCSc1ccc(cc1Cl)Br 62a_100000766300_100011216062 [0,2,0,0,0,0|2,0,0]=4 13690 B12R1.69 COCSc1ccc(cc1Cl)Br 62a_100011216062_100000766300 [0,2,0,0,0,0|2,0,0]=4 13691 B12R1.69 COCSc1ccc(cc1Cl)C 62a_100000766300_100011263221 [0,2,0,0,0,0|2,0,0]=4 13692 B12R1.69 COCSc1ccc(cc1Cl)C 62a_100011263221_100000766300 [0,2,0,0,0,0|2,0,0]=4 13693 B12R1.69 COCSc1ccc(cc1Cl)Cl 62a_100000699841_100000766300 [0,2,0,0,0,0|2,0,0]=4 13694 B12R1.69 COCSc1ccc(cc1Cl)Cl 62a_100000766300_100000699841 [0,2,0,0,0,0|2,0,0]=4 13695 B12R1.69 COCSc1ccc(cc1Cl)F 62a_100000733362_100000766300 [0,2,0,0,0,0|2,0,0]=4 13696 B12R1.69 COCSc1ccc(cc1Cl)F 62a_100000766300_100000733362 [0,2,0,0,0,0|2,0,0]=4 13697 B12R1.69 COCSc1ccc(cc1Cl)N 62a_100000761885_100000766300 [0,2,0,0,0,0|2,0,0]=4 13698 B12R1.69 COCSc1ccc(cc1Cl)N 62a_100000766300_100000761885 [0,2,0,0,0,0|2,0,0]=4 13699 B12R1.69 COCSc1ccc(cc1Cl)O 62a_100000047559_100000766300 [0,2,0,0,0,0|2,0,0]=4 13700 B12R1.69 COCSc1ccc(cc1Cl)O 62a_100000766300_100000047559 [0,2,0,0,0,0|2,0,0]=4 13701 B12R1.69 COCSc1ccc(cc1F)Br 62a_100000766300_100009814013 [0,2,0,0,0,0|2,0,0]=4 13702 B12R1.69 COCSc1ccc(cc1F)Br 62a_100009814013_100000766300 [0,2,0,0,0,0|2,0,0]=4 13703 B12R1.69 COCSc1ccc(cc1F)C 62a_100000766300_100011216119 [0,2,0,0,0,0|2,0,0]=4 13704 B12R1.69 COCSc1ccc(cc1F)C 62a_100011216119_100000766300 [0,2,0,0,0,0|2,0,0]=4 13705 B12R1.69 COCSc1ccc(cc1F)Cl 62a_100000766300_100011216042 [0,2,0,0,0,0|2,0,0]=4 13706 B12R1.69 COCSc1ccc(cc1F)Cl 62a_100011216042_100000766300 [0,2,0,0,0,0|2,0,0]=4 13707 B12R1.69 COCSc1ccc(cc1F)F 62a_100000750030_100000766300 [0,2,0,0,0,0|2,0,0]=4 13708 B12R1.69 COCSc1ccc(cc1F)F 62a_100000766300_100000750030 [0,2,0,0,0,0|2,0,0]=4 13709 B12R1.69 COCSc1ccc(cc1F)N 62a_100000766300_100011356925 [0,2,0,0,0,0|2,0,0]=4 13710 B12R1.69 COCSc1ccc(cc1F)N 62a_100011356925_100000766300 [0,2,0,0,0,0|2,0,0]=4 13711 B12R1.69 COCSc1ccc(cc1F)O 62a_100000755031_100000766300 [0,2,0,0,0,0|2,0,0]=4 13712 B12R1.69 COCSc1ccc(cc1F)O 62a_100000766300_100000755031 [0,2,0,0,0,0|2,0,0]=4 13713 B12R1.69 COCSc1ccc(cc1N)Br 62a_100000743836_100000766300 [0,2,0,0,0,0|2,0,0]=4 13714 B12R1.69 COCSc1ccc(cc1N)Br 62a_100000766300_100000743836 [0,2,0,0,0,0|2,0,0]=4 13715 B12R1.69 COCSc1ccc(cc1N)C 62a_100000766300_100011216686 [0,2,0,0,0,0|2,0,0]=4 13716 B12R1.69 COCSc1ccc(cc1N)C 62a_100011216686_100000766300 [0,2,0,0,0,0|2,0,0]=4 13717 B12R1.69 COCSc1ccc(cc1N)Cl 62a_100000761886_100000766300 [0,2,0,0,0,0|2,0,0]=4 13718 B12R1.69 COCSc1ccc(cc1N)Cl 62a_100000766300_100000761886 [0,2,0,0,0,0|2,0,0]=4 13719 B12R1.69 COCSc1ccc(cc1N)F 62a_100000687223_100000766300 [0,2,0,0,0,0|2,0,0]=4 13720 B12R1.69 COCSc1ccc(cc1N)F 62a_100000766300_100000687223 [0,2,0,0,0,0|2,0,0]=4 13721 B12R1.69 COCSc1ccc(cc1N)N 62a_100000766300_200012175722 [0,2,0,0,0,0|2,0,0]=4 13722 B12R1.69 COCSc1ccc(cc1N)N 62a_200012175722_100000766300 [0,2,0,0,0,0|2,0,0]=4 13723 B12R1.69 COCSc1ccc(cc1N)O 62a_100000766300_100011999798 [0,2,0,0,0,0|2,0,0]=4 13724 B12R1.69 COCSc1ccc(cc1N)O 62a_100011999798_100000766300 [0,2,0,0,0,0|2,0,0]=4 13725 B12R1.69 COCSc1ccc(cc1O)Br 62a_100000766300_100012344904 [0,2,0,0,0,0|1,0,0]=3 13726 B12R1.69 COCSc1ccc(cc1O)Br 62a_100012344904_100000766300 [0,2,0,0,0,0|1,0,0]=3 13727 B12R1.69 COCSc1ccc(cc1O)C 62a_100000766300_100012002257 [0,2,0,0,0,0|1,0,0]=3 13728 B12R1.69 COCSc1ccc(cc1O)C 62a_100012002257_100000766300 [0,2,0,0,0,0|1,0,0]=3 13729 B12R1.69 COCSc1ccc(cc1O)Cl 62a_100000050036_100000766300 [0,2,0,0,0,0|1,0,0]=3 13730 B12R1.69 COCSc1ccc(cc1O)Cl 62a_100000766300_100000050036 [0,2,0,0,0,0|1,0,0]=3 13731 B12R1.69 COCSc1ccc(cc1O)F 62a_100000690578_100000766300 [0,2,0,0,0,0|1,0,0]=3 13732 B12R1.69 COCSc1ccc(cc1O)F 62a_100000766300_100000690578 [0,2,0,0,0,0|1,0,0]=3 13733 B12R1.69 COCSc1ccc(cc1O)O 62a_100000766300_100009813921 [0,2,0,0,0,0|1,0,0]=3 13734 B12R1.69 COCSc1ccc(nc1O)C 62a_100000766300_100009817604 [0,2,0,0,0,0|2,0,0]=4 13735 B12R1.69 COCSc1ccc(nc1O)C 62a_100009817604_100000766300 [0,2,0,0,0,0|2,0,0]=4 13736 B12R1.69 COCSc1cnc(cc1O)C 62a_100000766300_100011016184 [0,2,0,0,0,0|2,0,0]=4 13737 B12R1.69 COCSc1cnc(cc1O)C 62a_100011016184_100000766300 [0,2,0,0,0,0|2,0,0]=4 13738 B12R1.69 COCSc1ncc(cc1O)Br 62a_100000766300_100010210634 [0,2,0,0,0,0|2,0,0]=4 13739 B12R1.69 COCSc1ncc(cc1O)Br 62a_100010210634_100000766300 [0,2,0,0,0,0|2,0,0]=4 13740 B12R1.69 COCSc1ncc(cc1O)C 62a_100000766300_100012000487 [0,2,0,0,0,0|2,0,0]=4 13741 B12R1.69 COCSc1ncc(cc1O)Cl 62a_100000766300_100010233512 [0,2,0,0,0,0|2,0,0]=4 13742 B12R1.69 COCSc1ncc(cc1O)Cl 62a_100010233512_100000766300 [0,2,0,0,0,0|2,0,0]=4 13743 B12R1.69 COCSc1ncc(cc1O)F 62a_100000766300_100000079967 [0,2,0,0,0,0|2,0,0]=4 13744 B12R1.69 COCSc1ncc(cc1O)F 62a_100009820119_100000766300 [0,2,0,0,0,0|2,0,0]=4 13745 B12R1.69 CSCCc1ccc(cc1Br)Cl 62a_200000210301_200012945151 [0,2,0,0,0,0|1,0,0]=3 13746 B12R1.69 CSCCc1ccc(cc1Br)Cl 62a_200012945151_200000210301 [0,2,0,0,0,0|1,0,0]=3 13747 B12R1.69 CSCCc1ccc(cc1Cl)Cl 62a_200000210301_200012161198 [0,2,0,0,0,0|1,0,0]=3 13748 B12R1.69 CSCCc1ccc(cc1Cl)Cl 62a_200012161198_200000210301 [0,2,0,0,0,0|1,0,0]=3 13749 B12R1.69 CSCNc1ccc(cc1Br)Br 34a_100000211012_100011218213 [0,2,0,0,0,0|2,0,0]=4 13750 B12R1.69 CSCNc1ccc(cc1Br)C 34a_100000210942_100011218213 [0,2,0,0,0,0|2,0,0]=4 13751 B12R1.69 CSCNc1ccc(cc1Br)Cl 34a_100000752454_100011218213 [0,2,0,0,0,0|2,0,0]=4 13752 B12R1.69 CSCNc1ccc(cc1Br)F 34a_100000738039_100011218213 [0,2,0,0,0,0|2,0,0]=4 13753 B12R1.69 CSCNc1ccc(cc1Br)O 34a_100012001276_100011218213 [0,2,0,0,0,0|2,0,0]=4 13754 B12R1.69 CSCNc1ccc(cc1C)Br 34a_100000211769_100011218213 [0,2,0,0,0,0|2,0,0]=4 13755 B12R1.69 CSCNc1ccc(cc1C)C 34a_100000736561_100011218213 [0,2,0,0,0,0|2,0,0]=4 13756 B12R1.69 CSCNc1ccc(cc1C)Cl 34a_100000210418_100011218213 [0,2,0,0,0,0|2,0,0]=4 13757 B12R1.69 CSCNc1ccc(cc1C)F 34a_100000211637_100011218213 [0,2,0,0,0,0|2,0,0]=4 13758 B12R1.69 CSCNc1ccc(cc1C)I 34a_100000184554_100011218213 [0,2,0,0,0,0|2,0,0]=4 13759 B12R1.69 CSCNc1ccc(cc1C)O 34a_100000756630_100011218213 [0,2,0,0,0,0|2,0,0]=4 13760 B12R1.69 CSCNc1ccc(cc1Cl)Br 34a_100000211467_100011218213 [0,2,0,0,0,0|2,0,0]=4 13761 B12R1.69 CSCNc1ccc(cc1Cl)C 34a_100000210522_100011218213 [0,2,0,0,0,0|2,0,0]=4 13762 B12R1.69 CSCNc1ccc(cc1Cl)Cl 34a_100000185861_100011218213 [0,2,0,0,0,0|2,0,0]=4 13763 B12R1.69 CSCNc1ccc(cc1Cl)F 34a_100000212003_100011218213 [0,2,0,0,0,0|2,0,0]=4 13764 B12R1.69 CSCNc1ccc(cc1Cl)I 34a_100011218065_100011218213 [0,2,0,0,0,0|2,0,0]=4 13765 B12R1.69 CSCNc1ccc(cc1Cl)O 34a_100011215599_100011218213 [0,2,0,0,0,0|2,0,0]=4 13766 B12R1.69 CSCNc1ccc(cc1F)Br 34a_100000210722_100011218213 [0,2,0,0,0,0|2,0,0]=4 13767 B12R1.69 CSCNc1ccc(cc1F)C 34a_100000211023_100011218213 [0,2,0,0,0,0|2,0,0]=4 13768 B12R1.69 CSCNc1ccc(cc1F)Cl 34a_100000211020_100011218213 [0,2,0,0,0,0|2,0,0]=4 13769 B12R1.69 CSCNc1ccc(cc1F)F 34a_100000210720_100011218213 [0,2,0,0,0,0|2,0,0]=4 13770 B12R1.69 CSCNc1ccc(cc1F)I 34a_100011215594_100011218213 [0,2,0,0,0,0|2,0,0]=4 13771 B12R1.69 CSCNc1ccc(cc1F)O 34a_100000759473_100011218213 [0,2,0,0,0,0|2,0,0]=4 13772 B12R1.69 CSCNc1ccc(cc1I)Br 34a_100000187925_100011218213 [0,2,0,0,0,0|2,0,0]=4 13773 B12R1.69 CSCNc1ccc(cc1I)C 34a_100011356834_100011218213 [0,2,0,0,0,0|2,0,0]=4 13774 B12R1.69 CSCNc1ccc(cc1I)Cl 34a_100000761889_100011218213 [0,2,0,0,0,0|2,0,0]=4 13775 B12R1.69 CSCNc1ccc(cc1I)F 34a_100000760547_100011218213 [0,2,0,0,0,0|2,0,0]=4 13776 B12R1.69 CSCNc1ccc(cc1I)O 34a_100010084370_100011218213 [0,2,0,0,0,0|2,0,0]=4 13777 B12R1.69 CSCNc1ccc(cc1O)Br 34a_100000739049_100011218213 [0,2,0,0,0,0|1,0,0]=3 13778 B12R1.69 CSCNc1ccc(cc1O)C 34a_100000211527_100011218213 [0,2,0,0,0,0|1,0,0]=3 13779 B12R1.69 CSCNc1ccc(cc1O)Cl 34a_100000185728_100011218213 [0,2,0,0,0,0|1,0,0]=3 13780 B12R1.69 CSCNc1ccc(cc1O)F 34a_100000753323_100011218213 [0,2,0,0,0,0|1,0,0]=3 13781 B12R1.69 CSCNc1ccc(cc1O)O 34a_100000106777_100011218213 [0,2,0,0,0,0|1,0,0]=3 13782 B12R1.69 CSCOc1ccc(cc1Br)Br 34a_100000188717_100011218213 [0,2,0,0,0,0|2,0,0]=4 13783 B12R1.69 CSCOc1ccc(cc1Br)C 34a_100000210800_100011218213 [0,2,0,0,0,0|2,0,0]=4 13784 B12R1.69 CSCOc1ccc(cc1Br)Cl 34a_100000211998_100011218213 [0,2,0,0,0,0|2,0,0]=4 13785 B12R1.69 CSCOc1ccc(cc1Br)F 34a_100000211999_100011218213 [0,2,0,0,0,0|2,0,0]=4 13786 B12R1.69 CSCOc1ccc(cc1Br)I 34a_100012361655_100011218213 [0,2,0,0,0,0|2,0,0]=4 13787 B12R1.69 CSCOc1ccc(cc1Br)N 34a_100011534360_100011218213 [0,2,0,0,0,0|2,0,0]=4 13788 B12R1.69 CSCOc1ccc(cc1C)Br 34a_100000186361_100011218213 [0,2,0,0,0,0|2,0,0]=4 13789 B12R1.69 CSCOc1ccc(cc1C)C 34a_100000211776_100011218213 [0,2,0,0,0,0|2,0,0]=4 13790 B12R1.69 CSCOc1ccc(cc1C)Cl 34a_100000211091_100011218213 [0,2,0,0,0,0|2,0,0]=4 13791 B12R1.69 CSCOc1ccc(cc1C)F 34a_100000764316_100011218213 [0,2,0,0,0,0|2,0,0]=4 13792 B12R1.69 CSCOc1ccc(cc1C)I 34a_100011218673_100011218213 [0,2,0,0,0,0|2,0,0]=4 13793 B12R1.69 CSCOc1ccc(cc1C)N 34a_100011218179_100011218213 [0,2,0,0,0,0|2,0,0]=4 13794 B12R1.69 CSCOc1ccc(cc1Cl)Br 34a_100000186472_100011218213 [0,2,0,0,0,0|2,0,0]=4 13795 B12R1.69 CSCOc1ccc(cc1Cl)C 34a_100000749699_100011218213 [0,2,0,0,0,0|2,0,0]=4 13796 B12R1.69 CSCOc1ccc(cc1Cl)Cl 34a_100015191787_100011218213 [0,2,0,0,0,0|2,0,0]=4 13797 B12R1.69 CSCOc1ccc(cc1Cl)F 34a_100000212004_100011218213 [0,2,0,0,0,0|2,0,0]=4 13798 B12R1.69 CSCOc1ccc(cc1Cl)I 34a_100012360047_100011218213 [0,2,0,0,0,0|2,0,0]=4 13799 B12R1.69 CSCOc1ccc(cc1Cl)N 34a_100000744943_100011218213 [0,2,0,0,0,0|2,0,0]=4 13800 B12R1.69 CSCOc1ccc(cc1F)Br 34a_100000185481_100011218213 [0,2,0,0,0,0|2,0,0]=4 13801 B12R1.69 CSCOc1ccc(cc1F)C 34a_100011216688_100011218213 [0,2,0,0,0,0|2,0,0]=4 13802 B12R1.69 CSCOc1ccc(cc1F)Cl 34a_100000230166_100011218213 [0,2,0,0,0,0|2,0,0]=4 13803 B12R1.69 CSCOc1ccc(cc1F)F 34a_100000230127_100011218213 [0,2,0,0,0,0|2,0,0]=4 13804 B12R1.69 CSCOc1ccc(cc1F)I 34a_100011356965_100011218213 [0,2,0,0,0,0|2,0,0]=4 13805 B12R1.69 CSCOc1ccc(cc1F)N 34a_100011220035_100011218213 [0,2,0,0,0,0|2,0,0]=4 13806 B12R1.69 CSCOc1ccc(cc1I)Br 34a_100012355227_100011218213 [0,2,0,0,0,0|2,0,0]=4 13807 B12R1.69 CSCOc1ccc(cc1I)C 34a_100000765521_100011218213 [0,2,0,0,0,0|2,0,0]=4 13808 B12R1.69 CSCOc1ccc(cc1I)Cl 34a_100011356953_100011218213 [0,2,0,0,0,0|2,0,0]=4 13809 B12R1.69 CSCOc1ccc(cc1I)F 34a_100012355409_100011218213 [0,2,0,0,0,0|2,0,0]=4 13810 B12R1.69 CSCOc1ccc(cc1N)Br 34a_100000752626_100011218213 [0,2,0,0,0,0|2,0,0]=4 13811 B12R1.69 CSCOc1ccc(cc1N)C 34a_100011215204_100011218213 [0,2,0,0,0,0|2,0,0]=4 13812 B12R1.69 CSCOc1ccc(cc1N)Cl 34a_100000210500_100011218213 [0,2,0,0,0,0|2,0,0]=4 13813 B12R1.69 CSCOc1ccc(cc1N)F 34a_100000759472_100011218213 [0,2,0,0,0,0|2,0,0]=4 13814 B12R1.69 CSCOc1ccc(cc1N)I 34a_100000753495_100011218213 [0,2,0,0,0,0|2,0,0]=4 13815 B12R1.69 CSCOc1ccc(cc1N)N 34a_100000725306_100011218213 [0,2,0,0,0,0|2,0,0]=4 13816 B12R1.69 CSCSc1ccc(cc1Br)Br 62a_100011218213_100011484698 [0,2,0,0,0,0|2,0,0]=4 13817 B12R1.69 CSCSc1ccc(cc1Br)Br 62a_100011484698_100011218213 [0,2,0,0,0,0|2,0,0]=4 13818 B12R1.69 CSCSc1ccc(cc1Br)C 62a_100009813563_100011218213 [0,2,0,0,0,0|2,0,0]=4 13819 B12R1.69 CSCSc1ccc(cc1Br)C 62a_100011218213_100009813563 [0,2,0,0,0,0|2,0,0]=4 13820 B12R1.69 CSCSc1ccc(cc1Br)Cl 62a_100011218213_100011219703 [0,2,0,0,0,0|2,0,0]=4 13821 B12R1.69 CSCSc1ccc(cc1Br)Cl 62a_100011219703_100011218213 [0,2,0,0,0,0|2,0,0]=4 13822 B12R1.69 CSCSc1ccc(cc1Br)F 62a_100011217111_100011218213 [0,2,0,0,0,0|2,0,0]=4 13823 B12R1.69 CSCSc1ccc(cc1Br)F 62a_100011218213_100011217111 [0,2,0,0,0,0|2,0,0]=4 13824 B12R1.69 CSCSc1ccc(cc1Br)N 62a_100000750458_100011218213 [0,2,0,0,0,0|2,0,0]=4 13825 B12R1.69 CSCSc1ccc(cc1Br)N 62a_100011218213_100000750458 [0,2,0,0,0,0|2,0,0]=4 13826 B12R1.69 CSCSc1ccc(cc1Br)O 62a_100000701344_100011218213 [0,2,0,0,0,0|2,0,0]=4 13827 B12R1.69 CSCSc1ccc(cc1Br)O 62a_100011218213_100000701344 [0,2,0,0,0,0|2,0,0]=4 13828 B12R1.69 CSCSc1ccc(cc1C)Br 62a_100000701812_100011218213 [0,2,0,0,0,0|2,0,0]=4 13829 B12R1.69 CSCSc1ccc(cc1C)Br 62a_100011218213_100000701812 [0,2,0,0,0,0|2,0,0]=4 13830 B12R1.69 CSCSc1ccc(cc1C)C 62a_100011217332_100011218213 [0,2,0,0,0,0|2,0,0]=4 13831 B12R1.69 CSCSc1ccc(cc1C)C 62a_100011218213_100011217332 [0,2,0,0,0,0|2,0,0]=4 13832 B12R1.69 CSCSc1ccc(cc1C)Cl 62a_100011218213_100011219607 [0,2,0,0,0,0|2,0,0]=4 13833 B12R1.69 CSCSc1ccc(cc1C)Cl 62a_100011219607_100011218213 [0,2,0,0,0,0|2,0,0]=4 13834 B12R1.69 CSCSc1ccc(cc1C)F 62a_100011205405_100011218213 [0,2,0,0,0,0|2,0,0]=4 13835 B12R1.69 CSCSc1ccc(cc1C)F 62a_100011218213_100011205405 [0,2,0,0,0,0|2,0,0]=4 13836 B12R1.69 CSCSc1ccc(cc1C)N 62a_100000210723_100011218213 [0,2,0,0,0,0|2,0,0]=4 13837 B12R1.69 CSCSc1ccc(cc1C)N 62a_100011218213_100000210723 [0,2,0,0,0,0|2,0,0]=4 13838 B12R1.69 CSCSc1ccc(cc1C)O 62a_100011218213_100000690111 [0,2,0,0,0,0|2,0,0]=4 13839 B12R1.69 CSCSc1ccc(cc1Cl)Br 62a_100011216062_100011218213 [0,2,0,0,0,0|2,0,0]=4 13840 B12R1.69 CSCSc1ccc(cc1Cl)Br 62a_100011218213_100011216062 [0,2,0,0,0,0|2,0,0]=4 13841 B12R1.69 CSCSc1ccc(cc1Cl)C 62a_100011218213_100011263221 [0,2,0,0,0,0|2,0,0]=4 13842 B12R1.69 CSCSc1ccc(cc1Cl)C 62a_100011263221_100011218213 [0,2,0,0,0,0|2,0,0]=4 13843 B12R1.69 CSCSc1ccc(cc1Cl)Cl 62a_100000699841_100011218213 [0,2,0,0,0,0|2,0,0]=4 13844 B12R1.69 CSCSc1ccc(cc1Cl)Cl 62a_100011218213_100000699841 [0,2,0,0,0,0|2,0,0]=4 13845 B12R1.69 CSCSc1ccc(cc1Cl)F 62a_100000733362_100011218213 [0,2,0,0,0,0|2,0,0]=4 13846 B12R1.69 CSCSc1ccc(cc1Cl)F 62a_100011218213_100000733362 [0,2,0,0,0,0|2,0,0]=4 13847 B12R1.69 CSCSc1ccc(cc1Cl)N 62a_100000761885_100011218213 [0,2,0,0,0,0|2,0,0]=4 13848 B12R1.69 CSCSc1ccc(cc1Cl)N 62a_100011218213_100000761885 [0,2,0,0,0,0|2,0,0]=4 13849 B12R1.69 CSCSc1ccc(cc1Cl)O 62a_100000047559_100011218213 [0,2,0,0,0,0|2,0,0]=4 13850 B12R1.69 CSCSc1ccc(cc1Cl)O 62a_100011218213_100000047559 [0,2,0,0,0,0|2,0,0]=4 13851 B12R1.69 CSCSc1ccc(cc1F)Br 62a_100009814013_100011218213 [0,2,0,0,0,0|2,0,0]=4 13852 B12R1.69 CSCSc1ccc(cc1F)Br 62a_100011218213_100009814013 [0,2,0,0,0,0|2,0,0]=4 13853 B12R1.69 CSCSc1ccc(cc1F)C 62a_100011216119_100011218213 [0,2,0,0,0,0|2,0,0]=4 13854 B12R1.69 CSCSc1ccc(cc1F)C 62a_100011218213_100011216119 [0,2,0,0,0,0|2,0,0]=4 13855 B12R1.69 CSCSc1ccc(cc1F)Cl 62a_100011216042_100011218213 [0,2,0,0,0,0|2,0,0]=4 13856 B12R1.69 CSCSc1ccc(cc1F)Cl 62a_100011218213_100011216042 [0,2,0,0,0,0|2,0,0]=4 13857 B12R1.69 CSCSc1ccc(cc1F)F 62a_100000750030_100011218213 [0,2,0,0,0,0|2,0,0]=4 13858 B12R1.69 CSCSc1ccc(cc1F)F 62a_100011218213_100000750030 [0,2,0,0,0,0|2,0,0]=4 13859 B12R1.69 CSCSc1ccc(cc1F)N 62a_100011218213_100011356925 [0,2,0,0,0,0|2,0,0]=4 13860 B12R1.69 CSCSc1ccc(cc1F)N 62a_100011356925_100011218213 [0,2,0,0,0,0|2,0,0]=4 13861 B12R1.69 CSCSc1ccc(cc1F)O 62a_100000755031_100011218213 [0,2,0,0,0,0|2,0,0]=4 13862 B12R1.69 CSCSc1ccc(cc1F)O 62a_100011218213_100000755031 [0,2,0,0,0,0|2,0,0]=4 13863 B12R1.69 CSCSc1ccc(cc1N)Br 62a_100000743836_100011218213 [0,2,0,0,0,0|2,0,0]=4 13864 B12R1.69 CSCSc1ccc(cc1N)Br 62a_100011218213_100000743836 [0,2,0,0,0,0|2,0,0]=4 13865 B12R1.69 CSCSc1ccc(cc1N)C 62a_100011216686_100011218213 [0,2,0,0,0,0|2,0,0]=4 13866 B12R1.69 CSCSc1ccc(cc1N)C 62a_100011218213_100011216686 [0,2,0,0,0,0|2,0,0]=4 13867 B12R1.69 CSCSc1ccc(cc1N)Cl 62a_100000761886_100011218213 [0,2,0,0,0,0|2,0,0]=4 13868 B12R1.69 CSCSc1ccc(cc1N)Cl 62a_100011218213_100000761886 [0,2,0,0,0,0|2,0,0]=4 13869 B12R1.69 CSCSc1ccc(cc1N)F 62a_100000687223_100011218213 [0,2,0,0,0,0|2,0,0]=4 13870 B12R1.69 CSCSc1ccc(cc1N)F 62a_100011218213_100000687223 [0,2,0,0,0,0|2,0,0]=4 13871 B12R1.69 CSCSc1ccc(cc1N)N 62a_100011218213_200012175722 [0,2,0,0,0,0|2,0,0]=4 13872 B12R1.69 CSCSc1ccc(cc1N)N 62a_200012175722_100011218213 [0,2,0,0,0,0|2,0,0]=4 13873 B12R1.69 CSCSc1ccc(cc1N)O 62a_100011218213_100011999798 [0,2,0,0,0,0|2,0,0]=4 13874 B12R1.69 CSCSc1ccc(cc1N)O 62a_100011999798_100011218213 [0,2,0,0,0,0|2,0,0]=4 13875 B12R1.69 CSCSc1ccc(cc1O)Br 62a_100011218213_100012344904 [0,2,0,0,0,0|1,0,0]=3 13876 B12R1.69 CSCSc1ccc(cc1O)Br 62a_100012344904_100011218213 [0,2,0,0,0,0|1,0,0]=3 13877 B12R1.69 CSCSc1ccc(cc1O)C 62a_100011218213_100012002257 [0,2,0,0,0,0|1,0,0]=3 13878 B12R1.69 CSCSc1ccc(cc1O)C 62a_100012002257_100011218213 [0,2,0,0,0,0|1,0,0]=3 13879 B12R1.69 CSCSc1ccc(cc1O)Cl 62a_100000050036_100011218213 [0,2,0,0,0,0|1,0,0]=3 13880 B12R1.69 CSCSc1ccc(cc1O)Cl 62a_100011218213_100000050036 [0,2,0,0,0,0|1,0,0]=3 13881 B12R1.69 CSCSc1ccc(cc1O)F 62a_100000690578_100011218213 [0,2,0,0,0,0|1,0,0]=3 13882 B12R1.69 CSCSc1ccc(cc1O)F 62a_100011218213_100000690578 [0,2,0,0,0,0|1,0,0]=3 13883 B12R1.69 CSCSc1ccc(cc1O)O 62a_100011218213_100009813921 [0,2,0,0,0,0|1,0,0]=3 13884 B12R1.69 CSCSc1ccc(nc1O)C 62a_100009817604_100011218213 [0,2,0,0,0,0|2,0,0]=4 13885 B12R1.69 CSCSc1ccc(nc1O)C 62a_100011218213_100009817604 [0,2,0,0,0,0|2,0,0]=4 13886 B12R1.69 CSCSc1cnc(cc1O)C 62a_100011016184_100011218213 [0,2,0,0,0,0|2,0,0]=4 13887 B12R1.69 CSCSc1cnc(cc1O)C 62a_100011218213_100011016184 [0,2,0,0,0,0|2,0,0]=4 13888 B12R1.69 CSCSc1ncc(cc1O)Br 62a_100010210634_100011218213 [0,2,0,0,0,0|2,0,0]=4 13889 B12R1.69 CSCSc1ncc(cc1O)Br 62a_100011218213_100010210634 [0,2,0,0,0,0|2,0,0]=4 13890 B12R1.69 CSCSc1ncc(cc1O)C 62a_100011218213_100012000487 [0,2,0,0,0,0|2,0,0]=4 13891 B12R1.69 CSCSc1ncc(cc1O)Cl 62a_100010233512_100011218213 [0,2,0,0,0,0|2,0,0]=4 13892 B12R1.69 CSCSc1ncc(cc1O)Cl 62a_100011218213_100010233512 [0,2,0,0,0,0|2,0,0]=4 13893 B12R1.69 CSCSc1ncc(cc1O)F 62a_100009820119_100011218213 [0,2,0,0,0,0|2,0,0]=4 13894 B12R1.69 CSCSc1ncc(cc1O)F 62a_100011218213_100000079967 [0,2,0,0,0,0|2,0,0]=4 13895 B12R1.69 Cc1cc(c(cn1)SCCF)O 62a_100011016184_100011217306 [0,2,0,0,0,0|2,0,0]=4 13896 B12R1.69 Cc1cc(c(cn1)SCCF)O 62a_100011217306_100011016184 [0,2,0,0,0,0|2,0,0]=4 13897 B12R1.69 Cc1cc(c(cn1)SCCO)O 62a_100000211926_100011016184 [0,2,0,0,0,0|2,0,0]=4 13898 B12R1.69 Cc1cc(c(cn1)SCCO)O 62a_100011016184_100000211926 [0,2,0,0,0,0|2,0,0]=4 13899 B12R1.69 Cc1cc(ccc1CNCF)Br 34a_100000753881_100015361967 [0,2,0,0,0,0|2,0,0]=4 13900 B12R1.69 Cc1cc(ccc1CNCF)Cl 34a_103436540063_100015361967 [0,2,0,0,0,0|2,0,0]=4 13901 B12R1.69 Cc1cc(ccc1CNCF)F 34a_100137329023_100015361967 [0,2,0,0,0,0|2,0,0]=4 13902 B12R1.69 Cc1cc(ccc1COCF)Br 34a_100000748258_100015361967 [0,2,0,0,0,0|2,0,0]=4 13903 B12R1.69 Cc1cc(ccc1COCF)Br 7a_100000748258_100015361967 [0,2,0,0,0,0|2,0,0]=4 13904 B12R1.69 Cc1cc(ccc1COCF)Cl 34a_100000702939_100015361967 [0,2,0,0,0,0|2,0,0]=4 13905 B12R1.69 Cc1cc(ccc1COCF)Cl 7a_100000702939_100015361967 [0,2,0,0,0,0|2,0,0]=4 13906 B12R1.69 Cc1cc(ccc1COCF)F 34a_100000700136_100015361967 [0,2,0,0,0,0|2,0,0]=4 13907 B12R1.69 Cc1cc(ccc1COCF)F 7a_100000700136_100015361967 [0,2,0,0,0,0|2,0,0]=4 13908 B12R1.69 Cc1cc(ccc1COCF)N 34a_100000102464_100015361967 [0,2,0,0,0,0|2,0,0]=4 13909 B12R1.69 Cc1cc(ccc1COCF)N 7a_100000102464_100015361967 [0,2,0,0,0,0|2,0,0]=4 13910 B12R1.69 Cc1cc(ccc1CSCF)Br 62a_100000708836_100015361967 [0,2,0,0,0,0|2,0,0]=4 13911 B12R1.69 Cc1cc(ccc1CSCF)Br 62a_100015361967_100000708836 [0,2,0,0,0,0|2,0,0]=4 13912 B12R1.69 Cc1cc(ccc1CSCF)Cl 62a_100012361307_100015361967 [0,2,0,0,0,0|2,0,0]=4 13913 B12R1.69 Cc1cc(ccc1CSCF)Cl 62a_100015361967_100012361307 [0,2,0,0,0,0|2,0,0]=4 13914 B12R1.69 Cc1cc(ccc1CSCF)F 62a_100000700533_100015361967 [0,2,0,0,0,0|2,0,0]=4 13915 B12R1.69 Cc1cc(ccc1CSCF)F 62a_100015361967_100000700533 [0,2,0,0,0,0|2,0,0]=4 13916 B12R1.69 Cc1cc(ccc1NCCF)Br 34a_100000211769_100011217306 [0,2,0,0,0,0|2,0,0]=4 13917 B12R1.69 Cc1cc(ccc1NCCF)Br 7a_100000211769_100011217306 [0,2,0,0,0,0|2,0,0]=4 13918 B12R1.69 Cc1cc(ccc1NCCF)Cl 34a_100000210418_100011217306 [0,2,0,0,0,0|2,0,0]=4 13919 B12R1.69 Cc1cc(ccc1NCCF)Cl 7a_100000210418_100011217306 [0,2,0,0,0,0|2,0,0]=4 13920 B12R1.69 Cc1cc(ccc1NCCF)F 34a_100000211637_100011217306 [0,2,0,0,0,0|2,0,0]=4 13921 B12R1.69 Cc1cc(ccc1NCCF)F 7a_100000211637_100011217306 [0,2,0,0,0,0|2,0,0]=4 13922 B12R1.69 Cc1cc(ccc1NCCF)I 34a_100000184554_100011217306 [0,2,0,0,0,0|2,0,0]=4 13923 B12R1.69 Cc1cc(ccc1NCCF)I 7a_100000184554_100011217306 [0,2,0,0,0,0|2,0,0]=4 13924 B12R1.69 Cc1cc(ccc1NCCF)O 34a_100000756630_100011217306 [0,2,0,0,0,0|2,0,0]=4 13925 B12R1.69 Cc1cc(ccc1NCCO)Br 34a_100000211769_100000211926 [0,2,0,0,0,0|2,0,0]=4 13926 B12R1.69 Cc1cc(ccc1NCCO)Br 7a_100000211769_100000211926 [0,2,0,0,0,0|2,0,0]=4 13927 B12R1.69 Cc1cc(ccc1NCCO)Cl 34a_100000210418_100000211926 [0,2,0,0,0,0|2,0,0]=4 13928 B12R1.69 Cc1cc(ccc1NCCO)Cl 7a_100000210418_100000211926 [0,2,0,0,0,0|2,0,0]=4 13929 B12R1.69 Cc1cc(ccc1NCCO)F 34a_100000211637_100000211926 [0,2,0,0,0,0|2,0,0]=4 13930 B12R1.69 Cc1cc(ccc1NCCO)F 7a_100000211637_100000211926 [0,2,0,0,0,0|2,0,0]=4 13931 B12R1.69 Cc1cc(ccc1NCCO)I 34a_100000184554_100000211926 [0,2,0,0,0,0|2,0,0]=4 13932 B12R1.69 Cc1cc(ccc1NCCO)I 7a_100000184554_100000211926 [0,2,0,0,0,0|2,0,0]=4 13933 B12R1.69 Cc1cc(ccc1NCCO)O 34a_100000756630_100000211926 [0,2,0,0,0,0|2,0,0]=4 13934 B12R1.69 Cc1cc(ccc1OCCF)Br 34a_100000186361_100011217306 [0,2,0,0,0,0|2,0,0]=4 13935 B12R1.69 Cc1cc(ccc1OCCF)Br 7a_100000186361_100011217306 [0,2,0,0,0,0|2,0,0]=4 13936 B12R1.69 Cc1cc(ccc1OCCF)Cl 34a_100000211091_100011217306 [0,2,0,0,0,0|2,0,0]=4 13937 B12R1.69 Cc1cc(ccc1OCCF)Cl 7a_100000211091_100011217306 [0,2,0,0,0,0|2,0,0]=4 13938 B12R1.69 Cc1cc(ccc1OCCF)F 34a_100000764316_100011217306 [0,2,0,0,0,0|2,0,0]=4 13939 B12R1.69 Cc1cc(ccc1OCCF)F 7a_100000764316_100011217306 [0,2,0,0,0,0|2,0,0]=4 13940 B12R1.69 Cc1cc(ccc1OCCF)I 34a_100011218673_100011217306 [0,2,0,0,0,0|2,0,0]=4 13941 B12R1.69 Cc1cc(ccc1OCCF)I 7a_100011218673_100011217306 [0,2,0,0,0,0|2,0,0]=4 13942 B12R1.69 Cc1cc(ccc1OCCF)N 34a_100011218179_100011217306 [0,2,0,0,0,0|2,0,0]=4 13943 B12R1.69 Cc1cc(ccc1OCCF)N 7a_100011218179_100011217306 [0,2,0,0,0,0|2,0,0]=4 13944 B12R1.69 Cc1cc(ccc1OCCO)Br 34a_100000186361_100000211926 [0,2,0,0,0,0|2,0,0]=4 13945 B12R1.69 Cc1cc(ccc1OCCO)Br 7a_100000186361_100000211926 [0,2,0,0,0,0|2,0,0]=4 13946 B12R1.69 Cc1cc(ccc1OCCO)Cl 34a_100000211091_100000211926 [0,2,0,0,0,0|2,0,0]=4 13947 B12R1.69 Cc1cc(ccc1OCCO)Cl 7a_100000211091_100000211926 [0,2,0,0,0,0|2,0,0]=4 13948 B12R1.69 Cc1cc(ccc1OCCO)F 34a_100000764316_100000211926 [0,2,0,0,0,0|2,0,0]=4 13949 B12R1.69 Cc1cc(ccc1OCCO)F 7a_100000764316_100000211926 [0,2,0,0,0,0|2,0,0]=4 13950 B12R1.69 Cc1cc(ccc1OCCO)I 34a_100011218673_100000211926 [0,2,0,0,0,0|2,0,0]=4 13951 B12R1.69 Cc1cc(ccc1OCCO)I 7a_100011218673_100000211926 [0,2,0,0,0,0|2,0,0]=4 13952 B12R1.69 Cc1cc(ccc1OCCO)N 34a_100011218179_100000211926 [0,2,0,0,0,0|2,0,0]=4 13953 B12R1.69 Cc1cc(ccc1OCCO)N 7a_100011218179_100000211926 [0,2,0,0,0,0|2,0,0]=4 13954 B12R1.69 Cc1cc(ccc1SCCF)Br 62a_100000701812_100011217306 [0,2,0,0,0,0|2,0,0]=4 13955 B12R1.69 Cc1cc(ccc1SCCF)Br 62a_100011217306_100000701812 [0,2,0,0,0,0|2,0,0]=4 13956 B12R1.69 Cc1cc(ccc1SCCF)Cl 62a_100011217306_100011219607 [0,2,0,0,0,0|2,0,0]=4 13957 B12R1.69 Cc1cc(ccc1SCCF)Cl 62a_100011219607_100011217306 [0,2,0,0,0,0|2,0,0]=4 13958 B12R1.69 Cc1cc(ccc1SCCF)F 62a_100011205405_100011217306 [0,2,0,0,0,0|2,0,0]=4 13959 B12R1.69 Cc1cc(ccc1SCCF)F 62a_100011217306_100011205405 [0,2,0,0,0,0|2,0,0]=4 13960 B12R1.69 Cc1cc(ccc1SCCF)N 62a_100000210723_100011217306 [0,2,0,0,0,0|2,0,0]=4 13961 B12R1.69 Cc1cc(ccc1SCCF)N 62a_100011217306_100000210723 [0,2,0,0,0,0|2,0,0]=4 13962 B12R1.69 Cc1cc(ccc1SCCF)O 62a_100011217306_100000690111 [0,2,0,0,0,0|2,0,0]=4 13963 B12R1.69 Cc1cc(ccc1SCCO)Br 62a_100000211926_100000701812 [0,2,0,0,0,0|2,0,0]=4 13964 B12R1.69 Cc1cc(ccc1SCCO)Br 62a_100000701812_100000211926 [0,2,0,0,0,0|2,0,0]=4 13965 B12R1.69 Cc1cc(ccc1SCCO)Cl 62a_100000211926_100011219607 [0,2,0,0,0,0|2,0,0]=4 13966 B12R1.69 Cc1cc(ccc1SCCO)Cl 62a_100011219607_100000211926 [0,2,0,0,0,0|2,0,0]=4 13967 B12R1.69 Cc1cc(ccc1SCCO)F 62a_100000211926_100011205405 [0,2,0,0,0,0|2,0,0]=4 13968 B12R1.69 Cc1cc(ccc1SCCO)F 62a_100011205405_100000211926 [0,2,0,0,0,0|2,0,0]=4 13969 B12R1.69 Cc1cc(ccc1SCCO)N 62a_100000210723_100000211926 [0,2,0,0,0,0|2,0,0]=4 13970 B12R1.69 Cc1cc(ccc1SCCO)N 62a_100000211926_100000210723 [0,2,0,0,0,0|2,0,0]=4 13971 B12R1.69 Cc1cc(ccc1SCCO)O 62a_100000211926_100000690111 [0,2,0,0,0,0|2,0,0]=4 13972 B12R1.69 Cc1ccc(c(c1)Br)NCCF 34a_100000210942_100011217306 [0,2,0,0,0,0|2,0,0]=4 13973 B12R1.69 Cc1ccc(c(c1)Br)NCCO 34a_100000210942_100000211926 [0,2,0,0,0,0|2,0,0]=4 13974 B12R1.69 Cc1ccc(c(c1)Br)OCCF 34a_100000210800_100011217306 [0,2,0,0,0,0|2,0,0]=4 13975 B12R1.69 Cc1ccc(c(c1)Br)OCCF 7a_100000210800_100011217306 [0,2,0,0,0,0|2,0,0]=4 13976 B12R1.69 Cc1ccc(c(c1)Br)OCCO 34a_100000210800_100000211926 [0,2,0,0,0,0|2,0,0]=4 13977 B12R1.69 Cc1ccc(c(c1)Br)OCCO 7a_100000210800_100000211926 [0,2,0,0,0,0|2,0,0]=4 13978 B12R1.69 Cc1ccc(c(c1)Br)SCCF 62a_100009813563_100011217306 [0,2,0,0,0,0|2,0,0]=4 13979 B12R1.69 Cc1ccc(c(c1)Br)SCCF 62a_100011217306_100009813563 [0,2,0,0,0,0|2,0,0]=4 13980 B12R1.69 Cc1ccc(c(c1)Br)SCCO 62a_100000211926_100009813563 [0,2,0,0,0,0|2,0,0]=4 13981 B12R1.69 Cc1ccc(c(c1)Br)SCCO 62a_100009813563_100000211926 [0,2,0,0,0,0|2,0,0]=4 13982 B12R1.69 Cc1ccc(c(c1)C)CCN[13CH3] 2230a_100000745621_200025704644 [0,2,0,0,0,0|1,0,0]=3 13983 B12R1.69 Cc1ccc(c(c1)C)CCN[13CH3] 34a_100000745621_200025704644 [0,2,0,0,0,0|1,0,0]=3 13984 B12R1.69 Cc1ccc(c(c1)C)CNCF 34a_100000737523_100015361967 [0,2,0,0,0,0|2,0,0]=4 13985 B12R1.69 Cc1ccc(c(c1)C)COCF 34a_100011215341_100015361967 [0,2,0,0,0,0|2,0,0]=4 13986 B12R1.69 Cc1ccc(c(c1)C)COCF 7a_100011215341_100015361967 [0,2,0,0,0,0|2,0,0]=4 13987 B12R1.69 Cc1ccc(c(c1)C)CSCF 62a_100011219618_100015361967 [0,2,0,0,0,0|2,0,0]=4 13988 B12R1.69 Cc1ccc(c(c1)C)CSCF 62a_100015361967_100011219618 [0,2,0,0,0,0|2,0,0]=4 13989 B12R1.69 Cc1ccc(c(c1)C)NCCF 34a_100000736561_100011217306 [0,2,0,0,0,0|2,0,0]=4 13990 B12R1.69 Cc1ccc(c(c1)C)NCCF 7a_100000736561_100011217306 [0,2,0,0,0,0|2,0,0]=4 13991 B12R1.69 Cc1ccc(c(c1)C)NCCO 34a_100000736561_100000211926 [0,2,0,0,0,0|2,0,0]=4 13992 B12R1.69 Cc1ccc(c(c1)C)NCCO 7a_100000736561_100000211926 [0,2,0,0,0,0|2,0,0]=4 13993 B12R1.69 Cc1ccc(c(c1)C)OCCF 34a_100000211776_100011217306 [0,2,0,0,0,0|2,0,0]=4 13994 B12R1.69 Cc1ccc(c(c1)C)OCCF 7a_100000211776_100011217306 [0,2,0,0,0,0|2,0,0]=4 13995 B12R1.69 Cc1ccc(c(c1)C)OCCO 34a_100000211776_100000211926 [0,2,0,0,0,0|2,0,0]=4 13996 B12R1.69 Cc1ccc(c(c1)C)OCCO 7a_100000211776_100000211926 [0,2,0,0,0,0|2,0,0]=4 13997 B12R1.69 Cc1ccc(c(c1)C)SCCF 62a_100011217306_100011217332 [0,2,0,0,0,0|2,0,0]=4 13998 B12R1.69 Cc1ccc(c(c1)C)SCCF 62a_100011217332_100011217306 [0,2,0,0,0,0|2,0,0]=4 13999 B12R1.69 Cc1ccc(c(c1)C)SCCO 62a_100000211926_100011217332 [0,2,0,0,0,0|2,0,0]=4 14000 B12R1.69 Cc1ccc(c(c1)C)SCCO 62a_100011217332_100000211926 [0,2,0,0,0,0|2,0,0]=4 14001 B12R1.69 Cc1ccc(c(c1)Cl)CNCF 34a_100011997539_100015361967 [0,2,0,0,0,0|2,0,0]=4 14002 B12R1.69 Cc1ccc(c(c1)Cl)COCF 34a_100000720314_100015361967 [0,2,0,0,0,0|2,0,0]=4 14003 B12R1.69 Cc1ccc(c(c1)Cl)COCF 7a_100000720314_100015361967 [0,2,0,0,0,0|2,0,0]=4 14004 B12R1.69 Cc1ccc(c(c1)Cl)CSCF 62a_100012349684_100015361967 [0,2,0,0,0,0|2,0,0]=4 14005 B12R1.69 Cc1ccc(c(c1)Cl)CSCF 62a_100015361967_100012349684 [0,2,0,0,0,0|2,0,0]=4 14006 B12R1.69 Cc1ccc(c(c1)Cl)NCCF 34a_100000210522_100011217306 [0,2,0,0,0,0|2,0,0]=4 14007 B12R1.69 Cc1ccc(c(c1)Cl)NCCO 34a_100000210522_100000211926 [0,2,0,0,0,0|2,0,0]=4 14008 B12R1.69 Cc1ccc(c(c1)Cl)OCCF 34a_100000749699_100011217306 [0,2,0,0,0,0|2,0,0]=4 14009 B12R1.69 Cc1ccc(c(c1)Cl)OCCF 7a_100000749699_100011217306 [0,2,0,0,0,0|2,0,0]=4 14010 B12R1.69 Cc1ccc(c(c1)Cl)OCCO 34a_100000749699_100000211926 [0,2,0,0,0,0|2,0,0]=4 14011 B12R1.69 Cc1ccc(c(c1)Cl)OCCO 7a_100000749699_100000211926 [0,2,0,0,0,0|2,0,0]=4 14012 B12R1.69 Cc1ccc(c(c1)Cl)SCCF 62a_100011217306_100011263221 [0,2,0,0,0,0|2,0,0]=4 14013 B12R1.69 Cc1ccc(c(c1)Cl)SCCF 62a_100011263221_100011217306 [0,2,0,0,0,0|2,0,0]=4 14014 B12R1.69 Cc1ccc(c(c1)Cl)SCCO 62a_100000211926_100011263221 [0,2,0,0,0,0|2,0,0]=4 14015 B12R1.69 Cc1ccc(c(c1)Cl)SCCO 62a_100011263221_100000211926 [0,2,0,0,0,0|2,0,0]=4 14016 B12R1.69 Cc1ccc(c(c1)F)CNCF 34a_100102887089_100015361967 [0,2,0,0,0,0|2,0,0]=4 14017 B12R1.69 Cc1ccc(c(c1)F)COCF 34a_100011216587_100015361967 [0,2,0,0,0,0|2,0,0]=4 14018 B12R1.69 Cc1ccc(c(c1)F)COCF 7a_100011216587_100015361967 [0,2,0,0,0,0|2,0,0]=4 14019 B12R1.69 Cc1ccc(c(c1)F)CSCF 62a_100011217900_100015361967 [0,2,0,0,0,0|2,0,0]=4 14020 B12R1.69 Cc1ccc(c(c1)F)CSCF 62a_100015361967_100011217900 [0,2,0,0,0,0|2,0,0]=4 14021 B12R1.69 Cc1ccc(c(c1)F)NCCF 34a_100000211023_100011217306 [0,2,0,0,0,0|2,0,0]=4 14022 B12R1.69 Cc1ccc(c(c1)F)NCCO 34a_100000211023_100000211926 [0,2,0,0,0,0|2,0,0]=4 14023 B12R1.69 Cc1ccc(c(c1)F)OCCF 34a_100011216688_100011217306 [0,2,0,0,0,0|2,0,0]=4 14024 B12R1.69 Cc1ccc(c(c1)F)OCCF 7a_100011216688_100011217306 [0,2,0,0,0,0|2,0,0]=4 14025 B12R1.69 Cc1ccc(c(c1)F)OCCO 34a_100011216688_100000211926 [0,2,0,0,0,0|2,0,0]=4 14026 B12R1.69 Cc1ccc(c(c1)F)OCCO 7a_100011216688_100000211926 [0,2,0,0,0,0|2,0,0]=4 14027 B12R1.69 Cc1ccc(c(c1)F)SCCF 62a_100011216119_100011217306 [0,2,0,0,0,0|2,0,0]=4 14028 B12R1.69 Cc1ccc(c(c1)F)SCCF 62a_100011217306_100011216119 [0,2,0,0,0,0|2,0,0]=4 14029 B12R1.69 Cc1ccc(c(c1)F)SCCO 62a_100000211926_100011216119 [0,2,0,0,0,0|2,0,0]=4 14030 B12R1.69 Cc1ccc(c(c1)F)SCCO 62a_100011216119_100000211926 [0,2,0,0,0,0|2,0,0]=4 14031 B12R1.69 Cc1ccc(c(c1)I)NCCF 34a_100011356834_100011217306 [0,2,0,0,0,0|2,0,0]=4 14032 B12R1.69 Cc1ccc(c(c1)I)NCCO 34a_100011356834_100000211926 [0,2,0,0,0,0|2,0,0]=4 14033 B12R1.69 Cc1ccc(c(c1)I)OCCF 34a_100000765521_100011217306 [0,2,0,0,0,0|2,0,0]=4 14034 B12R1.69 Cc1ccc(c(c1)I)OCCF 7a_100000765521_100011217306 [0,2,0,0,0,0|2,0,0]=4 14035 B12R1.69 Cc1ccc(c(c1)I)OCCO 34a_100000765521_100000211926 [0,2,0,0,0,0|2,0,0]=4 14036 B12R1.69 Cc1ccc(c(c1)I)OCCO 7a_100000765521_100000211926 [0,2,0,0,0,0|2,0,0]=4 14037 B12R1.69 Cc1ccc(c(c1)N)COCF 34a_100000087799_100015361967 [0,2,0,0,0,0|2,0,0]=4 14038 B12R1.69 Cc1ccc(c(c1)N)COCF 7a_100000087799_100015361967 [0,2,0,0,0,0|2,0,0]=4 14039 B12R1.69 Cc1ccc(c(c1)N)OCCF 34a_100011215204_100011217306 [0,2,0,0,0,0|2,0,0]=4 14040 B12R1.69 Cc1ccc(c(c1)N)OCCF 7a_100011215204_100011217306 [0,2,0,0,0,0|2,0,0]=4 14041 B12R1.69 Cc1ccc(c(c1)N)OCCO 34a_100011215204_100000211926 [0,2,0,0,0,0|2,0,0]=4 14042 B12R1.69 Cc1ccc(c(c1)N)OCCO 7a_100011215204_100000211926 [0,2,0,0,0,0|2,0,0]=4 14043 B12R1.69 Cc1ccc(c(c1)N)SCCF 62a_100011216686_100011217306 [0,2,0,0,0,0|2,0,0]=4 14044 B12R1.69 Cc1ccc(c(c1)N)SCCF 62a_100011217306_100011216686 [0,2,0,0,0,0|2,0,0]=4 14045 B12R1.69 Cc1ccc(c(c1)N)SCCO 62a_100000211926_100011216686 [0,2,0,0,0,0|2,0,0]=4 14046 B12R1.69 Cc1ccc(c(c1)N)SCCO 62a_100011216686_100000211926 [0,2,0,0,0,0|2,0,0]=4 14047 B12R1.69 Cc1ccc(c(c1)O)NCC=O 34a_100000211527_200009817547 [0,2,0,0,0,0|1,0,1]=4 14048 B12R1.69 Cc1ccc(c(c1)O)NCCF 34a_100000211527_100011217306 [0,2,0,0,0,0|1,0,0]=3 14049 B12R1.69 Cc1ccc(c(c1)O)NCCO 34a_100000211527_100000211926 [0,2,0,0,0,0|1,0,0]=3 14050 B12R1.69 Cc1ccc(c(c1)O)OCCN 271570a_203496583355_100025744979 [0,2,0,0,0,0|1,0,0]=3 14051 B12R1.69 Cc1ccc(c(c1)O)SCC#N 62a_100011215382_100012002257 [0,2,0,0,0,0|1,0,1]=4 14052 B12R1.69 Cc1ccc(c(c1)O)SCC#N 62a_100012002257_100011215382 [0,2,0,0,0,0|1,0,1]=4 14053 B12R1.69 Cc1ccc(c(c1)O)SCC=O 62a_100012002257_200015260668 [0,2,0,0,0,0|1,0,1]=4 14054 B12R1.69 Cc1ccc(c(c1)O)SCC=O 62a_200015260668_100012002257 [0,2,0,0,0,0|1,0,1]=4 14055 B12R1.69 Cc1ccc(c(c1)O)SCCF 62a_100011217306_100012002257 [0,2,0,0,0,0|1,0,0]=3 14056 B12R1.69 Cc1ccc(c(c1)O)SCCF 62a_100012002257_100011217306 [0,2,0,0,0,0|1,0,0]=3 14057 B12R1.69 Cc1ccc(c(c1)O)SCCO 62a_100000211926_100012002257 [0,2,0,0,0,0|1,0,0]=3 14058 B12R1.69 Cc1ccc(c(c1)O)SCCO 62a_100012002257_100000211926 [0,2,0,0,0,0|1,0,0]=3 14059 B12R1.69 Cc1ccc(c(n1)O)SCCF 62a_100009817604_100011217306 [0,2,0,0,0,0|2,0,0]=4 14060 B12R1.69 Cc1ccc(c(n1)O)SCCF 62a_100011217306_100009817604 [0,2,0,0,0,0|2,0,0]=4 14061 B12R1.69 Cc1ccc(c(n1)O)SCCO 62a_100000211926_100009817604 [0,2,0,0,0,0|2,0,0]=4 14062 B12R1.69 Cc1ccc(c(n1)O)SCCO 62a_100009817604_100000211926 [0,2,0,0,0,0|2,0,0]=4 14063 B12R1.69 Cc1cnc(c(c1)O)SCCF 62a_100011217306_100012000487 [0,2,0,0,0,0|2,0,0]=4 14064 B12R1.69 Cc1cnc(c(c1)O)SCCO 62a_100000211926_100012000487 [0,2,0,0,0,0|2,0,0]=4 14065 B12R1.69 FCCNc1ccc(cc1Br)Br 34a_100000211012_100011217306 [0,2,0,0,0,0|2,0,0]=4 14066 B12R1.69 FCCNc1ccc(cc1Br)Cl 34a_100000752454_100011217306 [0,2,0,0,0,0|2,0,0]=4 14067 B12R1.69 FCCNc1ccc(cc1Br)F 34a_100000738039_100011217306 [0,2,0,0,0,0|2,0,0]=4 14068 B12R1.69 FCCNc1ccc(cc1Cl)Br 34a_100000211467_100011217306 [0,2,0,0,0,0|2,0,0]=4 14069 B12R1.69 FCCNc1ccc(cc1Cl)Cl 34a_100000185861_100011217306 [0,2,0,0,0,0|2,0,0]=4 14070 B12R1.69 FCCNc1ccc(cc1Cl)F 34a_100000212003_100011217306 [0,2,0,0,0,0|2,0,0]=4 14071 B12R1.69 FCCNc1ccc(cc1Cl)I 34a_100011218065_100011217306 [0,2,0,0,0,0|2,0,0]=4 14072 B12R1.69 FCCNc1ccc(cc1F)Br 34a_100000210722_100011217306 [0,2,0,0,0,0|2,0,0]=4 14073 B12R1.69 FCCNc1ccc(cc1F)Cl 34a_100000211020_100011217306 [0,2,0,0,0,0|2,0,0]=4 14074 B12R1.69 FCCNc1ccc(cc1F)F 34a_100000210720_100011217306 [0,2,0,0,0,0|2,0,0]=4 14075 B12R1.69 FCCNc1ccc(cc1F)I 34a_100011215594_100011217306 [0,2,0,0,0,0|2,0,0]=4 14076 B12R1.69 FCCNc1ccc(cc1I)Br 34a_100000187925_100011217306 [0,2,0,0,0,0|2,0,0]=4 14077 B12R1.69 FCCNc1ccc(cc1I)Cl 34a_100000761889_100011217306 [0,2,0,0,0,0|2,0,0]=4 14078 B12R1.69 FCCNc1ccc(cc1I)F 34a_100000760547_100011217306 [0,2,0,0,0,0|2,0,0]=4 14079 B12R1.69 FCCOc1ccc(cc1Br)Br 34a_100000188717_100011217306 [0,2,0,0,0,0|2,0,0]=4 14080 B12R1.69 FCCOc1ccc(cc1Br)Br 7a_100000188717_100011217306 [0,2,0,0,0,0|2,0,0]=4 14081 B12R1.69 FCCOc1ccc(cc1Br)Cl 34a_100000211998_100011217306 [0,2,0,0,0,0|2,0,0]=4 14082 B12R1.69 FCCOc1ccc(cc1Br)Cl 7a_100000211998_100011217306 [0,2,0,0,0,0|2,0,0]=4 14083 B12R1.69 FCCOc1ccc(cc1Br)F 34a_100000211999_100011217306 [0,2,0,0,0,0|2,0,0]=4 14084 B12R1.69 FCCOc1ccc(cc1Br)F 7a_100000211999_100011217306 [0,2,0,0,0,0|2,0,0]=4 14085 B12R1.69 FCCOc1ccc(cc1Br)I 34a_100012361655_100011217306 [0,2,0,0,0,0|2,0,0]=4 14086 B12R1.69 FCCOc1ccc(cc1Br)I 7a_100012361655_100011217306 [0,2,0,0,0,0|2,0,0]=4 14087 B12R1.69 FCCOc1ccc(cc1Cl)Br 34a_100000186472_100011217306 [0,2,0,0,0,0|2,0,0]=4 14088 B12R1.69 FCCOc1ccc(cc1Cl)Br 7a_100000186472_100011217306 [0,2,0,0,0,0|2,0,0]=4 14089 B12R1.69 FCCOc1ccc(cc1Cl)Cl 34a_100015191787_100011217306 [0,2,0,0,0,0|2,0,0]=4 14090 B12R1.69 FCCOc1ccc(cc1Cl)Cl 7a_100015191787_100011217306 [0,2,0,0,0,0|2,0,0]=4 14091 B12R1.69 FCCOc1ccc(cc1Cl)F 34a_100000212004_100011217306 [0,2,0,0,0,0|2,0,0]=4 14092 B12R1.69 FCCOc1ccc(cc1Cl)F 7a_100000212004_100011217306 [0,2,0,0,0,0|2,0,0]=4 14093 B12R1.69 FCCOc1ccc(cc1Cl)I 34a_100012360047_100011217306 [0,2,0,0,0,0|2,0,0]=4 14094 B12R1.69 FCCOc1ccc(cc1Cl)I 7a_100012360047_100011217306 [0,2,0,0,0,0|2,0,0]=4 14095 B12R1.69 FCCOc1ccc(cc1F)Br 34a_100000185481_100011217306 [0,2,0,0,0,0|2,0,0]=4 14096 B12R1.69 FCCOc1ccc(cc1F)Br 7a_100000185481_100011217306 [0,2,0,0,0,0|2,0,0]=4 14097 B12R1.69 FCCOc1ccc(cc1F)Cl 34a_100000230166_100011217306 [0,2,0,0,0,0|2,0,0]=4 14098 B12R1.69 FCCOc1ccc(cc1F)Cl 7a_100000230166_100011217306 [0,2,0,0,0,0|2,0,0]=4 14099 B12R1.69 FCCOc1ccc(cc1F)F 34a_100000230127_100011217306 [0,2,0,0,0,0|2,0,0]=4 14100 B12R1.69 FCCOc1ccc(cc1F)F 7a_100000230127_100011217306 [0,2,0,0,0,0|2,0,0]=4 14101 B12R1.69 FCCOc1ccc(cc1F)I 34a_100011356965_100011217306 [0,2,0,0,0,0|2,0,0]=4 14102 B12R1.69 FCCOc1ccc(cc1F)I 7a_100011356965_100011217306 [0,2,0,0,0,0|2,0,0]=4 14103 B12R1.69 FCCOc1ccc(cc1I)Br 34a_100012355227_100011217306 [0,2,0,0,0,0|2,0,0]=4 14104 B12R1.69 FCCOc1ccc(cc1I)Br 7a_100012355227_100011217306 [0,2,0,0,0,0|2,0,0]=4 14105 B12R1.69 FCCOc1ccc(cc1I)Cl 34a_100011356953_100011217306 [0,2,0,0,0,0|2,0,0]=4 14106 B12R1.69 FCCOc1ccc(cc1I)Cl 7a_100011356953_100011217306 [0,2,0,0,0,0|2,0,0]=4 14107 B12R1.69 FCCOc1ccc(cc1I)F 34a_100012355409_100011217306 [0,2,0,0,0,0|2,0,0]=4 14108 B12R1.69 FCCOc1ccc(cc1I)F 7a_100012355409_100011217306 [0,2,0,0,0,0|2,0,0]=4 14109 B12R1.69 FCCOc1ccc(cc1I)I 7a_100010001573_100011217306 [0,2,0,0,0,0|2,0,0]=4 14110 B12R1.69 FCCSc1ccc(cc1Br)Br 62a_100011217306_100011484698 [0,2,0,0,0,0|2,0,0]=4 14111 B12R1.69 FCCSc1ccc(cc1Br)Br 62a_100011484698_100011217306 [0,2,0,0,0,0|2,0,0]=4 14112 B12R1.69 FCCSc1ccc(cc1Br)Cl 62a_100011217306_100011219703 [0,2,0,0,0,0|2,0,0]=4 14113 B12R1.69 FCCSc1ccc(cc1Br)Cl 62a_100011219703_100011217306 [0,2,0,0,0,0|2,0,0]=4 14114 B12R1.69 FCCSc1ccc(cc1Br)F 62a_100011217111_100011217306 [0,2,0,0,0,0|2,0,0]=4 14115 B12R1.69 FCCSc1ccc(cc1Br)F 62a_100011217306_100011217111 [0,2,0,0,0,0|2,0,0]=4 14116 B12R1.69 FCCSc1ccc(cc1Cl)Br 62a_100011216062_100011217306 [0,2,0,0,0,0|2,0,0]=4 14117 B12R1.69 FCCSc1ccc(cc1Cl)Br 62a_100011217306_100011216062 [0,2,0,0,0,0|2,0,0]=4 14118 B12R1.69 FCCSc1ccc(cc1Cl)Cl 62a_100000699841_100011217306 [0,2,0,0,0,0|2,0,0]=4 14119 B12R1.69 FCCSc1ccc(cc1Cl)Cl 62a_100011217306_100000699841 [0,2,0,0,0,0|2,0,0]=4 14120 B12R1.69 FCCSc1ccc(cc1Cl)F 62a_100000733362_100011217306 [0,2,0,0,0,0|2,0,0]=4 14121 B12R1.69 FCCSc1ccc(cc1Cl)F 62a_100011217306_100000733362 [0,2,0,0,0,0|2,0,0]=4 14122 B12R1.69 FCCSc1ccc(cc1F)Br 62a_100009814013_100011217306 [0,2,0,0,0,0|2,0,0]=4 14123 B12R1.69 FCCSc1ccc(cc1F)Br 62a_100011217306_100009814013 [0,2,0,0,0,0|2,0,0]=4 14124 B12R1.69 FCCSc1ccc(cc1F)Cl 62a_100011216042_100011217306 [0,2,0,0,0,0|2,0,0]=4 14125 B12R1.69 FCCSc1ccc(cc1F)Cl 62a_100011217306_100011216042 [0,2,0,0,0,0|2,0,0]=4 14126 B12R1.69 FCCSc1ccc(cc1F)F 62a_100000750030_100011217306 [0,2,0,0,0,0|2,0,0]=4 14127 B12R1.69 FCCSc1ccc(cc1F)F 62a_100011217306_100000750030 [0,2,0,0,0,0|2,0,0]=4 14128 B12R1.69 FCNCc1ccc(cc1Br)Cl 34a_100102692131_100015361967 [0,2,0,0,0,0|2,0,0]=4 14129 B12R1.69 FCNCc1ccc(cc1Br)F 34a_100000708791_100015361967 [0,2,0,0,0,0|2,0,0]=4 14130 B12R1.69 FCNCc1ccc(cc1Cl)Br 34a_100020628970_100015361967 [0,2,0,0,0,0|2,0,0]=4 14131 B12R1.69 FCNCc1ccc(cc1Cl)Cl 34a_100000174880_100015361967 [0,2,0,0,0,0|2,0,0]=4 14132 B12R1.69 FCNCc1ccc(cc1Cl)F 34a_100000174946_100015361967 [0,2,0,0,0,0|2,0,0]=4 14133 B12R1.69 FCNCc1ccc(cc1F)Br 34a_100000754580_100015361967 [0,2,0,0,0,0|2,0,0]=4 14134 B12R1.69 FCNCc1ccc(cc1F)Cl 34a_100000708496_100015361967 [0,2,0,0,0,0|2,0,0]=4 14135 B12R1.69 FCNCc1ccc(cc1F)F 34a_100000737868_100015361967 [0,2,0,0,0,0|2,0,0]=4 14136 B12R1.69 FCOCc1ccc(cc1Br)Br 34a_100012357508_100015361967 [0,2,0,0,0,0|2,0,0]=4 14137 B12R1.69 FCOCc1ccc(cc1Br)Br 7a_100012357508_100015361967 [0,2,0,0,0,0|2,0,0]=4 14138 B12R1.69 FCOCc1ccc(cc1Br)Cl 34a_100000707881_100015361967 [0,2,0,0,0,0|2,0,0]=4 14139 B12R1.69 FCOCc1ccc(cc1Br)Cl 7a_100000707881_100015361967 [0,2,0,0,0,0|2,0,0]=4 14140 B12R1.69 FCOCc1ccc(cc1Br)F 34a_100000744086_100015361967 [0,2,0,0,0,0|2,0,0]=4 14141 B12R1.69 FCOCc1ccc(cc1Br)F 7a_100000744086_100015361967 [0,2,0,0,0,0|2,0,0]=4 14142 B12R1.69 FCOCc1ccc(cc1Br)I 7a_100010240206_100015361967 [0,2,0,0,0,0|2,0,0]=4 14143 B12R1.69 FCOCc1ccc(cc1Cl)Br 34a_100000756401_100015361967 [0,2,0,0,0,0|2,0,0]=4 14144 B12R1.69 FCOCc1ccc(cc1Cl)Br 7a_100000756401_100015361967 [0,2,0,0,0,0|2,0,0]=4 14145 B12R1.69 FCOCc1ccc(cc1Cl)Cl 34a_100000215721_100015361967 [0,2,0,0,0,0|2,0,0]=4 14146 B12R1.69 FCOCc1ccc(cc1Cl)Cl 7a_100000215721_100015361967 [0,2,0,0,0,0|2,0,0]=4 14147 B12R1.69 FCOCc1ccc(cc1Cl)F 34a_100011219954_100015361967 [0,2,0,0,0,0|2,0,0]=4 14148 B12R1.69 FCOCc1ccc(cc1Cl)F 7a_100011219954_100015361967 [0,2,0,0,0,0|2,0,0]=4 14149 B12R1.69 FCOCc1ccc(cc1F)Br 34a_100011191541_100015361967 [0,2,0,0,0,0|2,0,0]=4 14150 B12R1.69 FCOCc1ccc(cc1F)Br 7a_100011191541_100015361967 [0,2,0,0,0,0|2,0,0]=4 14151 B12R1.69 FCOCc1ccc(cc1F)Cl 34a_100011217562_100015361967 [0,2,0,0,0,0|2,0,0]=4 14152 B12R1.69 FCOCc1ccc(cc1F)Cl 7a_100011217562_100015361967 [0,2,0,0,0,0|2,0,0]=4 14153 B12R1.69 FCOCc1ccc(cc1F)F 34a_100011215441_100015361967 [0,2,0,0,0,0|2,0,0]=4 14154 B12R1.69 FCOCc1ccc(cc1F)F 7a_100011215441_100015361967 [0,2,0,0,0,0|2,0,0]=4 14155 B12R1.69 FCOCc1ccc(cc1F)I 34a_200010202041_100015361967 [0,2,0,0,0,0|2,0,0]=4 14156 B12R1.69 FCOCc1ccc(cc1F)I 7a_200010202041_100015361967 [0,2,0,0,0,0|2,0,0]=4 14157 B12R1.69 FCOCc1ccc(cc1I)Br 7a_100010146605_100015361967 [0,2,0,0,0,0|2,0,0]=4 14158 B12R1.69 FCOCc1ccc(cc1I)Cl 34a_100000722340_100015361967 [0,2,0,0,0,0|2,0,0]=4 14159 B12R1.69 FCOCc1ccc(cc1I)Cl 7a_100000722340_100015361967 [0,2,0,0,0,0|2,0,0]=4 14160 B12R1.69 FCOCc1ccc(cc1I)F 34a_100011356828_100015361967 [0,2,0,0,0,0|2,0,0]=4 14161 B12R1.69 FCOCc1ccc(cc1I)F 7a_100011356828_100015361967 [0,2,0,0,0,0|2,0,0]=4 14162 B12R1.69 FCSCc1ccc(cc1Br)Br 62a_100015361967_200012351560 [0,2,0,0,0,0|2,0,0]=4 14163 B12R1.69 FCSCc1ccc(cc1Br)Br 62a_200012351560_100015361967 [0,2,0,0,0,0|2,0,0]=4 14164 B12R1.69 FCSCc1ccc(cc1Br)Cl 62a_100000755608_100015361967 [0,2,0,0,0,0|2,0,0]=4 14165 B12R1.69 FCSCc1ccc(cc1Br)Cl 62a_100015361967_100000755608 [0,2,0,0,0,0|2,0,0]=4 14166 B12R1.69 FCSCc1ccc(cc1Br)F 62a_100000243222_100015361967 [0,2,0,0,0,0|2,0,0]=4 14167 B12R1.69 FCSCc1ccc(cc1Br)F 62a_100015361967_100000243222 [0,2,0,0,0,0|2,0,0]=4 14168 B12R1.69 FCSCc1ccc(cc1Br)I 62a_100010146610_100015361967 [0,2,0,0,0,0|2,0,0]=4 14169 B12R1.69 FCSCc1ccc(cc1Br)I 62a_100015361967_100010146610 [0,2,0,0,0,0|2,0,0]=4 14170 B12R1.69 FCSCc1ccc(cc1Cl)Br 62a_100011740631_100015361967 [0,2,0,0,0,0|2,0,0]=4 14171 B12R1.69 FCSCc1ccc(cc1Cl)Br 62a_100015361967_100011740631 [0,2,0,0,0,0|2,0,0]=4 14172 B12R1.69 FCSCc1ccc(cc1Cl)Cl 62a_100000188473_100015361967 [0,2,0,0,0,0|2,0,0]=4 14173 B12R1.69 FCSCc1ccc(cc1Cl)Cl 62a_100015361967_100000188473 [0,2,0,0,0,0|2,0,0]=4 14174 B12R1.69 FCSCc1ccc(cc1Cl)F 62a_100000187853_100015361967 [0,2,0,0,0,0|2,0,0]=4 14175 B12R1.69 FCSCc1ccc(cc1Cl)F 62a_100015361967_100000187853 [0,2,0,0,0,0|2,0,0]=4 14176 B12R1.69 FCSCc1ccc(cc1F)Br 62a_100000211606_100015361967 [0,2,0,0,0,0|2,0,0]=4 14177 B12R1.69 FCSCc1ccc(cc1F)Br 62a_100015361967_100000211606 [0,2,0,0,0,0|2,0,0]=4 14178 B12R1.69 FCSCc1ccc(cc1F)Cl 62a_100000709361_100015361967 [0,2,0,0,0,0|2,0,0]=4 14179 B12R1.69 FCSCc1ccc(cc1F)Cl 62a_100015361967_100000709361 [0,2,0,0,0,0|2,0,0]=4 14180 B12R1.69 FCSCc1ccc(cc1F)F 62a_100000748237_100015361967 [0,2,0,0,0,0|2,0,0]=4 14181 B12R1.69 FCSCc1ccc(cc1F)F 62a_100015361967_100000748237 [0,2,0,0,0,0|2,0,0]=4 14182 B12R1.69 FCSCc1ccc(cc1F)I 62a_100010244991_100015361967 [0,2,0,0,0,0|2,0,0]=4 14183 B12R1.69 FCSCc1ccc(cc1F)I 62a_100015361967_100010244991 [0,2,0,0,0,0|2,0,0]=4 14184 B12R1.69 FCSCc1ccc(cc1I)Br 62a_100010146615_100015361967 [0,2,0,0,0,0|2,0,0]=4 14185 B12R1.69 FCSCc1ccc(cc1I)Br 62a_100015361967_100010146615 [0,2,0,0,0,0|2,0,0]=4 14186 B12R1.69 FCSCc1ccc(cc1I)Cl 62a_100010254388_100015361967 [0,2,0,0,0,0|2,0,0]=4 14187 B12R1.69 FCSCc1ccc(cc1I)Cl 62a_100015361967_100010254388 [0,2,0,0,0,0|2,0,0]=4 14188 B12R1.69 FCSCc1ccc(cc1I)F 62a_100012354799_100015361967 [0,2,0,0,0,0|2,0,0]=4 14189 B12R1.69 FCSCc1ccc(cc1I)F 62a_100015361967_100012354799 [0,2,0,0,0,0|2,0,0]=4 14190 B12R1.69 N#CCSc1ccc(cc1O)Br 62a_100011215382_100012344904 [0,2,0,0,0,0|1,0,1]=4 14191 B12R1.69 N#CCSc1ccc(cc1O)Br 62a_100012344904_100011215382 [0,2,0,0,0,0|1,0,1]=4 14192 B12R1.69 N#CCSc1ccc(cc1O)Cl 62a_100000050036_100011215382 [0,2,0,0,0,0|1,0,1]=4 14193 B12R1.69 N#CCSc1ccc(cc1O)Cl 62a_100011215382_100000050036 [0,2,0,0,0,0|1,0,1]=4 14194 B12R1.69 N#CCSc1ccc(cc1O)F 62a_100000690578_100011215382 [0,2,0,0,0,0|1,0,1]=4 14195 B12R1.69 N#CCSc1ccc(cc1O)F 62a_100011215382_100000690578 [0,2,0,0,0,0|1,0,1]=4 14196 B12R1.69 N#CCSc1ccc(cc1O)O 62a_100011215382_100009813921 [0,2,0,0,0,0|1,0,1]=4 14197 B12R1.69 Nc1cc(ccc1COCF)Br 34a_100000718831_100015361967 [0,2,0,0,0,0|2,0,0]=4 14198 B12R1.69 Nc1cc(ccc1COCF)Br 7a_100000718831_100015361967 [0,2,0,0,0,0|2,0,0]=4 14199 B12R1.69 Nc1cc(ccc1COCF)Cl 34a_100000238622_100015361967 [0,2,0,0,0,0|2,0,0]=4 14200 B12R1.69 Nc1cc(ccc1COCF)Cl 7a_100000238622_100015361967 [0,2,0,0,0,0|2,0,0]=4 14201 B12R1.69 Nc1cc(ccc1COCF)F 34a_100011996588_100015361967 [0,2,0,0,0,0|2,0,0]=4 14202 B12R1.69 Nc1cc(ccc1OCCF)Br 34a_100000752626_100011217306 [0,2,0,0,0,0|2,0,0]=4 14203 B12R1.69 Nc1cc(ccc1OCCF)Br 7a_100000752626_100011217306 [0,2,0,0,0,0|2,0,0]=4 14204 B12R1.69 Nc1cc(ccc1OCCF)Cl 34a_100000210500_100011217306 [0,2,0,0,0,0|2,0,0]=4 14205 B12R1.69 Nc1cc(ccc1OCCF)Cl 7a_100000210500_100011217306 [0,2,0,0,0,0|2,0,0]=4 14206 B12R1.69 Nc1cc(ccc1OCCF)F 34a_100000759472_100011217306 [0,2,0,0,0,0|2,0,0]=4 14207 B12R1.69 Nc1cc(ccc1OCCF)F 7a_100000759472_100011217306 [0,2,0,0,0,0|2,0,0]=4 14208 B12R1.69 Nc1cc(ccc1OCCF)I 34a_100000753495_100011217306 [0,2,0,0,0,0|2,0,0]=4 14209 B12R1.69 Nc1cc(ccc1OCCF)I 7a_100000753495_100011217306 [0,2,0,0,0,0|2,0,0]=4 14210 B12R1.69 Nc1cc(ccc1OCCO)Br 34a_100000752626_100000211926 [0,2,0,0,0,0|2,0,0]=4 14211 B12R1.69 Nc1cc(ccc1OCCO)Br 7a_100000752626_100000211926 [0,2,0,0,0,0|2,0,0]=4 14212 B12R1.69 Nc1cc(ccc1OCCO)Cl 34a_100000210500_100000211926 [0,2,0,0,0,0|2,0,0]=4 14213 B12R1.69 Nc1cc(ccc1OCCO)Cl 7a_100000210500_100000211926 [0,2,0,0,0,0|2,0,0]=4 14214 B12R1.69 Nc1cc(ccc1OCCO)F 34a_100000759472_100000211926 [0,2,0,0,0,0|2,0,0]=4 14215 B12R1.69 Nc1cc(ccc1OCCO)F 7a_100000759472_100000211926 [0,2,0,0,0,0|2,0,0]=4 14216 B12R1.69 Nc1cc(ccc1OCCO)I 34a_100000753495_100000211926 [0,2,0,0,0,0|2,0,0]=4 14217 B12R1.69 Nc1cc(ccc1OCCO)I 7a_100000753495_100000211926 [0,2,0,0,0,0|2,0,0]=4 14218 B12R1.69 Nc1cc(ccc1SCCF)Br 62a_100000743836_100011217306 [0,2,0,0,0,0|2,0,0]=4 14219 B12R1.69 Nc1cc(ccc1SCCF)Br 62a_100011217306_100000743836 [0,2,0,0,0,0|2,0,0]=4 14220 B12R1.69 Nc1cc(ccc1SCCF)Cl 62a_100000761886_100011217306 [0,2,0,0,0,0|2,0,0]=4 14221 B12R1.69 Nc1cc(ccc1SCCF)Cl 62a_100011217306_100000761886 [0,2,0,0,0,0|2,0,0]=4 14222 B12R1.69 Nc1cc(ccc1SCCF)F 62a_100000687223_100011217306 [0,2,0,0,0,0|2,0,0]=4 14223 B12R1.69 Nc1cc(ccc1SCCF)F 62a_100011217306_100000687223 [0,2,0,0,0,0|2,0,0]=4 14224 B12R1.69 Nc1cc(ccc1SCCF)O 62a_100011217306_100011999798 [0,2,0,0,0,0|2,0,0]=4 14225 B12R1.69 Nc1cc(ccc1SCCF)O 62a_100011999798_100011217306 [0,2,0,0,0,0|2,0,0]=4 14226 B12R1.69 Nc1cc(ccc1SCCO)Br 62a_100000211926_100000743836 [0,2,0,0,0,0|2,0,0]=4 14227 B12R1.69 Nc1cc(ccc1SCCO)Br 62a_100000743836_100000211926 [0,2,0,0,0,0|2,0,0]=4 14228 B12R1.69 Nc1cc(ccc1SCCO)Cl 62a_100000211926_100000761886 [0,2,0,0,0,0|2,0,0]=4 14229 B12R1.69 Nc1cc(ccc1SCCO)Cl 62a_100000761886_100000211926 [0,2,0,0,0,0|2,0,0]=4 14230 B12R1.69 Nc1cc(ccc1SCCO)F 62a_100000211926_100000687223 [0,2,0,0,0,0|2,0,0]=4 14231 B12R1.69 Nc1cc(ccc1SCCO)F 62a_100000687223_100000211926 [0,2,0,0,0,0|2,0,0]=4 14232 B12R1.69 Nc1cc(ccc1SCCO)O 62a_100000211926_100011999798 [0,2,0,0,0,0|2,0,0]=4 14233 B12R1.69 Nc1cc(ccc1SCCO)O 62a_100011999798_100000211926 [0,2,0,0,0,0|2,0,0]=4 14234 B12R1.69 Nc1ccc(c(c1)Br)OCCF 34a_100011534360_100011217306 [0,2,0,0,0,0|2,0,0]=4 14235 B12R1.69 Nc1ccc(c(c1)Br)OCCF 7a_100011534360_100011217306 [0,2,0,0,0,0|2,0,0]=4 14236 B12R1.69 Nc1ccc(c(c1)Br)OCCO 34a_100011534360_100000211926 [0,2,0,0,0,0|2,0,0]=4 14237 B12R1.69 Nc1ccc(c(c1)Br)OCCO 7a_100011534360_100000211926 [0,2,0,0,0,0|2,0,0]=4 14238 B12R1.69 Nc1ccc(c(c1)Br)SCCF 62a_100000750458_100011217306 [0,2,0,0,0,0|2,0,0]=4 14239 B12R1.69 Nc1ccc(c(c1)Br)SCCF 62a_100011217306_100000750458 [0,2,0,0,0,0|2,0,0]=4 14240 B12R1.69 Nc1ccc(c(c1)Br)SCCO 62a_100000211926_100000750458 [0,2,0,0,0,0|2,0,0]=4 14241 B12R1.69 Nc1ccc(c(c1)Br)SCCO 62a_100000750458_100000211926 [0,2,0,0,0,0|2,0,0]=4 14242 B12R1.69 Nc1ccc(c(c1)Cl)COCF 34a_100000689119_100015361967 [0,2,0,0,0,0|2,0,0]=4 14243 B12R1.69 Nc1ccc(c(c1)Cl)OCCF 34a_100000744943_100011217306 [0,2,0,0,0,0|2,0,0]=4 14244 B12R1.69 Nc1ccc(c(c1)Cl)OCCF 7a_100000744943_100011217306 [0,2,0,0,0,0|2,0,0]=4 14245 B12R1.69 Nc1ccc(c(c1)Cl)OCCO 34a_100000744943_100000211926 [0,2,0,0,0,0|2,0,0]=4 14246 B12R1.69 Nc1ccc(c(c1)Cl)OCCO 7a_100000744943_100000211926 [0,2,0,0,0,0|2,0,0]=4 14247 B12R1.69 Nc1ccc(c(c1)Cl)SCCF 62a_100000761885_100011217306 [0,2,0,0,0,0|2,0,0]=4 14248 B12R1.69 Nc1ccc(c(c1)Cl)SCCF 62a_100011217306_100000761885 [0,2,0,0,0,0|2,0,0]=4 14249 B12R1.69 Nc1ccc(c(c1)Cl)SCCO 62a_100000211926_100000761885 [0,2,0,0,0,0|2,0,0]=4 14250 B12R1.69 Nc1ccc(c(c1)Cl)SCCO 62a_100000761885_100000211926 [0,2,0,0,0,0|2,0,0]=4 14251 B12R1.69 Nc1ccc(c(c1)F)OCCF 34a_100011220035_100011217306 [0,2,0,0,0,0|2,0,0]=4 14252 B12R1.69 Nc1ccc(c(c1)F)OCCF 7a_100011220035_100011217306 [0,2,0,0,0,0|2,0,0]=4 14253 B12R1.69 Nc1ccc(c(c1)F)OCCO 34a_100011220035_100000211926 [0,2,0,0,0,0|2,0,0]=4 14254 B12R1.69 Nc1ccc(c(c1)F)OCCO 7a_100011220035_100000211926 [0,2,0,0,0,0|2,0,0]=4 14255 B12R1.69 Nc1ccc(c(c1)F)SCCF 62a_100011217306_100011356925 [0,2,0,0,0,0|2,0,0]=4 14256 B12R1.69 Nc1ccc(c(c1)F)SCCF 62a_100011356925_100011217306 [0,2,0,0,0,0|2,0,0]=4 14257 B12R1.69 Nc1ccc(c(c1)F)SCCO 62a_100000211926_100011356925 [0,2,0,0,0,0|2,0,0]=4 14258 B12R1.69 Nc1ccc(c(c1)F)SCCO 62a_100011356925_100000211926 [0,2,0,0,0,0|2,0,0]=4 14259 B12R1.69 Nc1ccc(c(c1)N)OCCF 34a_100000725306_100011217306 [0,2,0,0,0,0|2,0,0]=4 14260 B12R1.69 Nc1ccc(c(c1)N)OCCO 34a_100000725306_100000211926 [0,2,0,0,0,0|2,0,0]=4 14261 B12R1.69 Nc1ccc(c(c1)N)SCCF 62a_100011217306_200012175722 [0,2,0,0,0,0|2,0,0]=4 14262 B12R1.69 Nc1ccc(c(c1)N)SCCF 62a_200012175722_100011217306 [0,2,0,0,0,0|2,0,0]=4 14263 B12R1.69 Nc1ccc(c(c1)N)SCCO 62a_100000211926_200012175722 [0,2,0,0,0,0|2,0,0]=4 14264 B12R1.69 Nc1ccc(c(c1)N)SCCO 62a_200012175722_100000211926 [0,2,0,0,0,0|2,0,0]=4 14265 B12R1.69 O=CCNc1ccc(cc1O)Br 34a_100000739049_200009817547 [0,2,0,0,0,0|1,0,1]=4 14266 B12R1.69 O=CCNc1ccc(cc1O)Cl 34a_100000185728_200009817547 [0,2,0,0,0,0|1,0,1]=4 14267 B12R1.69 O=CCNc1ccc(cc1O)F 34a_100000753323_200009817547 [0,2,0,0,0,0|1,0,1]=4 14268 B12R1.69 O=CCNc1ccc(cc1O)O 34a_100000106777_200009817547 [0,2,0,0,0,0|1,0,1]=4 14269 B12R1.69 O=CCSc1ccc(cc1O)Br 62a_100012344904_200015260668 [0,2,0,0,0,0|1,0,1]=4 14270 B12R1.69 O=CCSc1ccc(cc1O)Br 62a_200015260668_100012344904 [0,2,0,0,0,0|1,0,1]=4 14271 B12R1.69 O=CCSc1ccc(cc1O)Cl 62a_100000050036_200015260668 [0,2,0,0,0,0|1,0,1]=4 14272 B12R1.69 O=CCSc1ccc(cc1O)Cl 62a_200015260668_100000050036 [0,2,0,0,0,0|1,0,1]=4 14273 B12R1.69 O=CCSc1ccc(cc1O)F 62a_100000690578_200015260668 [0,2,0,0,0,0|1,0,1]=4 14274 B12R1.69 O=CCSc1ccc(cc1O)F 62a_200015260668_100000690578 [0,2,0,0,0,0|1,0,1]=4 14275 B12R1.69 O=CCSc1ccc(cc1O)O 62a_200015260668_100009813921 [0,2,0,0,0,0|1,0,1]=4 14276 B12R1.69 OCCNc1ccc(cc1Br)Br 34a_100000211012_100000211926 [0,2,0,0,0,0|2,0,0]=4 14277 B12R1.69 OCCNc1ccc(cc1Br)Cl 34a_100000752454_100000211926 [0,2,0,0,0,0|2,0,0]=4 14278 B12R1.69 OCCNc1ccc(cc1Br)F 34a_100000738039_100000211926 [0,2,0,0,0,0|2,0,0]=4 14279 B12R1.69 OCCNc1ccc(cc1Br)O 34a_100012001276_100000211926 [0,2,0,0,0,0|2,0,0]=4 14280 B12R1.69 OCCNc1ccc(cc1Cl)Br 34a_100000211467_100000211926 [0,2,0,0,0,0|2,0,0]=4 14281 B12R1.69 OCCNc1ccc(cc1Cl)Cl 34a_100000185861_100000211926 [0,2,0,0,0,0|2,0,0]=4 14282 B12R1.69 OCCNc1ccc(cc1Cl)F 34a_100000212003_100000211926 [0,2,0,0,0,0|2,0,0]=4 14283 B12R1.69 OCCNc1ccc(cc1Cl)I 34a_100011218065_100000211926 [0,2,0,0,0,0|2,0,0]=4 14284 B12R1.69 OCCNc1ccc(cc1Cl)O 34a_100011215599_100000211926 [0,2,0,0,0,0|2,0,0]=4 14285 B12R1.69 OCCNc1ccc(cc1F)Br 34a_100000210722_100000211926 [0,2,0,0,0,0|2,0,0]=4 14286 B12R1.69 OCCNc1ccc(cc1F)Cl 34a_100000211020_100000211926 [0,2,0,0,0,0|2,0,0]=4 14287 B12R1.69 OCCNc1ccc(cc1F)F 34a_100000210720_100000211926 [0,2,0,0,0,0|2,0,0]=4 14288 B12R1.69 OCCNc1ccc(cc1F)I 34a_100011215594_100000211926 [0,2,0,0,0,0|2,0,0]=4 14289 B12R1.69 OCCNc1ccc(cc1F)O 34a_100000759473_100000211926 [0,2,0,0,0,0|2,0,0]=4 14290 B12R1.69 OCCNc1ccc(cc1I)Br 34a_100000187925_100000211926 [0,2,0,0,0,0|2,0,0]=4 14291 B12R1.69 OCCNc1ccc(cc1I)Cl 34a_100000761889_100000211926 [0,2,0,0,0,0|2,0,0]=4 14292 B12R1.69 OCCNc1ccc(cc1I)F 34a_100000760547_100000211926 [0,2,0,0,0,0|2,0,0]=4 14293 B12R1.69 OCCNc1ccc(cc1I)O 34a_100010084370_100000211926 [0,2,0,0,0,0|2,0,0]=4 14294 B12R1.69 OCCNc1ccc(cc1O)Br 34a_100000739049_100000211926 [0,2,0,0,0,0|1,0,0]=3 14295 B12R1.69 OCCNc1ccc(cc1O)Cl 34a_100000185728_100000211926 [0,2,0,0,0,0|1,0,0]=3 14296 B12R1.69 OCCNc1ccc(cc1O)F 34a_100000753323_100000211926 [0,2,0,0,0,0|1,0,0]=3 14297 B12R1.69 OCCNc1ccc(cc1O)O 34a_100000106777_100000211926 [0,2,0,0,0,0|1,0,0]=3 14298 B12R1.69 OCCOc1ccc(cc1Br)Br 34a_100000188717_100000211926 [0,2,0,0,0,0|2,0,0]=4 14299 B12R1.69 OCCOc1ccc(cc1Br)Br 7a_100000188717_100000211926 [0,2,0,0,0,0|2,0,0]=4 14300 B12R1.69 OCCOc1ccc(cc1Br)Cl 34a_100000211998_100000211926 [0,2,0,0,0,0|2,0,0]=4 14301 B12R1.69 OCCOc1ccc(cc1Br)Cl 7a_100000211998_100000211926 [0,2,0,0,0,0|2,0,0]=4 14302 B12R1.69 OCCOc1ccc(cc1Br)F 34a_100000211999_100000211926 [0,2,0,0,0,0|2,0,0]=4 14303 B12R1.69 OCCOc1ccc(cc1Br)F 7a_100000211999_100000211926 [0,2,0,0,0,0|2,0,0]=4 14304 B12R1.69 OCCOc1ccc(cc1Br)I 34a_100012361655_100000211926 [0,2,0,0,0,0|2,0,0]=4 14305 B12R1.69 OCCOc1ccc(cc1Br)I 7a_100012361655_100000211926 [0,2,0,0,0,0|2,0,0]=4 14306 B12R1.69 OCCOc1ccc(cc1Cl)Br 34a_100000186472_100000211926 [0,2,0,0,0,0|2,0,0]=4 14307 B12R1.69 OCCOc1ccc(cc1Cl)Br 7a_100000186472_100000211926 [0,2,0,0,0,0|2,0,0]=4 14308 B12R1.69 OCCOc1ccc(cc1Cl)Cl 34a_100015191787_100000211926 [0,2,0,0,0,0|2,0,0]=4 14309 B12R1.69 OCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000211926 [0,2,0,0,0,0|2,0,0]=4 14310 B12R1.69 OCCOc1ccc(cc1Cl)F 34a_100000212004_100000211926 [0,2,0,0,0,0|2,0,0]=4 14311 B12R1.69 OCCOc1ccc(cc1Cl)F 7a_100000212004_100000211926 [0,2,0,0,0,0|2,0,0]=4 14312 B12R1.69 OCCOc1ccc(cc1Cl)I 34a_100012360047_100000211926 [0,2,0,0,0,0|2,0,0]=4 14313 B12R1.69 OCCOc1ccc(cc1Cl)I 7a_100012360047_100000211926 [0,2,0,0,0,0|2,0,0]=4 14314 B12R1.69 OCCOc1ccc(cc1F)Br 34a_100000185481_100000211926 [0,2,0,0,0,0|2,0,0]=4 14315 B12R1.69 OCCOc1ccc(cc1F)Br 7a_100000185481_100000211926 [0,2,0,0,0,0|2,0,0]=4 14316 B12R1.69 OCCOc1ccc(cc1F)Cl 34a_100000230166_100000211926 [0,2,0,0,0,0|2,0,0]=4 14317 B12R1.69 OCCOc1ccc(cc1F)Cl 7a_100000230166_100000211926 [0,2,0,0,0,0|2,0,0]=4 14318 B12R1.69 OCCOc1ccc(cc1F)F 34a_100000230127_100000211926 [0,2,0,0,0,0|2,0,0]=4 14319 B12R1.69 OCCOc1ccc(cc1F)F 7a_100000230127_100000211926 [0,2,0,0,0,0|2,0,0]=4 14320 B12R1.69 OCCOc1ccc(cc1F)I 34a_100011356965_100000211926 [0,2,0,0,0,0|2,0,0]=4 14321 B12R1.69 OCCOc1ccc(cc1F)I 7a_100011356965_100000211926 [0,2,0,0,0,0|2,0,0]=4 14322 B12R1.69 OCCOc1ccc(cc1I)Br 34a_100012355227_100000211926 [0,2,0,0,0,0|2,0,0]=4 14323 B12R1.69 OCCOc1ccc(cc1I)Br 7a_100012355227_100000211926 [0,2,0,0,0,0|2,0,0]=4 14324 B12R1.69 OCCOc1ccc(cc1I)Cl 34a_100011356953_100000211926 [0,2,0,0,0,0|2,0,0]=4 14325 B12R1.69 OCCOc1ccc(cc1I)Cl 7a_100011356953_100000211926 [0,2,0,0,0,0|2,0,0]=4 14326 B12R1.69 OCCOc1ccc(cc1I)F 34a_100012355409_100000211926 [0,2,0,0,0,0|2,0,0]=4 14327 B12R1.69 OCCOc1ccc(cc1I)F 7a_100012355409_100000211926 [0,2,0,0,0,0|2,0,0]=4 14328 B12R1.69 OCCOc1ccc(cc1I)I 7a_100010001573_100000211926 [0,2,0,0,0,0|2,0,0]=4 14329 B12R1.69 OCCSc1ccc(cc1Br)Br 62a_100000211926_100011484698 [0,2,0,0,0,0|2,0,0]=4 14330 B12R1.69 OCCSc1ccc(cc1Br)Br 62a_100011484698_100000211926 [0,2,0,0,0,0|2,0,0]=4 14331 B12R1.69 OCCSc1ccc(cc1Br)Cl 62a_100000211926_100011219703 [0,2,0,0,0,0|2,0,0]=4 14332 B12R1.69 OCCSc1ccc(cc1Br)Cl 62a_100011219703_100000211926 [0,2,0,0,0,0|2,0,0]=4 14333 B12R1.69 OCCSc1ccc(cc1Br)F 62a_100000211926_100011217111 [0,2,0,0,0,0|2,0,0]=4 14334 B12R1.69 OCCSc1ccc(cc1Br)F 62a_100011217111_100000211926 [0,2,0,0,0,0|2,0,0]=4 14335 B12R1.69 OCCSc1ccc(cc1Br)O 62a_100000211926_100000701344 [0,2,0,0,0,0|2,0,0]=4 14336 B12R1.69 OCCSc1ccc(cc1Br)O 62a_100000701344_100000211926 [0,2,0,0,0,0|2,0,0]=4 14337 B12R1.69 OCCSc1ccc(cc1Cl)Br 62a_100000211926_100011216062 [0,2,0,0,0,0|2,0,0]=4 14338 B12R1.69 OCCSc1ccc(cc1Cl)Br 62a_100011216062_100000211926 [0,2,0,0,0,0|2,0,0]=4 14339 B12R1.69 OCCSc1ccc(cc1Cl)Cl 62a_100000211926_100000699841 [0,2,0,0,0,0|2,0,0]=4 14340 B12R1.69 OCCSc1ccc(cc1Cl)Cl 62a_100000699841_100000211926 [0,2,0,0,0,0|2,0,0]=4 14341 B12R1.69 OCCSc1ccc(cc1Cl)F 62a_100000211926_100000733362 [0,2,0,0,0,0|2,0,0]=4 14342 B12R1.69 OCCSc1ccc(cc1Cl)F 62a_100000733362_100000211926 [0,2,0,0,0,0|2,0,0]=4 14343 B12R1.69 OCCSc1ccc(cc1Cl)O 62a_100000047559_100000211926 [0,2,0,0,0,0|2,0,0]=4 14344 B12R1.69 OCCSc1ccc(cc1Cl)O 62a_100000211926_100000047559 [0,2,0,0,0,0|2,0,0]=4 14345 B12R1.69 OCCSc1ccc(cc1F)Br 62a_100000211926_100009814013 [0,2,0,0,0,0|2,0,0]=4 14346 B12R1.69 OCCSc1ccc(cc1F)Br 62a_100009814013_100000211926 [0,2,0,0,0,0|2,0,0]=4 14347 B12R1.69 OCCSc1ccc(cc1F)Cl 62a_100000211926_100011216042 [0,2,0,0,0,0|2,0,0]=4 14348 B12R1.69 OCCSc1ccc(cc1F)Cl 62a_100011216042_100000211926 [0,2,0,0,0,0|2,0,0]=4 14349 B12R1.69 OCCSc1ccc(cc1F)F 62a_100000211926_100000750030 [0,2,0,0,0,0|2,0,0]=4 14350 B12R1.69 OCCSc1ccc(cc1F)F 62a_100000750030_100000211926 [0,2,0,0,0,0|2,0,0]=4 14351 B12R1.69 OCCSc1ccc(cc1F)O 62a_100000211926_100000755031 [0,2,0,0,0,0|2,0,0]=4 14352 B12R1.69 OCCSc1ccc(cc1F)O 62a_100000755031_100000211926 [0,2,0,0,0,0|2,0,0]=4 14353 B12R1.69 OCCSc1ccc(cc1O)Br 62a_100000211926_100012344904 [0,2,0,0,0,0|1,0,0]=3 14354 B12R1.69 OCCSc1ccc(cc1O)Br 62a_100012344904_100000211926 [0,2,0,0,0,0|1,0,0]=3 14355 B12R1.69 OCCSc1ccc(cc1O)Cl 62a_100000050036_100000211926 [0,2,0,0,0,0|1,0,0]=3 14356 B12R1.69 OCCSc1ccc(cc1O)Cl 62a_100000211926_100000050036 [0,2,0,0,0,0|1,0,0]=3 14357 B12R1.69 OCCSc1ccc(cc1O)F 62a_100000211926_100000690578 [0,2,0,0,0,0|1,0,0]=3 14358 B12R1.69 OCCSc1ccc(cc1O)F 62a_100000690578_100000211926 [0,2,0,0,0,0|1,0,0]=3 14359 B12R1.69 OCCSc1ccc(cc1O)O 62a_100000211926_100009813921 [0,2,0,0,0,0|1,0,0]=3 14360 B12R1.69 OCCSc1ncc(cc1O)Br 62a_100000211926_100010210634 [0,2,0,0,0,0|2,0,0]=4 14361 B12R1.69 OCCSc1ncc(cc1O)Br 62a_100010210634_100000211926 [0,2,0,0,0,0|2,0,0]=4 14362 B12R1.69 OCCSc1ncc(cc1O)Cl 62a_100000211926_100010233512 [0,2,0,0,0,0|2,0,0]=4 14363 B12R1.69 OCCSc1ncc(cc1O)Cl 62a_100010233512_100000211926 [0,2,0,0,0,0|2,0,0]=4 14364 B12R1.69 OCCSc1ncc(cc1O)F 62a_100000211926_100000079967 [0,2,0,0,0,0|2,0,0]=4 14365 B12R1.69 OCCSc1ncc(cc1O)F 62a_100009820119_100000211926 [0,2,0,0,0,0|2,0,0]=4 14366 B12R1.69 Oc1cc(ccc1NCCF)Br 34a_100000739049_100011217306 [0,2,0,0,0,0|1,0,0]=3 14367 B12R1.69 Oc1cc(ccc1NCCF)Cl 34a_100000185728_100011217306 [0,2,0,0,0,0|1,0,0]=3 14368 B12R1.69 Oc1cc(ccc1NCCF)F 34a_100000753323_100011217306 [0,2,0,0,0,0|1,0,0]=3 14369 B12R1.69 Oc1cc(ccc1SCCF)Br 62a_100011217306_100012344904 [0,2,0,0,0,0|1,0,0]=3 14370 B12R1.69 Oc1cc(ccc1SCCF)Br 62a_100012344904_100011217306 [0,2,0,0,0,0|1,0,0]=3 14371 B12R1.69 Oc1cc(ccc1SCCF)Cl 62a_100000050036_100011217306 [0,2,0,0,0,0|1,0,0]=3 14372 B12R1.69 Oc1cc(ccc1SCCF)Cl 62a_100011217306_100000050036 [0,2,0,0,0,0|1,0,0]=3 14373 B12R1.69 Oc1cc(ccc1SCCF)F 62a_100000690578_100011217306 [0,2,0,0,0,0|1,0,0]=3 14374 B12R1.69 Oc1cc(ccc1SCCF)F 62a_100011217306_100000690578 [0,2,0,0,0,0|1,0,0]=3 14375 B12R1.69 Oc1cc(cnc1SCCF)Br 62a_100010210634_100011217306 [0,2,0,0,0,0|2,0,0]=4 14376 B12R1.69 Oc1cc(cnc1SCCF)Br 62a_100011217306_100010210634 [0,2,0,0,0,0|2,0,0]=4 14377 B12R1.69 Oc1cc(cnc1SCCF)Cl 62a_100010233512_100011217306 [0,2,0,0,0,0|2,0,0]=4 14378 B12R1.69 Oc1cc(cnc1SCCF)Cl 62a_100011217306_100010233512 [0,2,0,0,0,0|2,0,0]=4 14379 B12R1.69 Oc1cc(cnc1SCCF)F 62a_100009820119_100011217306 [0,2,0,0,0,0|2,0,0]=4 14380 B12R1.69 Oc1cc(cnc1SCCF)F 62a_100011217306_100000079967 [0,2,0,0,0,0|2,0,0]=4 14381 B12R1.69 Oc1ccc(c(c1)Br)NCCF 34a_100012001276_100011217306 [0,2,0,0,0,0|2,0,0]=4 14382 B12R1.69 Oc1ccc(c(c1)Br)SCCF 62a_100000701344_100011217306 [0,2,0,0,0,0|2,0,0]=4 14383 B12R1.69 Oc1ccc(c(c1)Br)SCCF 62a_100011217306_100000701344 [0,2,0,0,0,0|2,0,0]=4 14384 B12R1.69 Oc1ccc(c(c1)Cl)CNCF 34a_200161156549_100015361967 [0,2,0,0,0,0|2,0,0]=4 14385 B12R1.69 Oc1ccc(c(c1)Cl)NCCF 34a_100011215599_100011217306 [0,2,0,0,0,0|2,0,0]=4 14386 B12R1.69 Oc1ccc(c(c1)Cl)SCCF 62a_100000047559_100011217306 [0,2,0,0,0,0|2,0,0]=4 14387 B12R1.69 Oc1ccc(c(c1)Cl)SCCF 62a_100011217306_100000047559 [0,2,0,0,0,0|2,0,0]=4 14388 B12R1.69 Oc1ccc(c(c1)F)NCCF 34a_100000759473_100011217306 [0,2,0,0,0,0|2,0,0]=4 14389 B12R1.69 Oc1ccc(c(c1)F)SCCF 62a_100000755031_100011217306 [0,2,0,0,0,0|2,0,0]=4 14390 B12R1.69 Oc1ccc(c(c1)F)SCCF 62a_100011217306_100000755031 [0,2,0,0,0,0|2,0,0]=4 14391 B12R1.69 Oc1ccc(c(c1)I)NCCF 34a_100010084370_100011217306 [0,2,0,0,0,0|2,0,0]=4 14392 B12R1.69 Oc1ccc(c(c1)O)NCCF 34a_100000106777_100011217306 [0,2,0,0,0,0|1,0,0]=3 14393 B12R1.69 Oc1ccc(c(c1)O)SCCF 62a_100011217306_100009813921 [0,2,0,0,0,0|1,0,0]=3 14394 B12R1.69 [13CH3]NCCc1ccc(cc1Cl)Cl 2230a_100000210994_200025704644 [0,2,0,0,0,0|1,0,0]=3 14395 B12R1.69 [13CH3]NCCc1ccc(cc1Cl)Cl 34a_100000210994_200025704644 [0,2,0,0,0,0|1,0,0]=3 14396 B12R1.69 [13CH3]NCCc1ccc(cc1F)Cl 2230a_103496529009_200025704644 [0,2,0,0,0,0|1,0,0]=3 14397 B12R1.69 [13CH3]NCCc1ccc(cc1F)Cl 34a_103496529009_200025704644 [0,2,0,0,0,0|1,0,0]=3 14398 B12R1.69 [13CH3]NCCc1ccc(cc1F)F 2230a_100000754870_200025704644 [0,2,0,0,0,0|1,0,0]=3 14399 B12R1.69 [13CH3]NCCc1ccc(cc1F)F 34a_100000754870_200025704644 [0,2,0,0,0,0|1,0,0]=3 14400 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)Br 34a_100013445822_200025704644 [0,2,0,0,0,0|1,0,0]=3 14401 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)Br 7a_100013445822_200025704644 [0,2,0,0,0,0|1,0,0]=3 14402 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)Cl 34a_100011215701_200025704644 [0,2,0,0,0,0|1,0,0]=3 14403 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)Cl 7a_100011215701_200025704644 [0,2,0,0,0,0|1,0,0]=3 14404 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)F 34a_100011962860_200025704644 [0,2,0,0,0,0|1,0,0]=3 14405 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)F 7a_100011962860_200025704644 [0,2,0,0,0,0|1,0,0]=3 14406 B12R1.69 [13CH3]OCCc1ccc(cc1F)Br 34a_100011962869_200025704644 [0,2,0,0,0,0|1,0,0]=3 14407 B12R1.69 [13CH3]OCCc1ccc(cc1F)Br 7a_100011962869_200025704644 [0,2,0,0,0,0|1,0,0]=3 14408 B12R1.69 [13CH3]OCCc1ccc(cc1F)F 34a_100000697962_200025704644 [0,2,0,0,0,0|1,0,0]=3 14409 B12R1.69 [13CH3]OCCc1ccc(cc1F)F 7a_100000697962_200025704644 [0,2,0,0,0,0|1,0,0]=3 14410 B12R1.69 [13CH3]SCCc1ccc(cc1Br)Cl 62a_200012945151_200025704644 [0,2,0,0,0,0|1,0,0]=3 14411 B12R1.69 [13CH3]SCCc1ccc(cc1Br)Cl 62a_200025704644_200012945151 [0,2,0,0,0,0|1,0,0]=3 14412 B12R1.69 [13CH3]SCCc1ccc(cc1Cl)Cl 62a_200012161198_200025704644 [0,2,0,0,0,0|1,0,0]=3 14413 B12R1.69 [13CH3]SCCc1ccc(cc1Cl)Cl 62a_200025704644_200012161198 [0,2,0,0,0,0|1,0,0]=3 14414 B12R1.121 C#CCNc1ccccc1CO 34a_100000212039_100000184674 [0,2,0,0,0,0|0,0,2]=4 14415 B12R1.121 C#CCNc1ccccc1OC 34a_100000210025_100000184674 [0,2,0,0,0,0|0,0,2]=4 14416 B12R1.121 C#CCOc1ccccc1CO 34a_100011216872_100000184674 [0,2,0,0,0,0|0,0,2]=4 14417 B12R1.121 C#CCOc1ccccc1OC 34a_100000210385_100000184674 [0,2,0,0,0,0|0,0,2]=4 14418 B12R1.121 C#CCSc1ccccc1CO 62a_100000038162_100000187465 [0,2,0,0,0,0|0,0,2]=4 14419 B12R1.121 C#CCSc1ccccc1OC 62a_100000038162_100000210334 [0,2,0,0,0,0|0,0,2]=4 14420 B12R1.121 C#Cc1ccccc1CNCC 34a_100020634229_100000210202 [0,2,0,0,0,0|1,0,0]=3 14421 B12R1.121 C#Cc1ccccc1CNCF 34a_100020634229_100015361967 [0,2,0,0,0,0|2,0,0]=4 14422 B12R1.121 C#Cc1ccccc1COCC 34a_100000054652_100000210202 [0,2,0,0,0,0|1,0,0]=3 14423 B12R1.121 C#Cc1ccccc1COCC 7a_100000054652_100000210202 [0,2,0,0,0,0|1,0,0]=3 14424 B12R1.121 C#Cc1ccccc1COCF 34a_100000054652_100015361967 [0,2,0,0,0,0|2,0,0]=4 14425 B12R1.121 C#Cc1ccccc1COCF 7a_100000054652_100015361967 [0,2,0,0,0,0|2,0,0]=4 14426 B12R1.121 C#Cc1ccccc1NCCC 34a_100011470550_100000210303 [0,2,0,0,0,0|1,0,0]=3 14427 B12R1.121 C#Cc1ccccc1NCCF 34a_100011470550_100011217306 [0,2,0,0,0,0|2,0,0]=4 14428 B12R1.121 C#Cc1ccccc1NCCO 34a_100011470550_100000211926 [0,2,0,0,0,0|2,0,0]=4 14429 B12R1.121 C#Cc1ccccc1NCSC 34a_100011470550_100011218213 [0,2,0,0,0,0|2,0,0]=4 14430 B12R1.121 C#Cc1ccccc1OCCC 34a_200011470546_100000210303 [0,2,0,0,0,0|1,0,0]=3 14431 B12R1.121 C#Cc1ccccc1OCCC 7a_200011470546_100000210303 [0,2,0,0,0,0|1,0,0]=3 14432 B12R1.121 C#Cc1ccccc1OCCF 34a_200011470546_100011217306 [0,2,0,0,0,0|2,0,0]=4 14433 B12R1.121 C#Cc1ccccc1OCCF 7a_200011470546_100011217306 [0,2,0,0,0,0|2,0,0]=4 14434 B12R1.121 C#Cc1ccccc1OCCO 34a_200011470546_100000211926 [0,2,0,0,0,0|2,0,0]=4 14435 B12R1.121 C#Cc1ccccc1OCCO 7a_200011470546_100000211926 [0,2,0,0,0,0|2,0,0]=4 14436 B12R1.121 C#Cc1ccccc1OCSC 34a_200011470546_100011218213 [0,2,0,0,0,0|2,0,0]=4 14437 B12R1.121 C=CCNc1ccccc1CO 34a_100000212039_100015514636 [0,2,0,0,0,0|0,0,2]=4 14438 B12R1.121 C=CCNc1ccccc1OC 34a_100000210025_100015514636 [0,2,0,0,0,0|0,0,2]=4 14439 B12R1.121 C=CCOc1ccccc1CO 34a_100011216872_100015514636 [0,2,0,0,0,0|0,0,2]=4 14440 B12R1.121 C=CCOc1ccccc1OC 34a_100000210385_100015514636 [0,2,0,0,0,0|0,0,2]=4 14441 B12R1.121 C=CCOc1ccccc1OC 34a_200011262142_200000210301 [0,2,0,0,0,0|0,0,2]=4 14442 B12R1.121 C=CCOc1ccccc1OC 7a_200011262142_200000210301 [0,2,0,0,0,0|0,0,2]=4 14443 B12R1.121 C=CCOc1ccccc1O[13CH3] 34a_200011262142_200025704644 [0,2,0,0,0,0|0,0,2]=4 14444 B12R1.121 C=CCOc1ccccc1O[13CH3] 7a_200011262142_200025704644 [0,2,0,0,0,0|0,0,2]=4 14445 B12R1.121 C=CCSc1ccccc1CO 62a_100000187465_100000210623 [0,2,0,0,0,0|0,0,2]=4 14446 B12R1.121 C=CCSc1ccccc1CO 62a_100000210623_100000187465 [0,2,0,0,0,0|0,0,2]=4 14447 B12R1.121 C=CCSc1ccccc1OC 62a_100000210334_100000210623 [0,2,0,0,0,0|0,0,2]=4 14448 B12R1.121 C=CCSc1ccccc1OC 62a_100000210623_100000210334 [0,2,0,0,0,0|0,0,2]=4 14449 B12R1.121 C=Cc1ccccc1CCC=O 271570a_100011290941_100011713448 [0,2,0,0,0,0|1,0,1]=4 14450 B12R1.121 C=Cc1ccccc1CCCO 271570a_100011290941_100000699526 [0,2,0,0,0,0|1,0,0]=3 14451 B12R1.121 C=Cc1ccccc1COCC 271570a_100011290941_200011493690 [0,2,0,0,0,0|1,0,0]=3 14452 B12R1.121 C=Cc1ccccc1COCC 34a_200010883148_100000210202 [0,2,0,0,0,0|1,0,0]=3 14453 B12R1.121 C=Cc1ccccc1COCC 7a_200010883148_100000210202 [0,2,0,0,0,0|1,0,0]=3 14454 B12R1.121 C=Cc1ccccc1COCF 34a_200010883148_100015361967 [0,2,0,0,0,0|2,0,0]=4 14455 B12R1.121 C=Cc1ccccc1COCF 7a_200010883148_100015361967 [0,2,0,0,0,0|2,0,0]=4 14456 B12R1.121 C=Cc1ccccc1CSCC 271570a_100011290941_200000173030 [0,2,0,0,0,0|1,0,0]=3 14457 B12R1.121 C=Cc1ccccc1NCCC 34a_100012022501_100000210303 [0,2,0,0,0,0|1,0,0]=3 14458 B12R1.121 C=Cc1ccccc1NCCF 34a_100012022501_100011217306 [0,2,0,0,0,0|2,0,0]=4 14459 B12R1.121 C=Cc1ccccc1NCCO 34a_100012022501_100000211926 [0,2,0,0,0,0|2,0,0]=4 14460 B12R1.121 C=Cc1ccccc1NCSC 34a_100012022501_100011218213 [0,2,0,0,0,0|2,0,0]=4 14461 B12R1.121 C=Cc1ccccc1OCCC 271570a_100011290941_100000174042 [0,2,0,0,0,0|1,0,0]=3 14462 B12R1.121 C=Cc1ccccc1OCCN 271570a_100011290941_100000744007 [0,2,0,0,0,0|2,0,0]=4 14463 B12R1.121 C=Cc1ccccc1OCCO 271570a_100011290941_100000230753 [0,2,0,0,0,0|2,0,0]=4 14464 B12R1.121 C=Cc1ccccc1OCOC 271570a_100011290941_200000230759 [0,2,0,0,0,0|2,0,0]=4 14465 B12R1.121 C=Cc1ccccc1SCCC 62a_100000210303_100011218376 [0,2,0,0,0,0|1,0,0]=3 14466 B12R1.121 C=Cc1ccccc1SCCC 62a_100011218376_100000210303 [0,2,0,0,0,0|1,0,0]=3 14467 B12R1.121 C=Cc1ccccc1SCCF 62a_100011217306_100011218376 [0,2,0,0,0,0|2,0,0]=4 14468 B12R1.121 C=Cc1ccccc1SCCF 62a_100011218376_100011217306 [0,2,0,0,0,0|2,0,0]=4 14469 B12R1.121 C=Cc1ccccc1SCCO 271570a_100011290941_200000230852 [0,2,0,0,0,0|2,0,0]=4 14470 B12R1.121 C=Cc1ccccc1SCCO 62a_100000211926_100011218376 [0,2,0,0,0,0|2,0,0]=4 14471 B12R1.121 C=Cc1ccccc1SCCO 62a_100011218376_100000211926 [0,2,0,0,0,0|2,0,0]=4 14472 B12R1.121 C=Cc1ccccc1SCOC 62a_100000766300_100011218376 [0,2,0,0,0,0|2,0,0]=4 14473 B12R1.121 C=Cc1ccccc1SCOC 62a_100011218376_100000766300 [0,2,0,0,0,0|2,0,0]=4 14474 B12R1.121 C=Cc1ccccc1SCSC 62a_100011218213_100011218376 [0,2,0,0,0,0|2,0,0]=4 14475 B12R1.121 C=Cc1ccccc1SCSC 62a_100011218376_100011218213 [0,2,0,0,0,0|2,0,0]=4 14476 B12R1.121 C=Cc1cccnc1OCCC 271570a_100011290941_200011465209 [0,2,0,0,0,0|2,0,0]=4 14477 B12R1.121 CC=NNc1ccccc1OC 4a_100000751209_200000210099 [0,2,0,0,0,0|1,0,1]=4 14478 B12R1.121 CCCCc1ccccc1C#N 271570a_100020621405_100000188569 [0,2,0,0,0,0|1,0,0]=3 14479 B12R1.121 CCCCc1ccccc1C=O 271570a_100020621405_100000211189 [0,2,0,0,0,0|0,0,1]=3 14480 B12R1.121 CCCCc1ccccc1CC 271570a_100020621405_100011215823 [0,2,0,0,0,0|1,0,0]=3 14481 B12R1.121 CCCCc1ccccc1CN 271570a_100020621405_100000689332 [0,2,0,0,0,0|1,0,0]=3 14482 B12R1.121 CCCCc1ccccc1CO 271570a_100020621405_100000187465 [0,2,0,0,0,0|0,0,0]=2 14483 B12R1.121 CCCCc1ccccc1NC 2230a_200011217597_200000210301 [0,2,0,0,0,0|1,0,0]=3 14484 B12R1.121 CCCCc1ccccc1NC 271570a_100020621405_100020606079 [0,2,0,0,0,0|1,0,0]=3 14485 B12R1.121 CCCCc1ccccc1NC 34a_200011217597_200000210301 [0,2,0,0,0,0|1,0,0]=3 14486 B12R1.121 CCCCc1ccccc1NC 7a_200011217597_200000210301 [0,2,0,0,0,0|1,0,0]=3 14487 B12R1.121 CCCCc1ccccc1NN 271570a_100020621405_100000241748 [0,2,0,0,0,0|1,0,0]=3 14488 B12R1.121 CCCCc1ccccc1N[13CH3] 2230a_200011217597_200025704644 [0,2,0,0,0,0|1,0,0]=3 14489 B12R1.121 CCCCc1ccccc1N[13CH3] 34a_200011217597_200025704644 [0,2,0,0,0,0|1,0,0]=3 14490 B12R1.121 CCCCc1ccccc1N[13CH3] 7a_200011217597_200025704644 [0,2,0,0,0,0|1,0,0]=3 14491 B12R1.121 CCCCc1ccccc1OC 271570a_100020621405_100000174000 [0,2,0,0,0,0|0,0,0]=2 14492 B12R1.121 CCCCc1ccccc1SC 271570a_100020621405_100011217816 [0,2,0,0,0,0|0,1,0]=3 14493 B12R1.121 CCCCc1cccnc1C#N 271570a_100020621405_100000685805 [0,2,0,0,0,0|2,0,0]=4 14494 B12R1.121 CCCCc1cccnc1C=O 271570a_100020621405_100011934733 [0,2,0,0,0,0|1,0,1]=4 14495 B12R1.121 CCCCc1cccnc1CC 271570a_100020621405_100009877225 [0,2,0,0,0,0|2,0,0]=4 14496 B12R1.121 CCCCc1cccnc1CN 271570a_100020621405_100020591323 [0,2,0,0,0,0|2,0,0]=4 14497 B12R1.121 CCCCc1cccnc1CO 271570a_100020621405_100011996772 [0,2,0,0,0,0|1,0,0]=3 14498 B12R1.121 CCCCc1cccnc1NC 271570a_100020621405_100000700899 [0,2,0,0,0,0|2,0,0]=4 14499 B12R1.121 CCCCc1cccnc1NN 271570a_100020621405_100011464834 [0,2,0,0,0,0|2,0,0]=4 14500 B12R1.121 CCCCc1cccnc1OC 271570a_100020621405_100000047025 [0,2,0,0,0,0|1,0,0]=3 14501 B12R1.121 CCCCc1cccnc1SC 271570a_100020621405_100011465278 [0,2,0,0,0,0|1,1,0]=4 14502 B12R1.121 CCCCc1ccncc1C#N 271570a_100020621405_100000687039 [0,2,0,0,0,0|2,0,0]=4 14503 B12R1.121 CCCCc1ccncc1C=O 271570a_100020621405_100000050567 [0,2,0,0,0,0|1,0,1]=4 14504 B12R1.121 CCCCc1ccncc1CC 271570a_100020621405_100025704421 [0,2,0,0,0,0|2,0,0]=4 14505 B12R1.121 CCCCc1ccncc1CO 271570a_100020621405_100000117392 [0,2,0,0,0,0|1,0,0]=3 14506 B12R1.121 CCCCc1ccncc1OC 271570a_100020621405_100016988167 [0,2,0,0,0,0|1,0,0]=3 14507 B12R1.121 CCCCc1cnccc1C#N 271570a_100020621405_100000684818 [0,2,0,0,0,0|2,0,0]=4 14508 B12R1.121 CCCCc1cnccc1C=O 271570a_100020621405_100011934409 [0,2,0,0,0,0|1,0,1]=4 14509 B12R1.121 CCCCc1cnccc1CC 271570a_100020621405_100009819861 [0,2,0,0,0,0|2,0,0]=4 14510 B12R1.121 CCCCc1cnccc1CN 271570a_100020621405_100020640021 [0,2,0,0,0,0|2,0,0]=4 14511 B12R1.121 CCCCc1cnccc1CO 271570a_100020621405_100009873359 [0,2,0,0,0,0|1,0,0]=3 14512 B12R1.121 CCCCc1cnccc1NC 271570a_100020621405_100010069531 [0,2,0,0,0,0|2,0,0]=4 14513 B12R1.121 CCCCc1cnccc1NN 271570a_100020621405_100013404636 [0,2,0,0,0,0|2,0,0]=4 14514 B12R1.121 CCCCc1cnccc1OC 271570a_100020621405_100011997281 [0,2,0,0,0,0|1,0,0]=3 14515 B12R1.121 CCCCc1cncnc1OC 271570a_100020621405_100000719902 [0,2,0,0,0,0|2,0,0]=4 14516 B12R1.121 CCCCc1ncccc1C#N 271570a_100020621405_100000211984 [0,2,0,0,0,0|2,0,0]=4 14517 B12R1.121 CCCCc1ncccc1C=O 271570a_100020621405_100009816751 [0,2,0,0,0,0|1,0,1]=4 14518 B12R1.121 CCCCc1ncccc1CN 271570a_100020621405_100015189234 [0,2,0,0,0,0|2,0,0]=4 14519 B12R1.121 CCCCc1ncccc1CO 271570a_100020621405_100000748726 [0,2,0,0,0,0|1,0,0]=3 14520 B12R1.121 CCCCc1ncccc1NC 271570a_100020621405_200011806188 [0,2,0,0,0,0|2,0,0]=4 14521 B12R1.121 CCCCc1ncccc1OC 271570a_100020621405_100000690851 [0,2,0,0,0,0|1,0,0]=3 14522 B12R1.121 CCCCc1nccnc1CO 271570a_100020621405_100000057004 [0,2,0,0,0,0|2,0,0]=4 14523 B12R1.121 CCCCc1nccnc1OC 271570a_100020621405_100000749998 [0,2,0,0,0,0|2,0,0]=4 14524 B12R1.121 CCCCc1ncncc1OC 271570a_100020621405_100012001275 [0,2,0,0,0,0|2,0,0]=4 14525 B12R1.121 CCCNc1ccccc1C#N 34a_100000211148_100000210303 [0,2,0,0,0,0|1,0,0]=3 14526 B12R1.121 CCCNc1ccccc1CC 2230a_100000212081_100000210303 [0,2,0,0,0,0|1,0,0]=3 14527 B12R1.121 CCCNc1ccccc1CC 34a_100000212081_100000210303 [0,2,0,0,0,0|1,0,0]=3 14528 B12R1.121 CCCNc1ccccc1CC 7a_100000212081_100000210303 [0,2,0,0,0,0|1,0,0]=3 14529 B12R1.121 CCCNc1ccccc1CO 34a_100000212039_100000210303 [0,2,0,0,0,0|0,0,0]=2 14530 B12R1.121 CCCNc1ccccc1OC 34a_100000210025_100000210303 [0,2,0,0,0,0|0,0,0]=2 14531 B12R1.121 CCCNc1ccccc1SC 34a_100000211160_100000210303 [0,2,0,0,0,0|0,1,0]=3 14532 B12R1.121 CCCOc1ccccc1C#N 34a_100000211048_100000210303 [0,2,0,0,0,0|1,0,0]=3 14533 B12R1.121 CCCOc1ccccc1C#N 7a_100000211048_100000210303 [0,2,0,0,0,0|1,0,0]=3 14534 B12R1.121 CCCOc1ccccc1CC 34a_100000210936_100000210303 [0,2,0,0,0,0|1,0,0]=3 14535 B12R1.121 CCCOc1ccccc1CC 7a_100000210936_100000210303 [0,2,0,0,0,0|1,0,0]=3 14536 B12R1.121 CCCOc1ccccc1CN 34a_100000185550_100000210303 [0,2,0,0,0,0|1,0,0]=3 14537 B12R1.121 CCCOc1ccccc1CO 34a_100011216872_100000210303 [0,2,0,0,0,0|0,0,0]=2 14538 B12R1.121 CCCOc1ccccc1NC 27a_100102657272_100000174042 [0,2,0,0,0,0|1,0,0]=3 14539 B12R1.121 CCCOc1ccccc1NC 34a_100000033821_100000210303 [0,2,0,0,0,0|1,0,0]=3 14540 B12R1.121 CCCOc1ccccc1NC 34a_100000683936_200000210301 [0,2,0,0,0,0|1,0,0]=3 14541 B12R1.121 CCCOc1ccccc1N[13CH3] 34a_100000683936_200025704644 [0,2,0,0,0,0|1,0,0]=3 14542 B12R1.121 CCCOc1ccccc1OC 34a_100000180214_200000210301 [0,2,0,0,0,0|0,0,0]=2 14543 B12R1.121 CCCOc1ccccc1OC 34a_100000210385_100000210303 [0,2,0,0,0,0|0,0,0]=2 14544 B12R1.121 CCCOc1ccccc1OC 7a_100000180214_200000210301 [0,2,0,0,0,0|0,0,0]=2 14545 B12R1.121 CCCOc1ccccc1O[13CH3] 34a_100000180214_200025704644 [0,2,0,0,0,0|0,0,0]=2 14546 B12R1.121 CCCOc1ccccc1O[13CH3] 7a_100000180214_200025704644 [0,2,0,0,0,0|0,0,0]=2 14547 B12R1.121 CCCOc1ccccc1SC 34a_100011216402_100000210303 [0,2,0,0,0,0|0,1,0]=3 14548 B12R1.121 CCCOc1ccccc1SC 62a_100000174042_200000210301 [0,2,0,0,0,0|0,1,0]=3 14549 B12R1.121 CCCOc1ccccc1SC 62a_200000210301_100000174042 [0,2,0,0,0,0|0,1,0]=3 14550 B12R1.121 CCCOc1ccccc1S[13CH3] 62a_100000174042_200025704644 [0,2,0,0,0,0|0,1,0]=3 14551 B12R1.121 CCCOc1ccccc1S[13CH3] 62a_200025704644_100000174042 [0,2,0,0,0,0|0,1,0]=3 14552 B12R1.121 CCCOc1cccnc1C#N 34a_100000722750_100000210303 [0,2,0,0,0,0|2,0,0]=4 14553 B12R1.121 CCCOc1cccnc1C#N 7a_100000722750_100000210303 [0,2,0,0,0,0|2,0,0]=4 14554 B12R1.121 CCCOc1cccnc1CBr 34a_200020655725_100000210303 [0,2,0,0,0,0|2,0,0]=4 14555 B12R1.121 CCCOc1cccnc1CBr 7a_200020655725_100000210303 [0,2,0,0,0,0|2,0,0]=4 14556 B12R1.121 CCCOc1cccnc1CO 34a_100000731849_100000210303 [0,2,0,0,0,0|1,0,0]=3 14557 B12R1.121 CCCOc1cccnc1OC 34a_100000698397_100000210303 [0,2,0,0,0,0|1,0,0]=3 14558 B12R1.121 CCCOc1cccnc1OC 7a_100000698397_100000210303 [0,2,0,0,0,0|1,0,0]=3 14559 B12R1.121 CCCOc1cnccc1C#N 7a_100012181322_100000210303 [0,2,0,0,0,0|2,0,0]=4 14560 B12R1.121 CCCOc1cnccc1CO 34a_100000078615_100000210303 [0,2,0,0,0,0|1,0,0]=3 14561 B12R1.121 CCCOc1cnccc1OC 34a_100000101186_100000210303 [0,2,0,0,0,0|1,0,0]=3 14562 B12R1.121 CCCOc1ncccc1OC 34a_100025773188_100000210303 [0,2,0,0,0,0|1,0,0]=3 14563 B12R1.121 CCCOc1ncccc1SC 62a_200000210301_200011465209 [0,2,0,0,0,0|1,1,0]=4 14564 B12R1.121 CCCOc1ncccc1SC 62a_200011465209_200000210301 [0,2,0,0,0,0|1,1,0]=4 14565 B12R1.121 CCCOc1ncccc1S[13CH3] 62a_200011465209_200025704644 [0,2,0,0,0,0|1,1,0]=4 14566 B12R1.121 CCCOc1ncccc1S[13CH3] 62a_200025704644_200011465209 [0,2,0,0,0,0|1,1,0]=4 14567 B12R1.121 CCCSc1ccccc1C#N 62a_100000210303_100000188569 [0,2,0,0,0,0|1,0,0]=3 14568 B12R1.121 CCCSc1ccccc1C=O 62a_100000210073_100000210303 [0,2,0,0,0,0|0,0,1]=3 14569 B12R1.121 CCCSc1ccccc1C=O 62a_100000210303_100000210073 [0,2,0,0,0,0|0,0,1]=3 14570 B12R1.121 CCCSc1ccccc1CC 62a_100000210303_100011215823 [0,2,0,0,0,0|1,0,0]=3 14571 B12R1.121 CCCSc1ccccc1CC 62a_100011215823_100000210303 [0,2,0,0,0,0|1,0,0]=3 14572 B12R1.121 CCCSc1ccccc1CN 62a_100000210303_100000689332 [0,2,0,0,0,0|1,0,0]=3 14573 B12R1.121 CCCSc1ccccc1CN 62a_100000689332_100000210303 [0,2,0,0,0,0|1,0,0]=3 14574 B12R1.121 CCCSc1ccccc1CO 62a_100000187465_100000210303 [0,2,0,0,0,0|0,0,0]=2 14575 B12R1.121 CCCSc1ccccc1CO 62a_100000210303_100000187465 [0,2,0,0,0,0|0,0,0]=2 14576 B12R1.121 CCCSc1ccccc1NC 34a_100015184514_200000210301 [0,2,0,0,0,0|1,0,0]=3 14577 B12R1.121 CCCSc1ccccc1NC 62a_100000210303_100020606079 [0,2,0,0,0,0|1,0,0]=3 14578 B12R1.121 CCCSc1ccccc1NC 62a_100020606079_100000210303 [0,2,0,0,0,0|1,0,0]=3 14579 B12R1.121 CCCSc1ccccc1NC 7a_100015184514_200000210301 [0,2,0,0,0,0|1,0,0]=3 14580 B12R1.121 CCCSc1ccccc1NN 62a_100000210303_100000241748 [0,2,0,0,0,0|1,0,0]=3 14581 B12R1.121 CCCSc1ccccc1NN 62a_100000241748_100000210303 [0,2,0,0,0,0|1,0,0]=3 14582 B12R1.121 CCCSc1ccccc1N[13CH3] 34a_100015184514_200025704644 [0,2,0,0,0,0|1,0,0]=3 14583 B12R1.121 CCCSc1ccccc1N[13CH3] 7a_100015184514_200025704644 [0,2,0,0,0,0|1,0,0]=3 14584 B12R1.121 CCCSc1ccccc1OC 62a_100000210303_100000210334 [0,2,0,0,0,0|0,0,0]=2 14585 B12R1.121 CCCSc1ccccc1OC 62a_100000210334_100000210303 [0,2,0,0,0,0|0,0,0]=2 14586 B12R1.121 CCCSc1ccccc1SC 62a_100000210303_100011217816 [0,2,0,0,0,0|0,1,0]=3 14587 B12R1.121 CCCSc1ccccc1SC 62a_100011217816_100000210303 [0,2,0,0,0,0|0,1,0]=3 14588 B12R1.121 CCCSc1cccnc1C#N 62a_100000210303_100000685805 [0,2,0,0,0,0|2,0,0]=4 14589 B12R1.121 CCCSc1cccnc1C=O 62a_100000210303_100011934733 [0,2,0,0,0,0|1,0,1]=4 14590 B12R1.121 CCCSc1cccnc1C=O 62a_100011934733_100000210303 [0,2,0,0,0,0|1,0,1]=4 14591 B12R1.121 CCCSc1cccnc1CC 62a_100000210303_100009877225 [0,2,0,0,0,0|2,0,0]=4 14592 B12R1.121 CCCSc1cccnc1CC 62a_100009877225_100000210303 [0,2,0,0,0,0|2,0,0]=4 14593 B12R1.121 CCCSc1cccnc1CN 62a_100000210303_100020591323 [0,2,0,0,0,0|2,0,0]=4 14594 B12R1.121 CCCSc1cccnc1CN 62a_100020591323_100000210303 [0,2,0,0,0,0|2,0,0]=4 14595 B12R1.121 CCCSc1cccnc1CO 62a_100000210303_100011996772 [0,2,0,0,0,0|1,0,0]=3 14596 B12R1.121 CCCSc1cccnc1CO 62a_100011996772_100000210303 [0,2,0,0,0,0|1,0,0]=3 14597 B12R1.121 CCCSc1cccnc1NC 62a_100000210303_100000700899 [0,2,0,0,0,0|2,0,0]=4 14598 B12R1.121 CCCSc1cccnc1NC 62a_100000700899_100000210303 [0,2,0,0,0,0|2,0,0]=4 14599 B12R1.121 CCCSc1cccnc1NN 62a_100000210303_100011464834 [0,2,0,0,0,0|2,0,0]=4 14600 B12R1.121 CCCSc1cccnc1NN 62a_100011464834_100000210303 [0,2,0,0,0,0|2,0,0]=4 14601 B12R1.121 CCCSc1cccnc1OC 62a_100000047025_100000210303 [0,2,0,0,0,0|1,0,0]=3 14602 B12R1.121 CCCSc1cccnc1OC 62a_100000210303_100000047025 [0,2,0,0,0,0|1,0,0]=3 14603 B12R1.121 CCCSc1cccnc1SC 62a_100000210303_100011465278 [0,2,0,0,0,0|1,1,0]=4 14604 B12R1.121 CCCSc1cccnc1SC 62a_100011465278_100000210303 [0,2,0,0,0,0|1,1,0]=4 14605 B12R1.121 CCCSc1ccncc1C#N 62a_100000210303_100000687039 [0,2,0,0,0,0|2,0,0]=4 14606 B12R1.121 CCCSc1ccncc1C=O 62a_100000050567_100000210303 [0,2,0,0,0,0|1,0,1]=4 14607 B12R1.121 CCCSc1ccncc1C=O 62a_100000210303_100000050567 [0,2,0,0,0,0|1,0,1]=4 14608 B12R1.121 CCCSc1ccncc1CC 62a_100000210303_100025704421 [0,2,0,0,0,0|2,0,0]=4 14609 B12R1.121 CCCSc1ccncc1CC 62a_100025704421_100000210303 [0,2,0,0,0,0|2,0,0]=4 14610 B12R1.121 CCCSc1ccncc1CO 62a_100000117392_100000210303 [0,2,0,0,0,0|1,0,0]=3 14611 B12R1.121 CCCSc1ccncc1CO 62a_100000210303_100000117392 [0,2,0,0,0,0|1,0,0]=3 14612 B12R1.121 CCCSc1ccncc1OC 62a_100000210303_100016988167 [0,2,0,0,0,0|1,0,0]=3 14613 B12R1.121 CCCSc1ccncc1OC 62a_100016988167_100000210303 [0,2,0,0,0,0|1,0,0]=3 14614 B12R1.121 CCCSc1cnccc1C#N 62a_100000210303_100000684818 [0,2,0,0,0,0|2,0,0]=4 14615 B12R1.121 CCCSc1cnccc1C=O 62a_100000210303_100011934409 [0,2,0,0,0,0|1,0,1]=4 14616 B12R1.121 CCCSc1cnccc1C=O 62a_100011934409_100000210303 [0,2,0,0,0,0|1,0,1]=4 14617 B12R1.121 CCCSc1cnccc1CC 62a_100000210303_100009819861 [0,2,0,0,0,0|2,0,0]=4 14618 B12R1.121 CCCSc1cnccc1CC 62a_100009819861_100000210303 [0,2,0,0,0,0|2,0,0]=4 14619 B12R1.121 CCCSc1cnccc1CN 62a_100000210303_100020640021 [0,2,0,0,0,0|2,0,0]=4 14620 B12R1.121 CCCSc1cnccc1CN 62a_100020640021_100000210303 [0,2,0,0,0,0|2,0,0]=4 14621 B12R1.121 CCCSc1cnccc1CO 62a_100000210303_100009873359 [0,2,0,0,0,0|1,0,0]=3 14622 B12R1.121 CCCSc1cnccc1CO 62a_100009873359_100000210303 [0,2,0,0,0,0|1,0,0]=3 14623 B12R1.121 CCCSc1cnccc1NC 62a_100000210303_100010069531 [0,2,0,0,0,0|2,0,0]=4 14624 B12R1.121 CCCSc1cnccc1NC 62a_100010069531_100000210303 [0,2,0,0,0,0|2,0,0]=4 14625 B12R1.121 CCCSc1cnccc1NN 62a_100000210303_100013404636 [0,2,0,0,0,0|2,0,0]=4 14626 B12R1.121 CCCSc1cnccc1NN 62a_100013404636_100000210303 [0,2,0,0,0,0|2,0,0]=4 14627 B12R1.121 CCCSc1cnccc1OC 62a_100000210303_100011997281 [0,2,0,0,0,0|1,0,0]=3 14628 B12R1.121 CCCSc1cnccc1OC 62a_100011997281_100000210303 [0,2,0,0,0,0|1,0,0]=3 14629 B12R1.121 CCCSc1cncnc1OC 62a_100000210303_100000719902 [0,2,0,0,0,0|2,0,0]=4 14630 B12R1.121 CCCSc1cncnc1OC 62a_100000719902_100000210303 [0,2,0,0,0,0|2,0,0]=4 14631 B12R1.121 CCCSc1ncccc1C#N 62a_100000210303_100000211984 [0,2,0,0,0,0|2,0,0]=4 14632 B12R1.121 CCCSc1ncccc1C=O 62a_100000210303_100009816751 [0,2,0,0,0,0|1,0,1]=4 14633 B12R1.121 CCCSc1ncccc1C=O 62a_100009816751_100000210303 [0,2,0,0,0,0|1,0,1]=4 14634 B12R1.121 CCCSc1ncccc1CN 62a_100000210303_100015189234 [0,2,0,0,0,0|2,0,0]=4 14635 B12R1.121 CCCSc1ncccc1CN 62a_100015189234_100000210303 [0,2,0,0,0,0|2,0,0]=4 14636 B12R1.121 CCCSc1ncccc1CO 62a_100000210303_100000748726 [0,2,0,0,0,0|1,0,0]=3 14637 B12R1.121 CCCSc1ncccc1CO 62a_100000748726_100000210303 [0,2,0,0,0,0|1,0,0]=3 14638 B12R1.121 CCCSc1ncccc1NC 62a_100000210303_200011806188 [0,2,0,0,0,0|2,0,0]=4 14639 B12R1.121 CCCSc1ncccc1OC 62a_100000210303_100000690851 [0,2,0,0,0,0|1,0,0]=3 14640 B12R1.121 CCCSc1ncccc1OC 62a_100000767102_100000210303 [0,2,0,0,0,0|1,0,0]=3 14641 B12R1.121 CCCSc1nccnc1CO 62a_100000057004_100000210303 [0,2,0,0,0,0|2,0,0]=4 14642 B12R1.121 CCCSc1nccnc1CO 62a_100000210303_100000057004 [0,2,0,0,0,0|2,0,0]=4 14643 B12R1.121 CCCSc1nccnc1OC 62a_100000210303_100000749998 [0,2,0,0,0,0|2,0,0]=4 14644 B12R1.121 CCCSc1nccnc1OC 62a_100009858322_100000210303 [0,2,0,0,0,0|2,0,0]=4 14645 B12R1.121 CCCSc1ncncc1OC 62a_100000210303_100012001275 [0,2,0,0,0,0|2,0,0]=4 14646 B12R1.121 CCCSc1ncncc1OC 62a_100012001275_100000210303 [0,2,0,0,0,0|2,0,0]=4 14647 B12R1.121 CCNCc1ccccc1C#N 2230a_100015525214_100000181865 [0,2,0,0,0,0|1,0,0]=3 14648 B12R1.121 CCNCc1ccccc1C#N 34a_100016989011_100000210202 [0,2,0,0,0,0|1,0,0]=3 14649 B12R1.121 CCNCc1ccccc1C=O 2230a_100015525214_200009853537 [0,2,0,0,0,0|0,0,1]=3 14650 B12R1.121 CCNCc1ccccc1CC 207a_100015525214_100011219594 [0,2,0,0,0,0|1,0,0]=3 14651 B12R1.121 CCNCc1ccccc1CC 270004a_100015525214_100011219594 [0,2,0,0,0,0|1,0,0]=3 14652 B12R1.121 CCNCc1ccccc1CO 2230a_100015525214_100009816955 [0,2,0,0,0,0|0,0,0]=2 14653 B12R1.121 CCNCc1ccccc1OC 207a_100015525214_100000169842 [0,2,0,0,0,0|0,0,0]=2 14654 B12R1.121 CCNCc1ccccc1OC 2230a_100015525214_100000210004 [0,2,0,0,0,0|0,0,0]=2 14655 B12R1.121 CCNCc1ccccc1OC 270004a_100015525214_100000169842 [0,2,0,0,0,0|0,0,0]=2 14656 B12R1.121 CCNCc1ccccc1OC 34a_100000188900_100000210202 [0,2,0,0,0,0|0,0,0]=2 14657 B12R1.121 CCNCc1ccccc1SC 207a_100015525214_100011217347 [0,2,0,0,0,0|0,1,0]=3 14658 B12R1.121 CCNCc1ccccc1SC 2230a_100015525214_100000699184 [0,2,0,0,0,0|0,1,0]=3 14659 B12R1.121 CCNCc1ccccc1SC 270004a_100015525214_100011217347 [0,2,0,0,0,0|0,1,0]=3 14660 B12R1.121 CCNCc1ccccc1SC 34a_102495365025_100000210202 [0,2,0,0,0,0|0,1,0]=3 14661 B12R1.121 CCNCc1cccnc1C#N 2230a_100015525214_100011768898 [0,2,0,0,0,0|2,0,0]=4 14662 B12R1.121 CCNCc1cccnc1OC 207a_100015525214_100011290804 [0,2,0,0,0,0|1,0,0]=3 14663 B12R1.121 CCNCc1cccnc1OC 2230a_100015525214_100020631285 [0,2,0,0,0,0|1,0,0]=3 14664 B12R1.121 CCNCc1cccnc1OC 270004a_100015525214_100011290804 [0,2,0,0,0,0|1,0,0]=3 14665 B12R1.121 CCNCc1ccncc1OC 207a_100015525214_100011361505 [0,2,0,0,0,0|1,0,0]=3 14666 B12R1.121 CCNCc1ccncc1OC 2230a_100015525214_100020635607 [0,2,0,0,0,0|1,0,0]=3 14667 B12R1.121 CCNCc1ccncc1OC 270004a_100015525214_100011361505 [0,2,0,0,0,0|1,0,0]=3 14668 B12R1.121 CCNCc1cnccc1OC 207a_100015525214_200011997045 [0,2,0,0,0,0|1,0,0]=3 14669 B12R1.121 CCNCc1cnccc1OC 270004a_100015525214_200011997045 [0,2,0,0,0,0|1,0,0]=3 14670 B12R1.121 CCNCc1ncccc1C#N 2230a_100015525214_100000099805 [0,2,0,0,0,0|2,0,0]=4 14671 B12R1.121 CCNCc1ncccc1OC 207a_100015525214_100011912573 [0,2,0,0,0,0|1,0,0]=3 14672 B12R1.121 CCNCc1ncccc1OC 270004a_100015525214_100011912573 [0,2,0,0,0,0|1,0,0]=3 14673 B12R1.121 CCOCc1ccccc1C#N 34a_100121572206_100000181865 [0,2,0,0,0,0|1,0,0]=3 14674 B12R1.121 CCOCc1ccccc1C#N 34a_200011269968_100000210202 [0,2,0,0,0,0|1,0,0]=3 14675 B12R1.121 CCOCc1ccccc1C#N 7a_200011269968_100000210202 [0,2,0,0,0,0|1,0,0]=3 14676 B12R1.121 CCOCc1ccccc1C=O 34a_100121572206_200009853537 [0,2,0,0,0,0|0,0,1]=3 14677 B12R1.121 CCOCc1ccccc1CBr 34a_100009816955_100000210202 [0,2,0,0,0,0|1,0,0]=3 14678 B12R1.121 CCOCc1ccccc1CBr 7a_100009816955_100000210202 [0,2,0,0,0,0|1,0,0]=3 14679 B12R1.121 CCOCc1ccccc1CC 34a_100011663872_100000210202 [0,2,0,0,0,0|1,0,0]=3 14680 B12R1.121 CCOCc1ccccc1CC 7a_100011663872_100000210202 [0,2,0,0,0,0|1,0,0]=3 14681 B12R1.121 CCOCc1ccccc1CN 34a_100000743596_100000210202 [0,2,0,0,0,0|1,0,0]=3 14682 B12R1.121 CCOCc1ccccc1CO 34a_100121572206_100009816955 [0,2,0,0,0,0|0,0,0]=2 14683 B12R1.121 CCOCc1ccccc1OC 34a_100000211301_100000210202 [0,2,0,0,0,0|0,0,0]=2 14684 B12R1.121 CCOCc1ccccc1OC 34a_100121572206_100000210004 [0,2,0,0,0,0|0,0,0]=2 14685 B12R1.121 CCOCc1ccccc1SC 34a_100000699167_100000210202 [0,2,0,0,0,0|0,1,0]=3 14686 B12R1.121 CCOCc1ccccc1SC 34a_100121572206_100000699184 [0,2,0,0,0,0|0,1,0]=3 14687 B12R1.121 CCOCc1ccccc1SC 62a_200000210301_200011493690 [0,2,0,0,0,0|0,1,0]=3 14688 B12R1.121 CCOCc1ccccc1SC 62a_200011493690_200000210301 [0,2,0,0,0,0|0,1,0]=3 14689 B12R1.121 CCOCc1ccccc1S[13CH3] 62a_200011493690_200025704644 [0,2,0,0,0,0|0,1,0]=3 14690 B12R1.121 CCOCc1ccccc1S[13CH3] 62a_200025704644_200011493690 [0,2,0,0,0,0|0,1,0]=3 14691 B12R1.121 CCOCc1cccnc1C#N 34a_100121572206_100011768898 [0,2,0,0,0,0|2,0,0]=4 14692 B12R1.121 CCOCc1cccnc1OC 34a_100000717863_100000210202 [0,2,0,0,0,0|1,0,0]=3 14693 B12R1.121 CCOCc1cccnc1OC 34a_100121572206_100020631285 [0,2,0,0,0,0|1,0,0]=3 14694 B12R1.121 CCOCc1ncccc1OC 34a_100011998681_100000210202 [0,2,0,0,0,0|1,0,0]=3 14695 B12R1.121 CCSCc1ccccc1C#N 62a_100000186380_100000210202 [0,2,0,0,0,0|1,0,0]=3 14696 B12R1.121 CCSCc1ccccc1C#N 62a_100000210202_100000181865 [0,2,0,0,0,0|1,0,0]=3 14697 B12R1.121 CCSCc1ccccc1C=O 62a_100000210202_200009853537 [0,2,0,0,0,0|0,0,1]=3 14698 B12R1.121 CCSCc1ccccc1C=O 62a_200009853537_100000210202 [0,2,0,0,0,0|0,0,1]=3 14699 B12R1.121 CCSCc1ccccc1CO 62a_100000210202_100009816955 [0,2,0,0,0,0|0,0,0]=2 14700 B12R1.121 CCSCc1ccccc1CO 62a_100009816955_100000210202 [0,2,0,0,0,0|0,0,0]=2 14701 B12R1.121 CCSCc1ccccc1OC 62a_100000210004_100000210202 [0,2,0,0,0,0|0,0,0]=2 14702 B12R1.121 CCSCc1ccccc1OC 62a_100000210202_100000210004 [0,2,0,0,0,0|0,0,0]=2 14703 B12R1.121 CCSCc1ccccc1SC 62a_100000210202_100000699184 [0,2,0,0,0,0|0,1,0]=3 14704 B12R1.121 CCSCc1ccccc1SC 62a_100000699184_100000210202 [0,2,0,0,0,0|0,1,0]=3 14705 B12R1.121 CCSCc1ccccc1SC 62a_200000173030_200000210301 [0,2,0,0,0,0|0,1,0]=3 14706 B12R1.121 CCSCc1ccccc1SC 62a_200000210301_200000173030 [0,2,0,0,0,0|0,1,0]=3 14707 B12R1.121 CCSCc1ccccc1S[13CH3] 62a_200000173030_200025704644 [0,2,0,0,0,0|0,1,0]=3 14708 B12R1.121 CCSCc1ccccc1S[13CH3] 62a_200025704644_200000173030 [0,2,0,0,0,0|0,1,0]=3 14709 B12R1.121 CCSCc1cccnc1C#N 62a_100000210202_100011768898 [0,2,0,0,0,0|2,0,0]=4 14710 B12R1.121 CCSCc1cccnc1OC 62a_100000210202_100020631285 [0,2,0,0,0,0|1,0,0]=3 14711 B12R1.121 CCSCc1cccnc1OC 62a_100020631285_100000210202 [0,2,0,0,0,0|1,0,0]=3 14712 B12R1.121 CCSCc1ccncc1OC 62a_100000210202_100020635607 [0,2,0,0,0,0|1,0,0]=3 14713 B12R1.121 CCSCc1ccncc1OC 62a_100020635607_100000210202 [0,2,0,0,0,0|1,0,0]=3 14714 B12R1.121 CCSCc1ncccc1C#N 62a_100000210202_100000099805 [0,2,0,0,0,0|2,0,0]=4 14715 B12R1.121 CCc1ccccc1CCNC 2230a_100011663701_200000210301 [0,2,0,0,0,0|1,0,0]=3 14716 B12R1.121 CCc1ccccc1CCNC 34a_100011663701_200000210301 [0,2,0,0,0,0|1,0,0]=3 14717 B12R1.121 CCc1ccccc1CCN[13CH3] 2230a_100011663701_200025704644 [0,2,0,0,0,0|1,0,0]=3 14718 B12R1.121 CCc1ccccc1CCN[13CH3] 34a_100011663701_200025704644 [0,2,0,0,0,0|1,0,0]=3 14719 B12R1.121 CCc1ccccc1COCF 34a_100011663872_100015361967 [0,2,0,0,0,0|2,0,0]=4 14720 B12R1.121 CCc1ccccc1COCF 7a_100011663872_100015361967 [0,2,0,0,0,0|2,0,0]=4 14721 B12R1.121 CCc1ccccc1NCCF 2230a_100000212081_100011217306 [0,2,0,0,0,0|2,0,0]=4 14722 B12R1.121 CCc1ccccc1NCCF 34a_100000212081_100011217306 [0,2,0,0,0,0|2,0,0]=4 14723 B12R1.121 CCc1ccccc1NCCF 7a_100000212081_100011217306 [0,2,0,0,0,0|2,0,0]=4 14724 B12R1.121 CCc1ccccc1NCCO 2230a_100000212081_100000211926 [0,2,0,0,0,0|2,0,0]=4 14725 B12R1.121 CCc1ccccc1NCCO 34a_100000212081_100000211926 [0,2,0,0,0,0|2,0,0]=4 14726 B12R1.121 CCc1ccccc1NCCO 7a_100000212081_100000211926 [0,2,0,0,0,0|2,0,0]=4 14727 B12R1.121 CCc1ccccc1NCOC 2230a_100000212081_100000766300 [0,2,0,0,0,0|2,0,0]=4 14728 B12R1.121 CCc1ccccc1NCSC 2230a_100000212081_100011218213 [0,2,0,0,0,0|2,0,0]=4 14729 B12R1.121 CCc1ccccc1NCSC 34a_100000212081_100011218213 [0,2,0,0,0,0|2,0,0]=4 14730 B12R1.121 CCc1ccccc1OCCF 34a_100000210936_100011217306 [0,2,0,0,0,0|2,0,0]=4 14731 B12R1.121 CCc1ccccc1OCCF 7a_100000210936_100011217306 [0,2,0,0,0,0|2,0,0]=4 14732 B12R1.121 CCc1ccccc1OCCO 34a_100000210936_100000211926 [0,2,0,0,0,0|2,0,0]=4 14733 B12R1.121 CCc1ccccc1OCCO 7a_100000210936_100000211926 [0,2,0,0,0,0|2,0,0]=4 14734 B12R1.121 CCc1ccccc1OCSC 34a_100000210936_100011218213 [0,2,0,0,0,0|2,0,0]=4 14735 B12R1.121 CCc1ccccc1SCCF 62a_100011215823_100011217306 [0,2,0,0,0,0|2,0,0]=4 14736 B12R1.121 CCc1ccccc1SCCF 62a_100011217306_100011215823 [0,2,0,0,0,0|2,0,0]=4 14737 B12R1.121 CCc1ccccc1SCCO 62a_100000211926_100011215823 [0,2,0,0,0,0|2,0,0]=4 14738 B12R1.121 CCc1ccccc1SCCO 62a_100011215823_100000211926 [0,2,0,0,0,0|2,0,0]=4 14739 B12R1.121 CCc1ccccc1SCOC 62a_100000766300_100011215823 [0,2,0,0,0,0|2,0,0]=4 14740 B12R1.121 CCc1ccccc1SCOC 62a_100011215823_100000766300 [0,2,0,0,0,0|2,0,0]=4 14741 B12R1.121 CCc1ccccc1SCSC 62a_100011215823_100011218213 [0,2,0,0,0,0|2,0,0]=4 14742 B12R1.121 CCc1ccccc1SCSC 62a_100011218213_100011215823 [0,2,0,0,0,0|2,0,0]=4 14743 B12R1.121 CNCCc1ccccc1C#N 2230a_106832991635_200013032965 [0,2,0,0,0,0|1,0,0]=3 14744 B12R1.121 CNCCc1ccccc1C#N 34a_100102657272_200013032965 [0,2,0,0,0,0|1,0,0]=3 14745 B12R1.121 CNCCc1ccccc1C#N 7a_106832991635_200013032965 [0,2,0,0,0,0|1,0,0]=3 14746 B12R1.121 CNCCc1ccccc1C=O 2230a_106832991635_100010186698 [0,2,0,0,0,0|0,0,1]=3 14747 B12R1.121 CNCCc1ccccc1C=O 34a_100102657272_100010186698 [0,2,0,0,0,0|0,0,1]=3 14748 B12R1.121 CNCCc1ccccc1C=O 7a_106832991635_100010186698 [0,2,0,0,0,0|0,0,1]=3 14749 B12R1.121 CNCCc1ccccc1OC 2230a_100000211851_200000210301 [0,2,0,0,0,0|0,0,0]=2 14750 B12R1.121 CNCCc1ccccc1OC 2230a_106832991635_100011713687 [0,2,0,0,0,0|0,0,0]=2 14751 B12R1.121 CNCCc1ccccc1OC 270004a_106832991635_100011713418 [0,2,0,0,0,0|0,0,0]=2 14752 B12R1.121 CNCCc1ccccc1OC 34a_100000211851_200000210301 [0,2,0,0,0,0|0,0,0]=2 14753 B12R1.121 CNCCc1ccccc1OC 34a_100102657272_100011713687 [0,2,0,0,0,0|0,0,0]=2 14754 B12R1.121 CNCCc1ccccc1OC 7a_106832991635_100011713687 [0,2,0,0,0,0|0,0,0]=2 14755 B12R1.121 CNCCc1ccccc1[Pd]Cl 2230a_106741704370_200000210301 [0,2,0,0,0,0|1,0,0]=3 14756 B12R1.121 CNCCc1ccccc1[Pd]Cl 34a_106741704370_200000210301 [0,2,0,0,0,0|1,0,0]=3 14757 B12R1.121 CNCCc1ccccc1[Pd]Cl 7a_106741704370_200000210301 [0,2,0,0,0,0|1,0,0]=3 14758 B12R1.121 CNc1ccccc1OCCF 34a_100000033821_100011217306 [0,2,0,0,0,0|2,0,0]=4 14759 B12R1.121 CNc1ccccc1OCCF 34a_100012000959_200000210301 [0,2,0,0,0,0|2,0,0]=4 14760 B12R1.121 CNc1ccccc1OCCO 34a_100000033821_100000211926 [0,2,0,0,0,0|2,0,0]=4 14761 B12R1.121 CNc1ccccc1OCCO 34a_100132302172_200000210301 [0,2,0,0,0,0|2,0,0]=4 14762 B12R1.121 CNc1ccccc1OCSC 34a_100000033821_100011218213 [0,2,0,0,0,0|2,0,0]=4 14763 B12R1.121 CNc1ccccc1SCCF 62a_100011217306_100020606079 [0,2,0,0,0,0|2,0,0]=4 14764 B12R1.121 CNc1ccccc1SCCF 62a_100020606079_100011217306 [0,2,0,0,0,0|2,0,0]=4 14765 B12R1.121 CNc1ccccc1SCCO 62a_100000211926_100020606079 [0,2,0,0,0,0|2,0,0]=4 14766 B12R1.121 CNc1ccccc1SCCO 62a_100020606079_100000211926 [0,2,0,0,0,0|2,0,0]=4 14767 B12R1.121 CNc1ccccc1SCOC 62a_100000766300_100020606079 [0,2,0,0,0,0|2,0,0]=4 14768 B12R1.121 CNc1ccccc1SCOC 62a_100020606079_100000766300 [0,2,0,0,0,0|2,0,0]=4 14769 B12R1.121 CNc1ccccc1SCSC 62a_100011218213_100020606079 [0,2,0,0,0,0|2,0,0]=4 14770 B12R1.121 CNc1ccccc1SCSC 62a_100020606079_100011218213 [0,2,0,0,0,0|2,0,0]=4 14771 B12R1.121 COCCc1ccccc1C#N 34a_100138415774_200013032965 [0,2,0,0,0,0|1,0,0]=3 14772 B12R1.121 COCCc1ccccc1C=O 34a_100138415774_100010186698 [0,2,0,0,0,0|0,0,1]=3 14773 B12R1.121 COCCc1ccccc1OC 34a_100000722730_200000210301 [0,2,0,0,0,0|0,0,0]=2 14774 B12R1.121 COCCc1ccccc1OC 34a_100011218620_200000210301 [0,2,0,0,0,0|0,0,0]=2 14775 B12R1.121 COCCc1ccccc1OC 34a_100138415774_100011713687 [0,2,0,0,0,0|0,0,0]=2 14776 B12R1.121 COCCc1ccccc1OC 7a_100000722730_200000210301 [0,2,0,0,0,0|0,0,0]=2 14777 B12R1.121 COCCc1ccccc1OC 7a_100011218620_200000210301 [0,2,0,0,0,0|0,0,0]=2 14778 B12R1.121 COCCc1ccccc1O[13CH3] 34a_100000722730_200025704644 [0,2,0,0,0,0|0,0,0]=2 14779 B12R1.121 COCCc1ccccc1O[13CH3] 7a_100000722730_200025704644 [0,2,0,0,0,0|0,0,0]=2 14780 B12R1.121 COCOc1ccccc1SC 62a_200000210301_200000230759 [0,2,0,0,0,0|1,1,0]=4 14781 B12R1.121 COCOc1ccccc1SC 62a_200000230759_200000210301 [0,2,0,0,0,0|1,1,0]=4 14782 B12R1.121 COCOc1ccccc1S[13CH3] 62a_200000230759_200025704644 [0,2,0,0,0,0|1,1,0]=4 14783 B12R1.121 COCOc1ccccc1S[13CH3] 62a_200025704644_200000230759 [0,2,0,0,0,0|1,1,0]=4 14784 B12R1.121 COCSc1ccccc1C#N 62a_100000766300_100000188569 [0,2,0,0,0,0|2,0,0]=4 14785 B12R1.121 COCSc1ccccc1C=O 62a_100000210073_100000766300 [0,2,0,0,0,0|1,0,1]=4 14786 B12R1.121 COCSc1ccccc1C=O 62a_100000766300_100000210073 [0,2,0,0,0,0|1,0,1]=4 14787 B12R1.121 COCSc1ccccc1CN 62a_100000689332_100000766300 [0,2,0,0,0,0|2,0,0]=4 14788 B12R1.121 COCSc1ccccc1CN 62a_100000766300_100000689332 [0,2,0,0,0,0|2,0,0]=4 14789 B12R1.121 COCSc1ccccc1CO 62a_100000187465_100000766300 [0,2,0,0,0,0|1,0,0]=3 14790 B12R1.121 COCSc1ccccc1CO 62a_100000766300_100000187465 [0,2,0,0,0,0|1,0,0]=3 14791 B12R1.121 COCSc1ccccc1NN 62a_100000241748_100000766300 [0,2,0,0,0,0|2,0,0]=4 14792 B12R1.121 COCSc1ccccc1NN 62a_100000766300_100000241748 [0,2,0,0,0,0|2,0,0]=4 14793 B12R1.121 COCSc1ccccc1OC 62a_100000210334_100000766300 [0,2,0,0,0,0|1,0,0]=3 14794 B12R1.121 COCSc1ccccc1OC 62a_100000766300_100000210334 [0,2,0,0,0,0|1,0,0]=3 14795 B12R1.121 COCSc1ccccc1SC 62a_100000766300_100011217816 [0,2,0,0,0,0|1,1,0]=4 14796 B12R1.121 COCSc1ccccc1SC 62a_100011217816_100000766300 [0,2,0,0,0,0|1,1,0]=4 14797 B12R1.121 COCSc1cccnc1CO 62a_100000766300_100011996772 [0,2,0,0,0,0|2,0,0]=4 14798 B12R1.121 COCSc1cccnc1CO 62a_100011996772_100000766300 [0,2,0,0,0,0|2,0,0]=4 14799 B12R1.121 COCSc1cccnc1OC 62a_100000047025_100000766300 [0,2,0,0,0,0|2,0,0]=4 14800 B12R1.121 COCSc1cccnc1OC 62a_100000766300_100000047025 [0,2,0,0,0,0|2,0,0]=4 14801 B12R1.121 COCSc1ccncc1CO 62a_100000117392_100000766300 [0,2,0,0,0,0|2,0,0]=4 14802 B12R1.121 COCSc1ccncc1CO 62a_100000766300_100000117392 [0,2,0,0,0,0|2,0,0]=4 14803 B12R1.121 COCSc1ccncc1OC 62a_100000766300_100016988167 [0,2,0,0,0,0|2,0,0]=4 14804 B12R1.121 COCSc1ccncc1OC 62a_100016988167_100000766300 [0,2,0,0,0,0|2,0,0]=4 14805 B12R1.121 COCSc1cnccc1CO 62a_100000766300_100009873359 [0,2,0,0,0,0|2,0,0]=4 14806 B12R1.121 COCSc1cnccc1CO 62a_100009873359_100000766300 [0,2,0,0,0,0|2,0,0]=4 14807 B12R1.121 COCSc1cnccc1OC 62a_100000766300_100011997281 [0,2,0,0,0,0|2,0,0]=4 14808 B12R1.121 COCSc1cnccc1OC 62a_100011997281_100000766300 [0,2,0,0,0,0|2,0,0]=4 14809 B12R1.121 COCSc1ncccc1CO 62a_100000748726_100000766300 [0,2,0,0,0,0|2,0,0]=4 14810 B12R1.121 COCSc1ncccc1CO 62a_100000766300_100000748726 [0,2,0,0,0,0|2,0,0]=4 14811 B12R1.121 COCSc1ncccc1OC 62a_100000766300_100000690851 [0,2,0,0,0,0|2,0,0]=4 14812 B12R1.121 COCSc1ncccc1OC 62a_100000767102_100000766300 [0,2,0,0,0,0|2,0,0]=4 14813 B12R1.121 COc1ccccc1CCN[13CH3] 2230a_100000211851_200025704644 [0,2,0,0,0,0|0,0,0]=2 14814 B12R1.121 COc1ccccc1CCN[13CH3] 34a_100000211851_200025704644 [0,2,0,0,0,0|0,0,0]=2 14815 B12R1.121 COc1ccccc1CCO[13CH3] 34a_100011218620_200025704644 [0,2,0,0,0,0|0,0,0]=2 14816 B12R1.121 COc1ccccc1CCO[13CH3] 7a_100011218620_200025704644 [0,2,0,0,0,0|0,0,0]=2 14817 B12R1.121 COc1ccccc1CCSC 62a_100011713687_200000210301 [0,2,0,0,0,0|0,0,0]=2 14818 B12R1.121 COc1ccccc1CCSC 62a_200000210301_100011713687 [0,2,0,0,0,0|0,0,0]=2 14819 B12R1.121 COc1ccccc1CCS[13CH3] 62a_100011713687_200025704644 [0,2,0,0,0,0|0,0,0]=2 14820 B12R1.121 COc1ccccc1CCS[13CH3] 62a_200025704644_100011713687 [0,2,0,0,0,0|0,0,0]=2 14821 B12R1.121 COc1ccccc1CNCF 34a_100000188900_100015361967 [0,2,0,0,0,0|1,0,0]=3 14822 B12R1.121 COc1ccccc1COCF 34a_100000211301_100015361967 [0,2,0,0,0,0|1,0,0]=3 14823 B12R1.121 COc1ccccc1CSCF 62a_100000210004_100015361967 [0,2,0,0,0,0|1,0,0]=3 14824 B12R1.121 COc1ccccc1CSCF 62a_100015361967_100000210004 [0,2,0,0,0,0|1,0,0]=3 14825 B12R1.121 COc1ccccc1NCC=O 34a_100000210025_200009817547 [0,2,0,0,0,0|1,0,1]=4 14826 B12R1.121 COc1ccccc1NCCF 34a_100000210025_100011217306 [0,2,0,0,0,0|1,0,0]=3 14827 B12R1.121 COc1ccccc1NCCO 34a_100000210025_100000211926 [0,2,0,0,0,0|1,0,0]=3 14828 B12R1.121 COc1ccccc1NCSC 34a_100000210025_100011218213 [0,2,0,0,0,0|1,0,0]=3 14829 B12R1.121 COc1ccccc1OCC=O 34a_100000210385_200009817547 [0,2,0,0,0,0|1,0,1]=4 14830 B12R1.121 COc1ccccc1OCCF 34a_100000210385_100011217306 [0,2,0,0,0,0|1,0,0]=3 14831 B12R1.121 COc1ccccc1OCCO 34a_100000181789_200000210301 [0,2,0,0,0,0|1,0,0]=3 14832 B12R1.121 COc1ccccc1OCCO 34a_100000210385_100000211926 [0,2,0,0,0,0|1,0,0]=3 14833 B12R1.121 COc1ccccc1OCCO 7a_100000181789_200000210301 [0,2,0,0,0,0|1,0,0]=3 14834 B12R1.121 COc1ccccc1OCSC 34a_100000210385_100011218213 [0,2,0,0,0,0|1,0,0]=3 14835 B12R1.121 COc1ccccc1SCC#N 62a_100000210334_100011215382 [0,2,0,0,0,0|1,0,1]=4 14836 B12R1.121 COc1ccccc1SCC#N 62a_100011215382_100000210334 [0,2,0,0,0,0|1,0,1]=4 14837 B12R1.121 COc1ccccc1SCC=O 62a_100000210334_200015260668 [0,2,0,0,0,0|1,0,1]=4 14838 B12R1.121 COc1ccccc1SCC=O 62a_200015260668_100000210334 [0,2,0,0,0,0|1,0,1]=4 14839 B12R1.121 COc1ccccc1SCCF 62a_100000210334_100011217306 [0,2,0,0,0,0|1,0,0]=3 14840 B12R1.121 COc1ccccc1SCCF 62a_100011217306_100000210334 [0,2,0,0,0,0|1,0,0]=3 14841 B12R1.121 COc1ccccc1SCCO 62a_100000210334_100000211926 [0,2,0,0,0,0|1,0,0]=3 14842 B12R1.121 COc1ccccc1SCCO 62a_100000211926_100000210334 [0,2,0,0,0,0|1,0,0]=3 14843 B12R1.121 COc1ccccc1SCSC 62a_100000210334_100011218213 [0,2,0,0,0,0|1,0,0]=3 14844 B12R1.121 COc1ccccc1SCSC 62a_100011218213_100000210334 [0,2,0,0,0,0|1,0,0]=3 14845 B12R1.121 COc1cccnc1COCF 34a_100011998681_100015361967 [0,2,0,0,0,0|2,0,0]=4 14846 B12R1.121 COc1cccnc1OCCF 34a_100025773188_100011217306 [0,2,0,0,0,0|2,0,0]=4 14847 B12R1.121 COc1cccnc1OCCO 34a_100025773188_100000211926 [0,2,0,0,0,0|2,0,0]=4 14848 B12R1.121 COc1cccnc1OCSC 34a_100025773188_100011218213 [0,2,0,0,0,0|2,0,0]=4 14849 B12R1.121 COc1cccnc1SCCF 62a_100000767102_100011217306 [0,2,0,0,0,0|2,0,0]=4 14850 B12R1.121 COc1cccnc1SCCF 62a_100011217306_100000690851 [0,2,0,0,0,0|2,0,0]=4 14851 B12R1.121 COc1cccnc1SCCO 62a_100000211926_100000690851 [0,2,0,0,0,0|2,0,0]=4 14852 B12R1.121 COc1cccnc1SCCO 62a_100000767102_100000211926 [0,2,0,0,0,0|2,0,0]=4 14853 B12R1.121 COc1cccnc1SCSC 62a_100000767102_100011218213 [0,2,0,0,0,0|2,0,0]=4 14854 B12R1.121 COc1cccnc1SCSC 62a_100011218213_100000690851 [0,2,0,0,0,0|2,0,0]=4 14855 B12R1.121 COc1ccncc1OCCF 34a_100000101186_100011217306 [0,2,0,0,0,0|2,0,0]=4 14856 B12R1.121 COc1ccncc1OCCO 34a_100000101186_100000211926 [0,2,0,0,0,0|2,0,0]=4 14857 B12R1.121 COc1ccncc1OCSC 34a_100000101186_100011218213 [0,2,0,0,0,0|2,0,0]=4 14858 B12R1.121 COc1ccncc1SCCF 62a_100011217306_100011997281 [0,2,0,0,0,0|2,0,0]=4 14859 B12R1.121 COc1ccncc1SCCF 62a_100011997281_100011217306 [0,2,0,0,0,0|2,0,0]=4 14860 B12R1.121 COc1ccncc1SCCO 62a_100000211926_100011997281 [0,2,0,0,0,0|2,0,0]=4 14861 B12R1.121 COc1ccncc1SCCO 62a_100011997281_100000211926 [0,2,0,0,0,0|2,0,0]=4 14862 B12R1.121 COc1ccncc1SCSC 62a_100011218213_100011997281 [0,2,0,0,0,0|2,0,0]=4 14863 B12R1.121 COc1ccncc1SCSC 62a_100011997281_100011218213 [0,2,0,0,0,0|2,0,0]=4 14864 B12R1.121 COc1cnccc1CSCF 62a_100015361967_100020635607 [0,2,0,0,0,0|2,0,0]=4 14865 B12R1.121 COc1cnccc1CSCF 62a_100020635607_100015361967 [0,2,0,0,0,0|2,0,0]=4 14866 B12R1.121 COc1cnccc1SCCF 62a_100011217306_100016988167 [0,2,0,0,0,0|2,0,0]=4 14867 B12R1.121 COc1cnccc1SCCF 62a_100016988167_100011217306 [0,2,0,0,0,0|2,0,0]=4 14868 B12R1.121 COc1cnccc1SCCO 62a_100000211926_100016988167 [0,2,0,0,0,0|2,0,0]=4 14869 B12R1.121 COc1cnccc1SCCO 62a_100016988167_100000211926 [0,2,0,0,0,0|2,0,0]=4 14870 B12R1.121 COc1cnccc1SCSC 62a_100011218213_100016988167 [0,2,0,0,0,0|2,0,0]=4 14871 B12R1.121 COc1cnccc1SCSC 62a_100016988167_100011218213 [0,2,0,0,0,0|2,0,0]=4 14872 B12R1.121 COc1ncccc1COCF 34a_100000717863_100015361967 [0,2,0,0,0,0|2,0,0]=4 14873 B12R1.121 COc1ncccc1CSCF 62a_100015361967_100020631285 [0,2,0,0,0,0|2,0,0]=4 14874 B12R1.121 COc1ncccc1CSCF 62a_100020631285_100015361967 [0,2,0,0,0,0|2,0,0]=4 14875 B12R1.121 COc1ncccc1OCCF 34a_100000698397_100011217306 [0,2,0,0,0,0|2,0,0]=4 14876 B12R1.121 COc1ncccc1OCCF 7a_100000698397_100011217306 [0,2,0,0,0,0|2,0,0]=4 14877 B12R1.121 COc1ncccc1OCCO 34a_100000698397_100000211926 [0,2,0,0,0,0|2,0,0]=4 14878 B12R1.121 COc1ncccc1OCCO 7a_100000698397_100000211926 [0,2,0,0,0,0|2,0,0]=4 14879 B12R1.121 COc1ncccc1OCSC 34a_100000698397_100011218213 [0,2,0,0,0,0|2,0,0]=4 14880 B12R1.121 COc1ncccc1SCCF 62a_100000047025_100011217306 [0,2,0,0,0,0|2,0,0]=4 14881 B12R1.121 COc1ncccc1SCCF 62a_100011217306_100000047025 [0,2,0,0,0,0|2,0,0]=4 14882 B12R1.121 COc1ncccc1SCCO 62a_100000047025_100000211926 [0,2,0,0,0,0|2,0,0]=4 14883 B12R1.121 COc1ncccc1SCCO 62a_100000211926_100000047025 [0,2,0,0,0,0|2,0,0]=4 14884 B12R1.121 COc1ncccc1SCSC 62a_100000047025_100011218213 [0,2,0,0,0,0|2,0,0]=4 14885 B12R1.121 COc1ncccc1SCSC 62a_100011218213_100000047025 [0,2,0,0,0,0|2,0,0]=4 14886 B12R1.121 CSCCc1ccccc1C#N 62a_200000210301_200013032965 [0,2,0,0,0,0|1,0,0]=3 14887 B12R1.121 CSCCc1ccccc1C=O 62a_100010186698_200000210301 [0,2,0,0,0,0|0,0,1]=3 14888 B12R1.121 CSCCc1ccccc1C=O 62a_200000210301_100010186698 [0,2,0,0,0,0|0,0,1]=3 14889 B12R1.121 CSCNc1ccccc1C#N 34a_100000211148_100011218213 [0,2,0,0,0,0|2,0,0]=4 14890 B12R1.121 CSCNc1ccccc1CO 34a_100000212039_100011218213 [0,2,0,0,0,0|1,0,0]=3 14891 B12R1.121 CSCNc1ccccc1SC 34a_100000211160_100011218213 [0,2,0,0,0,0|1,1,0]=4 14892 B12R1.121 CSCOc1ccccc1C#N 34a_100000211048_100011218213 [0,2,0,0,0,0|2,0,0]=4 14893 B12R1.121 CSCOc1ccccc1CN 34a_100000185550_100011218213 [0,2,0,0,0,0|2,0,0]=4 14894 B12R1.121 CSCOc1ccccc1CO 34a_100011216872_100011218213 [0,2,0,0,0,0|1,0,0]=3 14895 B12R1.121 CSCOc1ccccc1SC 34a_100011216402_100011218213 [0,2,0,0,0,0|1,1,0]=4 14896 B12R1.121 CSCOc1cccnc1CO 34a_100000731849_100011218213 [0,2,0,0,0,0|2,0,0]=4 14897 B12R1.121 CSCOc1cnccc1CO 34a_100000078615_100011218213 [0,2,0,0,0,0|2,0,0]=4 14898 B12R1.121 CSCSc1ccccc1C#N 62a_100011218213_100000188569 [0,2,0,0,0,0|2,0,0]=4 14899 B12R1.121 CSCSc1ccccc1C=O 62a_100000210073_100011218213 [0,2,0,0,0,0|1,0,1]=4 14900 B12R1.121 CSCSc1ccccc1C=O 62a_100011218213_100000210073 [0,2,0,0,0,0|1,0,1]=4 14901 B12R1.121 CSCSc1ccccc1CN 62a_100000689332_100011218213 [0,2,0,0,0,0|2,0,0]=4 14902 B12R1.121 CSCSc1ccccc1CN 62a_100011218213_100000689332 [0,2,0,0,0,0|2,0,0]=4 14903 B12R1.121 CSCSc1ccccc1CO 62a_100000187465_100011218213 [0,2,0,0,0,0|1,0,0]=3 14904 B12R1.121 CSCSc1ccccc1CO 62a_100011218213_100000187465 [0,2,0,0,0,0|1,0,0]=3 14905 B12R1.121 CSCSc1ccccc1NN 62a_100000241748_100011218213 [0,2,0,0,0,0|2,0,0]=4 14906 B12R1.121 CSCSc1ccccc1NN 62a_100011218213_100000241748 [0,2,0,0,0,0|2,0,0]=4 14907 B12R1.121 CSCSc1ccccc1SC 62a_100011217816_100011218213 [0,2,0,0,0,0|1,1,0]=4 14908 B12R1.121 CSCSc1ccccc1SC 62a_100011218213_100011217816 [0,2,0,0,0,0|1,1,0]=4 14909 B12R1.121 CSCSc1cccnc1CO 62a_100011218213_100011996772 [0,2,0,0,0,0|2,0,0]=4 14910 B12R1.121 CSCSc1cccnc1CO 62a_100011996772_100011218213 [0,2,0,0,0,0|2,0,0]=4 14911 B12R1.121 CSCSc1ccncc1CO 62a_100000117392_100011218213 [0,2,0,0,0,0|2,0,0]=4 14912 B12R1.121 CSCSc1ccncc1CO 62a_100011218213_100000117392 [0,2,0,0,0,0|2,0,0]=4 14913 B12R1.121 CSCSc1cnccc1CO 62a_100009873359_100011218213 [0,2,0,0,0,0|2,0,0]=4 14914 B12R1.121 CSCSc1cnccc1CO 62a_100011218213_100009873359 [0,2,0,0,0,0|2,0,0]=4 14915 B12R1.121 CSCSc1ncccc1CO 62a_100000748726_100011218213 [0,2,0,0,0,0|2,0,0]=4 14916 B12R1.121 CSCSc1ncccc1CO 62a_100011218213_100000748726 [0,2,0,0,0,0|2,0,0]=4 14917 B12R1.121 CSc1ccccc1CCC=O 62a_100011713448_200000210301 [0,2,0,0,0,0|0,1,1]=4 14918 B12R1.121 CSc1ccccc1CCC=O 62a_200000210301_100011713448 [0,2,0,0,0,0|0,1,1]=4 14919 B12R1.121 CSc1ccccc1CCCO 62a_100000699526_200000210301 [0,2,0,0,0,0|0,1,0]=3 14920 B12R1.121 CSc1ccccc1CCCO 62a_200000210301_100000699526 [0,2,0,0,0,0|0,1,0]=3 14921 B12R1.121 CSc1ccccc1CNCF 34a_102495365025_100015361967 [0,2,0,0,0,0|1,1,0]=4 14922 B12R1.121 CSc1ccccc1COCF 34a_100000699167_100015361967 [0,2,0,0,0,0|1,1,0]=4 14923 B12R1.121 CSc1ccccc1CSCF 62a_100000699184_100015361967 [0,2,0,0,0,0|1,1,0]=4 14924 B12R1.121 CSc1ccccc1CSCF 62a_100015361967_100000699184 [0,2,0,0,0,0|1,1,0]=4 14925 B12R1.121 CSc1ccccc1NCCF 34a_100000211160_100011217306 [0,2,0,0,0,0|1,1,0]=4 14926 B12R1.121 CSc1ccccc1NCCO 34a_100000211160_100000211926 [0,2,0,0,0,0|1,1,0]=4 14927 B12R1.121 CSc1ccccc1OCCF 34a_100011216402_100011217306 [0,2,0,0,0,0|1,1,0]=4 14928 B12R1.121 CSc1ccccc1OCCN 62a_100000744007_200000210301 [0,2,0,0,0,0|1,1,0]=4 14929 B12R1.121 CSc1ccccc1OCCN 62a_200000210301_100000744007 [0,2,0,0,0,0|1,1,0]=4 14930 B12R1.121 CSc1ccccc1OCCO 34a_100011216402_100000211926 [0,2,0,0,0,0|1,1,0]=4 14931 B12R1.121 CSc1ccccc1OCCO 62a_100000230753_200000210301 [0,2,0,0,0,0|1,1,0]=4 14932 B12R1.121 CSc1ccccc1OCCO 62a_200000210301_100000230753 [0,2,0,0,0,0|1,1,0]=4 14933 B12R1.121 CSc1ccccc1SCCF 62a_100011217306_100011217816 [0,2,0,0,0,0|1,1,0]=4 14934 B12R1.121 CSc1ccccc1SCCF 62a_100011217816_100011217306 [0,2,0,0,0,0|1,1,0]=4 14935 B12R1.121 CSc1ccccc1SCCO 62a_100000211926_100011217816 [0,2,0,0,0,0|1,1,0]=4 14936 B12R1.121 CSc1ccccc1SCCO 62a_100011217816_100000211926 [0,2,0,0,0,0|1,1,0]=4 14937 B12R1.121 CSc1ccccc1SCCO 62a_200000210301_200000230852 [0,2,0,0,0,0|1,1,0]=4 14938 B12R1.121 CSc1ccccc1SCCO 62a_200000230852_200000210301 [0,2,0,0,0,0|1,1,0]=4 14939 B12R1.121 FCOCc1ccccc1CBr 34a_100009816955_100015361967 [0,2,0,0,0,0|2,0,0]=4 14940 B12R1.121 FCOCc1ccccc1CBr 7a_100009816955_100015361967 [0,2,0,0,0,0|2,0,0]=4 14941 B12R1.121 N#CCSc1ccccc1CO 62a_100000187465_100011215382 [0,2,0,0,0,0|1,0,1]=4 14942 B12R1.121 N#CCSc1ccccc1CO 62a_100011215382_100000187465 [0,2,0,0,0,0|1,0,1]=4 14943 B12R1.121 N#Cc1ccccc1CNCF 34a_100016989011_100015361967 [0,2,0,0,0,0|2,0,0]=4 14944 B12R1.121 N#Cc1ccccc1COCF 34a_200011269968_100015361967 [0,2,0,0,0,0|2,0,0]=4 14945 B12R1.121 N#Cc1ccccc1COCF 7a_200011269968_100015361967 [0,2,0,0,0,0|2,0,0]=4 14946 B12R1.121 N#Cc1ccccc1CSCF 62a_100000186380_100015361967 [0,2,0,0,0,0|2,0,0]=4 14947 B12R1.121 N#Cc1ccccc1CSCF 62a_100015361967_100000181865 [0,2,0,0,0,0|2,0,0]=4 14948 B12R1.121 N#Cc1ccccc1NCCF 34a_100000211148_100011217306 [0,2,0,0,0,0|2,0,0]=4 14949 B12R1.121 N#Cc1ccccc1NCCO 34a_100000211148_100000211926 [0,2,0,0,0,0|2,0,0]=4 14950 B12R1.121 N#Cc1ccccc1OCCF 34a_100000211048_100011217306 [0,2,0,0,0,0|2,0,0]=4 14951 B12R1.121 N#Cc1ccccc1OCCF 7a_100000211048_100011217306 [0,2,0,0,0,0|2,0,0]=4 14952 B12R1.121 N#Cc1ccccc1OCCO 34a_100000211048_100000211926 [0,2,0,0,0,0|2,0,0]=4 14953 B12R1.121 N#Cc1ccccc1OCCO 7a_100000211048_100000211926 [0,2,0,0,0,0|2,0,0]=4 14954 B12R1.121 N#Cc1ccccc1SCCF 62a_100011217306_100000188569 [0,2,0,0,0,0|2,0,0]=4 14955 B12R1.121 N#Cc1ccccc1SCCO 62a_100000211926_100000188569 [0,2,0,0,0,0|2,0,0]=4 14956 B12R1.121 NCc1ccccc1COCF 34a_100000743596_100015361967 [0,2,0,0,0,0|2,0,0]=4 14957 B12R1.121 NCc1ccccc1OCCF 34a_100000185550_100011217306 [0,2,0,0,0,0|2,0,0]=4 14958 B12R1.121 NCc1ccccc1OCCO 34a_100000185550_100000211926 [0,2,0,0,0,0|2,0,0]=4 14959 B12R1.121 NCc1ccccc1SCCF 62a_100000689332_100011217306 [0,2,0,0,0,0|2,0,0]=4 14960 B12R1.121 NCc1ccccc1SCCF 62a_100011217306_100000689332 [0,2,0,0,0,0|2,0,0]=4 14961 B12R1.121 NCc1ccccc1SCCO 62a_100000211926_100000689332 [0,2,0,0,0,0|2,0,0]=4 14962 B12R1.121 NCc1ccccc1SCCO 62a_100000689332_100000211926 [0,2,0,0,0,0|2,0,0]=4 14963 B12R1.121 NNc1ccccc1SCCF 62a_100000241748_100011217306 [0,2,0,0,0,0|2,0,0]=4 14964 B12R1.121 NNc1ccccc1SCCF 62a_100011217306_100000241748 [0,2,0,0,0,0|2,0,0]=4 14965 B12R1.121 NNc1ccccc1SCCO 62a_100000211926_100000241748 [0,2,0,0,0,0|2,0,0]=4 14966 B12R1.121 NNc1ccccc1SCCO 62a_100000241748_100000211926 [0,2,0,0,0,0|2,0,0]=4 14967 B12R1.121 O=CCNc1ccccc1CO 34a_100000212039_200009817547 [0,2,0,0,0,0|1,0,1]=4 14968 B12R1.121 O=CCOc1ccccc1CO 34a_100011216872_200009817547 [0,2,0,0,0,0|1,0,1]=4 14969 B12R1.121 O=CCSc1ccccc1CO 62a_100000187465_200015260668 [0,2,0,0,0,0|1,0,1]=4 14970 B12R1.121 O=CCSc1ccccc1CO 62a_200015260668_100000187465 [0,2,0,0,0,0|1,0,1]=4 14971 B12R1.121 O=Cc1ccccc1CSCF 62a_100015361967_200009853537 [0,2,0,0,0,0|1,0,1]=4 14972 B12R1.121 O=Cc1ccccc1CSCF 62a_200009853537_100015361967 [0,2,0,0,0,0|1,0,1]=4 14973 B12R1.121 O=Cc1ccccc1SCCF 62a_100000210073_100011217306 [0,2,0,0,0,0|1,0,1]=4 14974 B12R1.121 O=Cc1ccccc1SCCF 62a_100011217306_100000210073 [0,2,0,0,0,0|1,0,1]=4 14975 B12R1.121 O=Cc1ccccc1SCCO 62a_100000210073_100000211926 [0,2,0,0,0,0|1,0,1]=4 14976 B12R1.121 O=Cc1ccccc1SCCO 62a_100000211926_100000210073 [0,2,0,0,0,0|1,0,1]=4 14977 B12R1.121 OCCNc1ccccc1CO 34a_100000212039_100000211926 [0,2,0,0,0,0|1,0,0]=3 14978 B12R1.121 OCCNc1ccncc1CO 27a_100000210304_100000117392 [0,2,0,0,0,0|2,0,0]=4 14979 B12R1.121 OCCOc1ccccc1CO 34a_100011216872_100000211926 [0,2,0,0,0,0|1,0,0]=3 14980 B12R1.121 OCCOc1cccnc1CO 34a_100000731849_100000211926 [0,2,0,0,0,0|2,0,0]=4 14981 B12R1.121 OCCOc1cnccc1CO 34a_100000078615_100000211926 [0,2,0,0,0,0|2,0,0]=4 14982 B12R1.121 OCCSc1ccccc1CO 62a_100000187465_100000211926 [0,2,0,0,0,0|1,0,0]=3 14983 B12R1.121 OCCSc1ccccc1CO 62a_100000211926_100000187465 [0,2,0,0,0,0|1,0,0]=3 14984 B12R1.121 OCCSc1cccnc1CO 62a_100000211926_100011996772 [0,2,0,0,0,0|2,0,0]=4 14985 B12R1.121 OCCSc1cccnc1CO 62a_100011996772_100000211926 [0,2,0,0,0,0|2,0,0]=4 14986 B12R1.121 OCCSc1ccncc1CO 62a_100000117392_100000211926 [0,2,0,0,0,0|2,0,0]=4 14987 B12R1.121 OCCSc1ccncc1CO 62a_100000211926_100000117392 [0,2,0,0,0,0|2,0,0]=4 14988 B12R1.121 OCCSc1cnccc1CO 62a_100000211926_100009873359 [0,2,0,0,0,0|2,0,0]=4 14989 B12R1.121 OCCSc1cnccc1CO 62a_100009873359_100000211926 [0,2,0,0,0,0|2,0,0]=4 14990 B12R1.121 OCCSc1ncccc1CO 62a_100000211926_100000748726 [0,2,0,0,0,0|2,0,0]=4 14991 B12R1.121 OCCSc1ncccc1CO 62a_100000748726_100000211926 [0,2,0,0,0,0|2,0,0]=4 14992 B12R1.121 OCc1ccccc1CSCF 62a_100009816955_100015361967 [0,2,0,0,0,0|1,0,0]=3 14993 B12R1.121 OCc1ccccc1CSCF 62a_100015361967_100009816955 [0,2,0,0,0,0|1,0,0]=3 14994 B12R1.121 OCc1ccccc1NCCF 34a_100000212039_100011217306 [0,2,0,0,0,0|1,0,0]=3 14995 B12R1.121 OCc1ccccc1OCCF 34a_100011216872_100011217306 [0,2,0,0,0,0|1,0,0]=3 14996 B12R1.121 OCc1ccccc1SCCF 62a_100000187465_100011217306 [0,2,0,0,0,0|1,0,0]=3 14997 B12R1.121 OCc1ccccc1SCCF 62a_100011217306_100000187465 [0,2,0,0,0,0|1,0,0]=3 14998 B12R1.121 OCc1cccnc1SCCF 62a_100000748726_100011217306 [0,2,0,0,0,0|2,0,0]=4 14999 B12R1.121 OCc1cccnc1SCCF 62a_100011217306_100000748726 [0,2,0,0,0,0|2,0,0]=4 15000 B12R1.121 OCc1ccncc1OCCF 34a_100000078615_100011217306 [0,2,0,0,0,0|2,0,0]=4 15001 B12R1.121 OCc1ccncc1SCCF 62a_100009873359_100011217306 [0,2,0,0,0,0|2,0,0]=4 15002 B12R1.121 OCc1ccncc1SCCF 62a_100011217306_100009873359 [0,2,0,0,0,0|2,0,0]=4 15003 B12R1.121 OCc1cnccc1SCCF 62a_100000117392_100011217306 [0,2,0,0,0,0|2,0,0]=4 15004 B12R1.121 OCc1cnccc1SCCF 62a_100011217306_100000117392 [0,2,0,0,0,0|2,0,0]=4 15005 B12R1.121 OCc1ncccc1OCCF 34a_100000731849_100011217306 [0,2,0,0,0,0|2,0,0]=4 15006 B12R1.121 OCc1ncccc1SCCF 62a_100011217306_100011996772 [0,2,0,0,0,0|2,0,0]=4 15007 B12R1.121 OCc1ncccc1SCCF 62a_100011996772_100011217306 [0,2,0,0,0,0|2,0,0]=4 15008 B12R1.121 [13CH3]NCCc1ccccc1[Pd]Cl 2230a_106741704370_200025704644 [0,2,0,0,0,0|1,0,0]=3 15009 B12R1.121 [13CH3]NCCc1ccccc1[Pd]Cl 34a_106741704370_200025704644 [0,2,0,0,0,0|1,0,0]=3 15010 B12R1.121 [13CH3]NCCc1ccccc1[Pd]Cl 7a_106741704370_200025704644 [0,2,0,0,0,0|1,0,0]=3 15011 B12R1.121 [13CH3]Nc1ccccc1OCCF 34a_100012000959_200025704644 [0,2,0,0,0,0|2,0,0]=4 15012 B12R1.121 [13CH3]Nc1ccccc1OCCO 34a_100132302172_200025704644 [0,2,0,0,0,0|2,0,0]=4 15013 B12R1.121 [13CH3]Oc1ccccc1OCCO 34a_100000181789_200025704644 [0,2,0,0,0,0|1,0,0]=3 15014 B12R1.121 [13CH3]Oc1ccccc1OCCO 7a_100000181789_200025704644 [0,2,0,0,0,0|1,0,0]=3 15015 B12R1.121 [13CH3]SCCc1ccccc1C#N 62a_200025704644_200013032965 [0,2,0,0,0,0|1,0,0]=3 15016 B12R1.121 [13CH3]SCCc1ccccc1C=O 62a_100010186698_200025704644 [0,2,0,0,0,0|0,0,1]=3 15017 B12R1.121 [13CH3]SCCc1ccccc1C=O 62a_200025704644_100010186698 [0,2,0,0,0,0|0,0,1]=3 15018 B12R1.121 [13CH3]Sc1ccccc1CCC=O 62a_100011713448_200025704644 [0,2,0,0,0,0|0,1,1]=4 15019 B12R1.121 [13CH3]Sc1ccccc1CCC=O 62a_200025704644_100011713448 [0,2,0,0,0,0|0,1,1]=4 15020 B12R1.121 [13CH3]Sc1ccccc1CCCO 62a_100000699526_200025704644 [0,2,0,0,0,0|0,1,0]=3 15021 B12R1.121 [13CH3]Sc1ccccc1CCCO 62a_200025704644_100000699526 [0,2,0,0,0,0|0,1,0]=3 15022 B12R1.121 [13CH3]Sc1ccccc1OCCN 62a_100000744007_200025704644 [0,2,0,0,0,0|1,1,0]=4 15023 B12R1.121 [13CH3]Sc1ccccc1OCCN 62a_200025704644_100000744007 [0,2,0,0,0,0|1,1,0]=4 15024 B12R1.121 [13CH3]Sc1ccccc1OCCO 62a_100000230753_200025704644 [0,2,0,0,0,0|1,1,0]=4 15025 B12R1.121 [13CH3]Sc1ccccc1OCCO 62a_200025704644_100000230753 [0,2,0,0,0,0|1,1,0]=4 15026 B12R1.121 [13CH3]Sc1ccccc1SCCO 62a_200000230852_200025704644 [0,2,0,0,0,0|1,1,0]=4 15027 B12R1.121 [13CH3]Sc1ccccc1SCCO 62a_200025704644_200000230852 [0,2,0,0,0,0|1,1,0]=4 15028 B12R1.125 C=C(C)CNc1ccccc1Br 34a_100000210017_100000748629 [0,2,0,0,0,0|1,0,1]=4 15029 B12R1.125 C=C(C)CNc1ccccc1C 34a_100015192222_100000748629 [0,2,0,0,0,0|1,0,1]=4 15030 B12R1.125 C=C(C)CNc1ccccc1Cl 34a_100000185783_100000748629 [0,2,0,0,0,0|1,0,1]=4 15031 B12R1.125 C=C(C)CNc1ccccc1F 34a_100000210422_100000748629 [0,2,0,0,0,0|1,0,1]=4 15032 B12R1.125 C=C(C)CNc1ccccc1I 34a_100000210053_100000748629 [0,2,0,0,0,0|1,0,1]=4 15033 B12R1.125 C=C(C)CNc1ccccc1O 34a_100000185747_100000748629 [0,2,0,0,0,0|0,0,1]=3 15034 B12R1.125 C=C(C)COc1ccccc1Br 34a_100000181306_100000748629 [0,2,0,0,0,0|1,0,1]=4 15035 B12R1.125 C=C(C)COc1ccccc1Br 7a_100000181306_100000748629 [0,2,0,0,0,0|1,0,1]=4 15036 B12R1.125 C=C(C)COc1ccccc1C 34a_100000210338_100000748629 [0,2,0,0,0,0|1,0,1]=4 15037 B12R1.125 C=C(C)COc1ccccc1C 7a_100000210338_100000748629 [0,2,0,0,0,0|1,0,1]=4 15038 B12R1.125 C=C(C)COc1ccccc1Cl 34a_100000210172_100000748629 [0,2,0,0,0,0|1,0,1]=4 15039 B12R1.125 C=C(C)COc1ccccc1Cl 7a_100000210172_100000748629 [0,2,0,0,0,0|1,0,1]=4 15040 B12R1.125 C=C(C)COc1ccccc1F 34a_100000210171_100000748629 [0,2,0,0,0,0|1,0,1]=4 15041 B12R1.125 C=C(C)COc1ccccc1F 7a_100000210171_100000748629 [0,2,0,0,0,0|1,0,1]=4 15042 B12R1.125 C=C(C)COc1ccccc1I 34a_100000739446_100000748629 [0,2,0,0,0,0|1,0,1]=4 15043 B12R1.125 C=C(C)COc1ccccc1I 7a_100000739446_100000748629 [0,2,0,0,0,0|1,0,1]=4 15044 B12R1.125 C=C(C)COc1ccccc1N 34a_100000185747_100000748629 [0,2,0,0,0,0|1,0,1]=4 15045 B12R1.125 C=C(C)COc1ccccc1N 7a_100000185747_100000748629 [0,2,0,0,0,0|1,0,1]=4 15046 B12R1.125 C=C(C)CSc1ccccc1Br 62a_100000695589_100000211660 [0,2,0,0,0,0|1,0,1]=4 15047 B12R1.125 C=C(C)CSc1ccccc1Br 62a_100000748629_100000695589 [0,2,0,0,0,0|1,0,1]=4 15048 B12R1.125 C=C(C)CSc1ccccc1C 62a_100000210755_100000211660 [0,2,0,0,0,0|1,0,1]=4 15049 B12R1.125 C=C(C)CSc1ccccc1C 62a_100000748629_100000210755 [0,2,0,0,0,0|1,0,1]=4 15050 B12R1.125 C=C(C)CSc1ccccc1Cl 62a_100000748629_100000764095 [0,2,0,0,0,0|1,0,1]=4 15051 B12R1.125 C=C(C)CSc1ccccc1Cl 62a_100000764095_100000211660 [0,2,0,0,0,0|1,0,1]=4 15052 B12R1.125 C=C(C)CSc1ccccc1F 62a_100000748629_100011215700 [0,2,0,0,0,0|1,0,1]=4 15053 B12R1.125 C=C(C)CSc1ccccc1F 62a_100011215700_100000211660 [0,2,0,0,0,0|1,0,1]=4 15054 B12R1.125 C=C(C)CSc1ccccc1N 62a_100000210017_100000211660 [0,2,0,0,0,0|1,0,1]=4 15055 B12R1.125 C=C(C)CSc1ccccc1N 62a_100000748629_100000210017 [0,2,0,0,0,0|1,0,1]=4 15056 B12R1.125 C=C(C)CSc1ccccc1O 62a_100000739446_100000211660 [0,2,0,0,0,0|0,0,1]=3 15057 B12R1.125 C=C(C)CSc1ccccc1O 62a_100000748629_100000739446 [0,2,0,0,0,0|0,0,1]=3 15058 B12R1.125 C=C(C)CSc1cccnc1O 62a_100000748629_100000760158 [0,2,0,0,0,0|1,0,1]=4 15059 B12R1.125 C=C(C)CSc1cccnc1O 62a_100000760158_100000211660 [0,2,0,0,0,0|1,0,1]=4 15060 B12R1.125 C=C(C)CSc1ccncc1O 62a_100000748629_100009817591 [0,2,0,0,0,0|1,0,1]=4 15061 B12R1.125 C=C(C)CSc1ccncc1O 62a_100009817591_100000211660 [0,2,0,0,0,0|1,0,1]=4 15062 B12R1.125 C=C(C)CSc1ncccc1O 62a_100000034122_100000211660 [0,2,0,0,0,0|1,0,1]=4 15063 B12R1.125 C=C(C)CSc1ncccc1O 62a_100000748629_100000034122 [0,2,0,0,0,0|1,0,1]=4 15064 B12R1.125 C=C(F)CNc1ccccc1O 34a_100000185747_100009893438 [0,2,0,0,0,0|0,0,2]=4 15065 B12R1.125 C=C(F)CSc1ccccc1O 62a_100000042424_100000739446 [0,2,0,0,0,0|0,0,2]=4 15066 B12R1.125 C=C(F)CSc1ccccc1O 62a_100000739446_100000042424 [0,2,0,0,0,0|0,0,2]=4 15067 B12R1.125 CC(=O)C=Cc1ccccc1O 1458a_100016263591_200000210301 [0,2,0,0,0,0|0,0,2]=4 15068 B12R1.125 CC(=O)CCc1ccccc1Br 1458a_100000070787_100012161201 [0,2,0,0,0,0|1,0,0]=3 15069 B12R1.125 CC(=O)CCc1ccccc1Br 1458a_100000740810_200000210301 [0,2,0,0,0,0|1,0,0]=3 15070 B12R1.125 CC(=O)CCc1ccccc1C 1458a_100000070787_100011713688 [0,2,0,0,0,0|1,0,0]=3 15071 B12R1.125 CC(=O)CCc1ccccc1C 1458a_100000748742_200000210301 [0,2,0,0,0,0|1,0,0]=3 15072 B12R1.125 CC(=O)CCc1ccccc1Cl 1458a_100000070787_100011713703 [0,2,0,0,0,0|1,0,0]=3 15073 B12R1.125 CC(=O)CCc1ccccc1Cl 1458a_100000184300_200000210301 [0,2,0,0,0,0|1,0,0]=3 15074 B12R1.125 CC(=O)CCc1ccccc1F 1458a_100000070787_100000720011 [0,2,0,0,0,0|1,0,0]=3 15075 B12R1.125 CC(=O)CCc1ccccc1F 1458a_100000189703_200000210301 [0,2,0,0,0,0|1,0,0]=3 15076 B12R1.125 CC(=O)CCc1ccccc1I 1458a_100000037306_200000210301 [0,2,0,0,0,0|1,0,0]=3 15077 B12R1.125 CC(=O)CCc1ccccc1O 1458a_100000070787_100000722297 [0,2,0,0,0,0|0,0,0]=2 15078 B12R1.125 CC(=O)CCc1ccccc1O 1458a_100000181328_200000210301 [0,2,0,0,0,0|0,0,0]=2 15079 B12R1.125 CC(=O)CCn1ccccc1=O 1458a_100000738505_200000210301 [0,2,0,0,0,0|1,0,1]=4 15080 B12R1.125 CC(=O)COc1ccccc1Br 1458a_100000216496_200000210301 [0,2,0,0,0,0|1,0,1]=4 15081 B12R1.125 CC(=O)COc1ccccc1C 1458a_100000182418_200000210301 [0,2,0,0,0,0|1,0,1]=4 15082 B12R1.125 CC(=O)COc1ccccc1Cl 1458a_100000185159_200000210301 [0,2,0,0,0,0|1,0,1]=4 15083 B12R1.125 CC(=O)COc1ccccc1F 1458a_100000182486_200000210301 [0,2,0,0,0,0|1,0,1]=4 15084 B12R1.125 CC(=O)COc1ccccc1O 1458a_100000183020_200000210301 [0,2,0,0,0,0|0,0,1]=3 15085 B12R1.125 CC(=O)CSc1ccccc1C 1458a_100000183026_200000210301 [0,2,0,0,0,0|1,0,1]=4 15086 B12R1.125 CC(=O)CSc1ccccc1F 1458a_100000179528_200000210301 [0,2,0,0,0,0|1,0,1]=4 15087 B12R1.125 CC(=O)CSc1ccccc1O 1458a_100000695322_200000210301 [0,2,0,0,0,0|0,0,1]=3 15088 B12R1.125 CC(=O)NCc1ccccc1Br 11a_100000689332_100015343762 [0,2,0,0,0,0|1,0,1]=4 15089 B12R1.125 CC(=O)NCc1ccccc1Br 1626a_100000689332_100015343762 [0,2,0,0,0,0|1,0,1]=4 15090 B12R1.125 CC(=O)NCc1ccccc1Br 240690a_100000689332_100015343762 [0,2,0,0,0,0|1,0,1]=4 15091 B12R1.125 CC(=O)NCc1ccccc1Br 527a_100000689332_100103153847 [0,2,0,0,0,0|1,0,1]=4 15092 B12R1.125 CC(=O)NCc1ccccc1C 11a_100000174972_100015343762 [0,2,0,0,0,0|1,0,1]=4 15093 B12R1.125 CC(=O)NCc1ccccc1C 1626a_100000174972_100015343762 [0,2,0,0,0,0|1,0,1]=4 15094 B12R1.125 CC(=O)NCc1ccccc1C 240690a_100000174972_100015343762 [0,2,0,0,0,0|1,0,1]=4 15095 B12R1.125 CC(=O)NCc1ccccc1C 527a_100000174972_100103153847 [0,2,0,0,0,0|1,0,1]=4 15096 B12R1.125 CC(=O)NCc1ccccc1Cl 11a_100000174879_100015343762 [0,2,0,0,0,0|1,0,1]=4 15097 B12R1.125 CC(=O)NCc1ccccc1Cl 1626a_100000174879_100015343762 [0,2,0,0,0,0|1,0,1]=4 15098 B12R1.125 CC(=O)NCc1ccccc1Cl 240690a_100000174879_100015343762 [0,2,0,0,0,0|1,0,1]=4 15099 B12R1.125 CC(=O)NCc1ccccc1Cl 527a_100000174879_100103153847 [0,2,0,0,0,0|1,0,1]=4 15100 B12R1.125 CC(=O)NCc1ccccc1F 11a_100000174869_100015343762 [0,2,0,0,0,0|1,0,1]=4 15101 B12R1.125 CC(=O)NCc1ccccc1F 1626a_100000174869_100015343762 [0,2,0,0,0,0|1,0,1]=4 15102 B12R1.125 CC(=O)NCc1ccccc1F 240690a_100000174869_100015343762 [0,2,0,0,0,0|1,0,1]=4 15103 B12R1.125 CC(=O)NCc1ccccc1F 527a_100000174869_100103153847 [0,2,0,0,0,0|1,0,1]=4 15104 B12R1.125 CC(=O)NCc1ccccc1I 11a_100015347259_100015343762 [0,2,0,0,0,0|1,0,1]=4 15105 B12R1.125 CC(=O)NCc1ccccc1I 1626a_100015347259_100015343762 [0,2,0,0,0,0|1,0,1]=4 15106 B12R1.125 CC(=O)NCc1ccccc1I 240690a_100015347259_100015343762 [0,2,0,0,0,0|1,0,1]=4 15107 B12R1.125 CC(=O)NCc1ccccc1I 527a_100015347259_100103153847 [0,2,0,0,0,0|1,0,1]=4 15108 B12R1.125 CC(=O)NCc1ccccc1O 240690a_100000185550_100015343762 [0,2,0,0,0,0|0,0,1]=3 15109 B12R1.125 CC(=O)NCc1ccccc1O 271570a_203496583355_100011237613 [0,2,0,0,0,0|0,0,1]=3 15110 B12R1.125 CC(=O)NCc1ccccc1O 527a_100000185550_100103153847 [0,2,0,0,0,0|0,0,1]=3 15111 B12R1.125 CC(C)C=Cc1ccccc1Br 271570a_100016257149_100000695589 [0,2,0,0,0,0|1,0,1]=4 15112 B12R1.125 CC(C)C=Cc1ccccc1Cl 271570a_100016257149_100000764095 [0,2,0,0,0,0|1,0,1]=4 15113 B12R1.125 CC(C)C=Cc1ccccc1F 271570a_100016257149_100011215700 [0,2,0,0,0,0|1,0,1]=4 15114 B12R1.125 CC(C)C=Cc1ccccc1N 271570a_100016257149_100000210017 [0,2,0,0,0,0|1,0,1]=4 15115 B12R1.125 CC(C)C=Cc1ccccc1O 271570a_100016257149_100000739446 [0,2,0,0,0,0|0,0,1]=3 15116 B12R1.125 CC(C)C=Cc1ccncc1O 271570a_100016257149_100009817591 [0,2,0,0,0,0|1,0,1]=4 15117 B12R1.125 CC(C)C=Cc1ncccc1O 271570a_100016257149_100000034122 [0,2,0,0,0,0|1,0,1]=4 15118 B12R1.125 CC(C)CCc1ncncc1O 271570a_203496583355_200009816994 [0,2,0,0,0,0|2,0,0]=4 15119 B12R1.125 CC(C)CNc1ccccc1Br 34a_100000210017_100000210624 [0,2,0,0,0,0|1,0,0]=3 15120 B12R1.125 CC(C)CNc1ccccc1Cl 34a_100000185783_100000210624 [0,2,0,0,0,0|1,0,0]=3 15121 B12R1.125 CC(C)CNc1ccccc1F 34a_100000210422_100000210624 [0,2,0,0,0,0|1,0,0]=3 15122 B12R1.125 CC(C)CNc1ccccc1I 34a_100000210053_100000210624 [0,2,0,0,0,0|1,0,0]=3 15123 B12R1.125 CC(C)CNc1ccccc1O 34a_100000185747_100000210624 [0,2,0,0,0,0|0,0,0]=2 15124 B12R1.125 CC(C)CNc1ccncc1Br 27a_100000210953_100000726257 [0,2,0,0,0,0|2,0,0]=4 15125 B12R1.125 CC(C)CNc1ccncc1F 27a_100000210953_100000035921 [0,2,0,0,0,0|2,0,0]=4 15126 B12R1.125 CC(C)CNc1ncccc1Br 27a_100000210953_100000696092 [0,2,0,0,0,0|2,0,0]=4 15127 B12R1.125 CC(C)COc1cccc[n+]1[O-] 7a_100000211761_100000210760 [0,2,0,0,0,0|1,0,1]=4 15128 B12R1.125 CC(C)COc1ccccc1Br 34a_100000181306_100000210624 [0,2,0,0,0,0|1,0,0]=3 15129 B12R1.125 CC(C)COc1ccccc1Br 7a_100000181306_100000210760 [0,2,0,0,0,0|1,0,0]=3 15130 B12R1.125 CC(C)COc1ccccc1Cl 34a_100000210172_100000210624 [0,2,0,0,0,0|1,0,0]=3 15131 B12R1.125 CC(C)COc1ccccc1Cl 7a_100000210172_100000210760 [0,2,0,0,0,0|1,0,0]=3 15132 B12R1.125 CC(C)COc1ccccc1F 34a_100000210171_100000210624 [0,2,0,0,0,0|1,0,0]=3 15133 B12R1.125 CC(C)COc1ccccc1F 7a_100000210171_100000210760 [0,2,0,0,0,0|1,0,0]=3 15134 B12R1.125 CC(C)COc1ccccc1I 34a_100000739446_100000210624 [0,2,0,0,0,0|1,0,0]=3 15135 B12R1.125 CC(C)COc1ccccc1I 7a_100000739446_100000210760 [0,2,0,0,0,0|1,0,0]=3 15136 B12R1.125 CC(C)COc1ccccc1N 34a_100000185747_100000210624 [0,2,0,0,0,0|1,0,0]=3 15137 B12R1.125 CC(C)COc1ccccc1N 7a_100000185747_100000210760 [0,2,0,0,0,0|1,0,0]=3 15138 B12R1.125 CC(C)COc1cccnc1Br 34a_100000744436_100000210624 [0,2,0,0,0,0|2,0,0]=4 15139 B12R1.125 CC(C)COc1cccnc1Br 7a_100000744436_100000210760 [0,2,0,0,0,0|2,0,0]=4 15140 B12R1.125 CC(C)COc1cccnc1Cl 34a_100000757616_100000210624 [0,2,0,0,0,0|2,0,0]=4 15141 B12R1.125 CC(C)COc1cccnc1Cl 7a_100000757616_100000210760 [0,2,0,0,0,0|2,0,0]=4 15142 B12R1.125 CC(C)COc1cccnc1F 34a_100000061740_100000210624 [0,2,0,0,0,0|2,0,0]=4 15143 B12R1.125 CC(C)COc1cccnc1F 7a_100000061740_100000210760 [0,2,0,0,0,0|2,0,0]=4 15144 B12R1.125 CC(C)COc1cccnc1I 34a_100000034122_100000210624 [0,2,0,0,0,0|2,0,0]=4 15145 B12R1.125 CC(C)COc1cccnc1I 7a_100000034122_100000210760 [0,2,0,0,0,0|2,0,0]=4 15146 B12R1.125 CC(C)COc1cccnc1N 34a_100000211975_100000210624 [0,2,0,0,0,0|2,0,0]=4 15147 B12R1.125 CC(C)COc1cccnc1N 7a_100000211975_100000210760 [0,2,0,0,0,0|2,0,0]=4 15148 B12R1.125 CC(C)COc1cccoc1=O 34a_100000077404_100000210624 [0,2,0,0,0,0|1,0,1]=4 15149 B12R1.125 CC(C)COc1cccoc1=O 7a_100000077404_100000210760 [0,2,0,0,0,0|1,0,1]=4 15150 B12R1.125 CC(C)COc1ccncc1Br 34a_100011996408_100000210624 [0,2,0,0,0,0|2,0,0]=4 15151 B12R1.125 CC(C)COc1ccncc1Cl 34a_100011997054_100000210624 [0,2,0,0,0,0|2,0,0]=4 15152 B12R1.125 CC(C)COc1ccncc1F 34a_200000081243_100000210624 [0,2,0,0,0,0|2,0,0]=4 15153 B12R1.125 CC(C)COc1cnccc1Cl 34a_100011996695_100000210624 [0,2,0,0,0,0|2,0,0]=4 15154 B12R1.125 CC(C)COc1cnccc1I 34a_100000050107_100000210624 [0,2,0,0,0,0|2,0,0]=4 15155 B12R1.125 CC(C)COc1cnccc1N 34a_100000753702_100000210624 [0,2,0,0,0,0|2,0,0]=4 15156 B12R1.125 CC(C)COc1coccc1=O 34a_100000060831_100000210624 [0,2,0,0,0,0|1,0,1]=4 15157 B12R1.125 CC(C)COc1ncccc1Cl 34a_100011290957_100000210624 [0,2,0,0,0,0|2,0,0]=4 15158 B12R1.125 CC(C)COc1ncccc1F 34a_100011219419_100000210624 [0,2,0,0,0,0|2,0,0]=4 15159 B12R1.125 CC(C)COc1ncccc1N 34a_100000746358_100000210624 [0,2,0,0,0,0|2,0,0]=4 15160 B12R1.125 CC(C)CSc1c[nH]ccc1=O 62a_100000210624_100009998708 [0,2,0,0,0,0|1,0,1]=4 15161 B12R1.125 CC(C)CSc1c[nH]ccc1=O 62a_100009998708_100000210760 [0,2,0,0,0,0|1,0,1]=4 15162 B12R1.125 CC(C)CSc1c[nH]ccc1=S 62a_100000210624_200012280681 [0,2,0,0,0,0|1,1,0]=4 15163 B12R1.125 CC(C)CSc1c[nH]ccc1=S 62a_200012280681_100000210760 [0,2,0,0,0,0|1,1,0]=4 15164 B12R1.125 CC(C)CSc1cccc[n+]1C 62a_100000210624_100000212160 [0,2,0,0,0,0|2,0,0]=4 15165 B12R1.125 CC(C)CSc1cccc[n+]1[O-] 62a_100000210624_200000042595 [0,2,0,0,0,0|1,0,1]=4 15166 B12R1.125 CC(C)CSc1ccccc1Br 62a_100000210624_100000695589 [0,2,0,0,0,0|1,0,0]=3 15167 B12R1.125 CC(C)CSc1ccccc1Br 62a_100000695589_100000210760 [0,2,0,0,0,0|1,0,0]=3 15168 B12R1.125 CC(C)CSc1ccccc1Cl 62a_100000210624_100000764095 [0,2,0,0,0,0|1,0,0]=3 15169 B12R1.125 CC(C)CSc1ccccc1Cl 62a_100000764095_100000210760 [0,2,0,0,0,0|1,0,0]=3 15170 B12R1.125 CC(C)CSc1ccccc1F 62a_100000210624_100011215700 [0,2,0,0,0,0|1,0,0]=3 15171 B12R1.125 CC(C)CSc1ccccc1F 62a_100011215700_100000210760 [0,2,0,0,0,0|1,0,0]=3 15172 B12R1.125 CC(C)CSc1ccccc1N 62a_100000210017_100000210760 [0,2,0,0,0,0|1,0,0]=3 15173 B12R1.125 CC(C)CSc1ccccc1N 62a_100000210624_100000210017 [0,2,0,0,0,0|1,0,0]=3 15174 B12R1.125 CC(C)CSc1ccccc1O 62a_100000210624_100000739446 [0,2,0,0,0,0|0,0,0]=2 15175 B12R1.125 CC(C)CSc1ccccc1O 62a_100000739446_100000210760 [0,2,0,0,0,0|0,0,0]=2 15176 B12R1.125 CC(C)CSc1cccnc1Br 62a_100000210624_100010202626 [0,2,0,0,0,0|2,0,0]=4 15177 B12R1.125 CC(C)CSc1cccnc1Br 62a_100010202626_100000210760 [0,2,0,0,0,0|2,0,0]=4 15178 B12R1.125 CC(C)CSc1cccnc1Cl 62a_100000036424_100000210760 [0,2,0,0,0,0|2,0,0]=4 15179 B12R1.125 CC(C)CSc1cccnc1Cl 62a_100000210624_100000036424 [0,2,0,0,0,0|2,0,0]=4 15180 B12R1.125 CC(C)CSc1cccnc1F 62a_100000210624_100009816115 [0,2,0,0,0,0|2,0,0]=4 15181 B12R1.125 CC(C)CSc1cccnc1F 62a_100009816115_100000210760 [0,2,0,0,0,0|2,0,0]=4 15182 B12R1.125 CC(C)CSc1cccnc1N 62a_100000045569_100000210760 [0,2,0,0,0,0|2,0,0]=4 15183 B12R1.125 CC(C)CSc1cccnc1N 62a_100000210624_100000045569 [0,2,0,0,0,0|2,0,0]=4 15184 B12R1.125 CC(C)CSc1cccnc1O 62a_100000210624_100000760158 [0,2,0,0,0,0|1,0,0]=3 15185 B12R1.125 CC(C)CSc1cccnc1O 62a_100000760158_100000210760 [0,2,0,0,0,0|1,0,0]=3 15186 B12R1.125 CC(C)CSc1ccncc1Br 62a_100000210624_100000726257 [0,2,0,0,0,0|2,0,0]=4 15187 B12R1.125 CC(C)CSc1ccncc1Br 62a_100000726257_100000210760 [0,2,0,0,0,0|2,0,0]=4 15188 B12R1.125 CC(C)CSc1ccncc1Cl 62a_100000210624_100000708259 [0,2,0,0,0,0|2,0,0]=4 15189 B12R1.125 CC(C)CSc1ccncc1Cl 62a_100000708259_100000210760 [0,2,0,0,0,0|2,0,0]=4 15190 B12R1.125 CC(C)CSc1ccncc1F 62a_100000047030_100000210760 [0,2,0,0,0,0|2,0,0]=4 15191 B12R1.125 CC(C)CSc1ccncc1F 62a_100000210624_100000047030 [0,2,0,0,0,0|2,0,0]=4 15192 B12R1.125 CC(C)CSc1ccncc1N 62a_100000210624_100000756074 [0,2,0,0,0,0|2,0,0]=4 15193 B12R1.125 CC(C)CSc1ccncc1N 62a_100000756074_100000210760 [0,2,0,0,0,0|2,0,0]=4 15194 B12R1.125 CC(C)CSc1ccncc1O 62a_100000210624_100009817591 [0,2,0,0,0,0|1,0,0]=3 15195 B12R1.125 CC(C)CSc1ccncc1O 62a_100009817591_100000210760 [0,2,0,0,0,0|1,0,0]=3 15196 B12R1.125 CC(C)CSc1cnccc1Br 62a_100000210624_100010138639 [0,2,0,0,0,0|2,0,0]=4 15197 B12R1.125 CC(C)CSc1cnccc1Br 62a_100010138639_100000210760 [0,2,0,0,0,0|2,0,0]=4 15198 B12R1.125 CC(C)CSc1cnccc1Cl 62a_100000210624_100009995489 [0,2,0,0,0,0|2,0,0]=4 15199 B12R1.125 CC(C)CSc1cnccc1Cl 62a_100009995489_100000210760 [0,2,0,0,0,0|2,0,0]=4 15200 B12R1.125 CC(C)CSc1cnccc1F 62a_100000210624_100009820683 [0,2,0,0,0,0|2,0,0]=4 15201 B12R1.125 CC(C)CSc1cnccc1F 62a_100009820683_100000210760 [0,2,0,0,0,0|2,0,0]=4 15202 B12R1.125 CC(C)CSc1cnccc1N 62a_100000047001_100000210760 [0,2,0,0,0,0|2,0,0]=4 15203 B12R1.125 CC(C)CSc1cnccc1N 62a_100000210624_100000047001 [0,2,0,0,0,0|2,0,0]=4 15204 B12R1.125 CC(C)CSc1cncnc1O 62a_100000210624_100000751107 [0,2,0,0,0,0|2,0,0]=4 15205 B12R1.125 CC(C)CSc1cncnc1O 62a_100000751107_100000210760 [0,2,0,0,0,0|2,0,0]=4 15206 B12R1.125 CC(C)CSc1ncccc1Br 62a_100000210624_100000696092 [0,2,0,0,0,0|2,0,0]=4 15207 B12R1.125 CC(C)CSc1ncccc1Br 62a_100000696092_100000210760 [0,2,0,0,0,0|2,0,0]=4 15208 B12R1.125 CC(C)CSc1ncccc1Cl 62a_100000210624_100011356963 [0,2,0,0,0,0|2,0,0]=4 15209 B12R1.125 CC(C)CSc1ncccc1Cl 62a_100011356963_100000210760 [0,2,0,0,0,0|2,0,0]=4 15210 B12R1.125 CC(C)CSc1ncccc1F 62a_100000210624_100000685392 [0,2,0,0,0,0|2,0,0]=4 15211 B12R1.125 CC(C)CSc1ncccc1F 62a_100000685392_100000210760 [0,2,0,0,0,0|2,0,0]=4 15212 B12R1.125 CC(C)CSc1ncccc1N 62a_100000210624_100000688686 [0,2,0,0,0,0|2,0,0]=4 15213 B12R1.125 CC(C)CSc1ncccc1N 62a_100000688686_100000210760 [0,2,0,0,0,0|2,0,0]=4 15214 B12R1.125 CC(C)CSc1ncccc1O 62a_100000034122_100000210760 [0,2,0,0,0,0|1,0,0]=3 15215 B12R1.125 CC(C)CSc1ncccc1O 62a_100000210624_100000034122 [0,2,0,0,0,0|1,0,0]=3 15216 B12R1.125 CC(C)NCc1ccccc1Br 207a_100138425928_100000211189 [0,2,0,0,0,0|1,0,0]=3 15217 B12R1.125 CC(C)NCc1ccccc1Br 2230a_100000689332_100000210206 [0,2,0,0,0,0|1,0,0]=3 15218 B12R1.125 CC(C)NCc1ccccc1Br 2230a_100138425928_100000184730 [0,2,0,0,0,0|1,0,0]=3 15219 B12R1.125 CC(C)NCc1ccccc1Br 34a_100000689332_100000210206 [0,2,0,0,0,0|1,0,0]=3 15220 B12R1.125 CC(C)NCc1ccccc1Br 34a_100138425928_100000184730 [0,2,0,0,0,0|1,0,0]=3 15221 B12R1.125 CC(C)NCc1ccccc1Cl 207a_100138425928_100000210073 [0,2,0,0,0,0|1,0,0]=3 15222 B12R1.125 CC(C)NCc1ccccc1Cl 2230a_100000174879_100000210206 [0,2,0,0,0,0|1,0,0]=3 15223 B12R1.125 CC(C)NCc1ccccc1Cl 2230a_100138425928_100000187162 [0,2,0,0,0,0|1,0,0]=3 15224 B12R1.125 CC(C)NCc1ccccc1Cl 34a_100000174879_100000210206 [0,2,0,0,0,0|1,0,0]=3 15225 B12R1.125 CC(C)NCc1ccccc1Cl 34a_100138425928_100000187162 [0,2,0,0,0,0|1,0,0]=3 15226 B12R1.125 CC(C)NCc1ccccc1F 207a_100138425928_100000210811 [0,2,0,0,0,0|1,0,0]=3 15227 B12R1.125 CC(C)NCc1ccccc1F 2230a_100138425928_100000211605 [0,2,0,0,0,0|1,0,0]=3 15228 B12R1.125 CC(C)NCc1ccccc1F 34a_100000174869_100000210206 [0,2,0,0,0,0|1,0,0]=3 15229 B12R1.125 CC(C)NCc1ccccc1F 34a_100138425928_100000211605 [0,2,0,0,0,0|1,0,0]=3 15230 B12R1.125 CC(C)NCc1ccccc1I 207a_100138425928_100000010305 [0,2,0,0,0,0|1,0,0]=3 15231 B12R1.125 CC(C)NCc1ccccc1I 2230a_100138425928_100011215278 [0,2,0,0,0,0|1,0,0]=3 15232 B12R1.125 CC(C)NCc1ccccc1I 34a_100138425928_100011215278 [0,2,0,0,0,0|1,0,0]=3 15233 B12R1.125 CC(C)NCc1ccccc1O 271570a_203496583355_100000195800 [0,2,0,0,0,0|0,0,0]=2 15234 B12R1.125 CC(C)NCc1ccccc1O 34a_100000185550_100000210206 [0,2,0,0,0,0|0,0,0]=2 15235 B12R1.125 CC(C)NCc1cccnc1Br 2230a_100009818023_100000210206 [0,2,0,0,0,0|2,0,0]=4 15236 B12R1.125 CC(C)NCc1cccnc1Br 2230a_100138425928_100010140945 [0,2,0,0,0,0|2,0,0]=4 15237 B12R1.125 CC(C)NCc1cccnc1Br 34a_100009818023_100000210206 [0,2,0,0,0,0|2,0,0]=4 15238 B12R1.125 CC(C)NCc1cccnc1Br 34a_100138425928_100010140945 [0,2,0,0,0,0|2,0,0]=4 15239 B12R1.125 CC(C)NCc1cccnc1Cl 2230a_100015189234_100000210206 [0,2,0,0,0,0|2,0,0]=4 15240 B12R1.125 CC(C)NCc1cccnc1Cl 2230a_100138425928_100000045678 [0,2,0,0,0,0|2,0,0]=4 15241 B12R1.125 CC(C)NCc1cccnc1Cl 34a_100015189234_100000210206 [0,2,0,0,0,0|2,0,0]=4 15242 B12R1.125 CC(C)NCc1cccnc1Cl 34a_100138425928_100000045678 [0,2,0,0,0,0|2,0,0]=4 15243 B12R1.125 CC(C)NCc1cccnc1F 2230a_100138425928_100000099810 [0,2,0,0,0,0|2,0,0]=4 15244 B12R1.125 CC(C)NCc1cccnc1F 34a_100000724633_100000210206 [0,2,0,0,0,0|2,0,0]=4 15245 B12R1.125 CC(C)NCc1cccnc1F 34a_100138425928_100000099810 [0,2,0,0,0,0|2,0,0]=4 15246 B12R1.125 CC(C)NCc1cccnc1O 207a_100138425928_100011998315 [0,2,0,0,0,0|1,0,0]=3 15247 B12R1.125 CC(C)NCc1ccncc1Cl 207a_100138425928_100011934409 [0,2,0,0,0,0|2,0,0]=4 15248 B12R1.125 CC(C)NCc1ccncc1Cl 2230a_100138425928_100000763264 [0,2,0,0,0,0|2,0,0]=4 15249 B12R1.125 CC(C)NCc1ccncc1F 34a_100011935246_100000210206 [0,2,0,0,0,0|2,0,0]=4 15250 B12R1.125 CC(C)NCc1ncccc1Br 207a_100138425928_100011934733 [0,2,0,0,0,0|2,0,0]=4 15251 B12R1.125 CC(C)NCc1ncccc1Br 2230a_100138425928_100025702911 [0,2,0,0,0,0|2,0,0]=4 15252 B12R1.125 CC(C)NCc1ncccc1Br 34a_100138425928_100025702911 [0,2,0,0,0,0|2,0,0]=4 15253 B12R1.125 CC(C)NCc1ncccc1Cl 207a_100138425928_100012001307 [0,2,0,0,0,0|2,0,0]=4 15254 B12R1.125 CC(C)NCc1ncccc1Cl 2230a_100015189233_100000210206 [0,2,0,0,0,0|2,0,0]=4 15255 B12R1.125 CC(C)NCc1ncccc1Cl 2230a_100138425928_100000099807 [0,2,0,0,0,0|2,0,0]=4 15256 B12R1.125 CC(C)NCc1ncccc1F 207a_100138425928_100011934734 [0,2,0,0,0,0|2,0,0]=4 15257 B12R1.125 CC(C)NCc1ncccc1F 2230a_100138425928_100000104219 [0,2,0,0,0,0|2,0,0]=4 15258 B12R1.125 CC(C)NCc1ncccc1F 34a_100000690088_100000210206 [0,2,0,0,0,0|2,0,0]=4 15259 B12R1.125 CC(C)NCc1ncccc1F 34a_100138425928_100000104219 [0,2,0,0,0,0|2,0,0]=4 15260 B12R1.125 CC(C)NCc1ncccc1O 34a_100138425928_200020655725 [0,2,0,0,0,0|1,0,0]=3 15261 B12R1.125 CC(C)OCc1ccccc1Br 34a_100000212225_100000184730 [0,2,0,0,0,0|1,0,0]=3 15262 B12R1.125 CC(C)OCc1ccccc1Br 34a_100000756307_100000210206 [0,2,0,0,0,0|1,0,0]=3 15263 B12R1.125 CC(C)OCc1ccccc1Br 7a_100000756307_100000210206 [0,2,0,0,0,0|1,0,0]=3 15264 B12R1.125 CC(C)OCc1ccccc1Cl 34a_100000210847_100000210206 [0,2,0,0,0,0|1,0,0]=3 15265 B12R1.125 CC(C)OCc1ccccc1Cl 34a_100000212225_100000187162 [0,2,0,0,0,0|1,0,0]=3 15266 B12R1.125 CC(C)OCc1ccccc1Cl 7a_100000210847_100000210206 [0,2,0,0,0,0|1,0,0]=3 15267 B12R1.125 CC(C)OCc1ccccc1F 34a_100000211962_100000210206 [0,2,0,0,0,0|1,0,0]=3 15268 B12R1.125 CC(C)OCc1ccccc1F 34a_100000212225_100000211605 [0,2,0,0,0,0|1,0,0]=3 15269 B12R1.125 CC(C)OCc1ccccc1F 7a_100000211962_100000210206 [0,2,0,0,0,0|1,0,0]=3 15270 B12R1.125 CC(C)OCc1ccccc1I 34a_100000187465_100000210206 [0,2,0,0,0,0|1,0,0]=3 15271 B12R1.125 CC(C)OCc1ccccc1I 34a_100000212225_100011215278 [0,2,0,0,0,0|1,0,0]=3 15272 B12R1.125 CC(C)OCc1ccccc1I 7a_100000187465_100000210206 [0,2,0,0,0,0|1,0,0]=3 15273 B12R1.125 CC(C)OCc1ccccc1N 34a_100000212039_100000210206 [0,2,0,0,0,0|1,0,0]=3 15274 B12R1.125 CC(C)OCc1cccnc1Br 34a_100000212225_100010140945 [0,2,0,0,0,0|2,0,0]=4 15275 B12R1.125 CC(C)OCc1cccnc1Br 34a_100000719692_100000210206 [0,2,0,0,0,0|2,0,0]=4 15276 B12R1.125 CC(C)OCc1cccnc1Br 7a_100000719692_100000210206 [0,2,0,0,0,0|2,0,0]=4 15277 B12R1.125 CC(C)OCc1cccnc1Cl 34a_100000212225_100000045678 [0,2,0,0,0,0|2,0,0]=4 15278 B12R1.125 CC(C)OCc1cccnc1Cl 34a_100000748726_100000210206 [0,2,0,0,0,0|2,0,0]=4 15279 B12R1.125 CC(C)OCc1cccnc1Cl 7a_100000748726_100000210206 [0,2,0,0,0,0|2,0,0]=4 15280 B12R1.125 CC(C)OCc1cccnc1F 34a_100000079888_100000210206 [0,2,0,0,0,0|2,0,0]=4 15281 B12R1.125 CC(C)OCc1cccnc1F 34a_100000212225_100000099810 [0,2,0,0,0,0|2,0,0]=4 15282 B12R1.125 CC(C)OCc1cccnc1F 7a_100000079888_100000210206 [0,2,0,0,0,0|2,0,0]=4 15283 B12R1.125 CC(C)OCc1ccncc1F 34a_100012172863_100000210206 [0,2,0,0,0,0|2,0,0]=4 15284 B12R1.125 CC(C)OCc1cnccc1Cl 34a_100000117392_100000210206 [0,2,0,0,0,0|2,0,0]=4 15285 B12R1.125 CC(C)OCc1ncccc1Br 34a_100000212225_100025702911 [0,2,0,0,0,0|2,0,0]=4 15286 B12R1.125 CC(C)OCc1ncccc1Br 34a_100011996772_100000210206 [0,2,0,0,0,0|2,0,0]=4 15287 B12R1.125 CC(C)OCc1ncccc1Cl 34a_100012002383_100000210206 [0,2,0,0,0,0|2,0,0]=4 15288 B12R1.125 CC(C)OCc1ncccc1F 34a_100000212225_100000104219 [0,2,0,0,0,0|2,0,0]=4 15289 B12R1.125 CC(C)OCc1ncccc1F 34a_100011934865_100000210206 [0,2,0,0,0,0|2,0,0]=4 15290 B12R1.125 CC(C)OCc1ncccc1N 34a_114873767017_100000210206 [0,2,0,0,0,0|2,0,0]=4 15291 B12R1.125 CC(C)OCc1ncccc1O 34a_100000212225_200020655725 [0,2,0,0,0,0|1,0,0]=3 15292 B12R1.125 CC(C)SCc1ccccc1Br 62a_100000184730_100000210206 [0,2,0,0,0,0|1,0,0]=3 15293 B12R1.125 CC(C)SCc1ccccc1Br 62a_100000210206_100000184730 [0,2,0,0,0,0|1,0,0]=3 15294 B12R1.125 CC(C)SCc1ccccc1Cl 62a_100000187162_100000210206 [0,2,0,0,0,0|1,0,0]=3 15295 B12R1.125 CC(C)SCc1ccccc1Cl 62a_100000210206_100000187162 [0,2,0,0,0,0|1,0,0]=3 15296 B12R1.125 CC(C)SCc1ccccc1F 62a_100000210206_100000211605 [0,2,0,0,0,0|1,0,0]=3 15297 B12R1.125 CC(C)SCc1ccccc1F 62a_100000211605_100000210206 [0,2,0,0,0,0|1,0,0]=3 15298 B12R1.125 CC(C)SCc1ccccc1I 62a_100000210206_100011216222 [0,2,0,0,0,0|1,0,0]=3 15299 B12R1.125 CC(C)SCc1ccccc1I 62a_100011216222_100000210206 [0,2,0,0,0,0|1,0,0]=3 15300 B12R1.125 CC(C)SCc1ccccc1O 271570a_203496583355_200000173093 [0,2,0,0,0,0|0,0,0]=2 15301 B12R1.125 CC(C)SCc1cccnc1Br 62a_100000210206_100010140945 [0,2,0,0,0,0|2,0,0]=4 15302 B12R1.125 CC(C)SCc1cccnc1Br 62a_100010140945_100000210206 [0,2,0,0,0,0|2,0,0]=4 15303 B12R1.125 CC(C)SCc1cccnc1Cl 62a_100000045678_100000210206 [0,2,0,0,0,0|2,0,0]=4 15304 B12R1.125 CC(C)SCc1cccnc1Cl 62a_100000210206_100000045678 [0,2,0,0,0,0|2,0,0]=4 15305 B12R1.125 CC(C)SCc1cccnc1F 62a_100000099810_100000210206 [0,2,0,0,0,0|2,0,0]=4 15306 B12R1.125 CC(C)SCc1cccnc1F 62a_100000210206_100000099810 [0,2,0,0,0,0|2,0,0]=4 15307 B12R1.125 CC(C)SCc1ccncc1Cl 62a_100000210206_100000763264 [0,2,0,0,0,0|2,0,0]=4 15308 B12R1.125 CC(C)SCc1ccncc1Cl 62a_100000763264_100000210206 [0,2,0,0,0,0|2,0,0]=4 15309 B12R1.125 CC(C)SCc1ncccc1Br 62a_100000210206_100025702911 [0,2,0,0,0,0|2,0,0]=4 15310 B12R1.125 CC(C)SCc1ncccc1Br 62a_100025702911_100000210206 [0,2,0,0,0,0|2,0,0]=4 15311 B12R1.125 CC(C)SCc1ncccc1Cl 62a_100000099807_100000210206 [0,2,0,0,0,0|2,0,0]=4 15312 B12R1.125 CC(C)SCc1ncccc1Cl 62a_100000210206_100000099807 [0,2,0,0,0,0|2,0,0]=4 15313 B12R1.125 CC(C)SCc1ncccc1F 62a_100000104219_100000210206 [0,2,0,0,0,0|2,0,0]=4 15314 B12R1.125 CC(C)SCc1ncccc1F 62a_100000210206_100000104219 [0,2,0,0,0,0|2,0,0]=4 15315 B12R1.125 CC(C)SCc1ncccc1O 62a_100000210206_200020655725 [0,2,0,0,0,0|1,0,0]=3 15316 B12R1.125 CC(C)SCc1ncccc1O 62a_200020655725_100000210206 [0,2,0,0,0,0|1,0,0]=3 15317 B12R1.125 CC(O)C=Cc1ccccc1Br 271570a_200011019289_100000695589 [0,2,0,0,0,0|1,0,1]=4 15318 B12R1.125 CC(O)C=Cc1ccccc1Cl 271570a_200011019289_100000764095 [0,2,0,0,0,0|1,0,1]=4 15319 B12R1.125 CC(O)C=Cc1ccccc1F 271570a_200011019289_100011215700 [0,2,0,0,0,0|1,0,1]=4 15320 B12R1.125 CC(O)C=Cc1ccccc1N 271570a_200011019289_100000210017 [0,2,0,0,0,0|1,0,1]=4 15321 B12R1.125 CC(O)C=Cc1ccccc1O 271570a_200011019289_100000739446 [0,2,0,0,0,0|0,0,1]=3 15322 B12R1.125 CC(O)C=Cc1ccncc1O 271570a_200011019289_100009817591 [0,2,0,0,0,0|1,0,1]=4 15323 B12R1.125 CC(O)C=Cc1ncccc1O 271570a_200011019289_100000034122 [0,2,0,0,0,0|1,0,1]=4 15324 B12R1.125 CC(O)CNc1ccccc1Br 34a_100000210017_100011218427 [0,2,0,0,0,0|1,0,0]=3 15325 B12R1.125 CC(O)CNc1ccccc1Cl 34a_100000185783_100011218427 [0,2,0,0,0,0|1,0,0]=3 15326 B12R1.125 CC(O)CNc1ccccc1F 34a_100000210422_100011218427 [0,2,0,0,0,0|1,0,0]=3 15327 B12R1.125 CC(O)CNc1ccccc1I 34a_100000210053_100011218427 [0,2,0,0,0,0|1,0,0]=3 15328 B12R1.125 CC(O)CNc1ccccc1O 34a_100000185747_100011218427 [0,2,0,0,0,0|0,0,0]=2 15329 B12R1.125 CC(O)CNc1ccncc1Br 27a_100000210904_100000726257 [0,2,0,0,0,0|2,0,0]=4 15330 B12R1.125 CC(O)CNc1ccncc1F 27a_100000210904_100000035921 [0,2,0,0,0,0|2,0,0]=4 15331 B12R1.125 CC(O)CNc1ncccc1Br 27a_100000210904_100000696092 [0,2,0,0,0,0|2,0,0]=4 15332 B12R1.125 CC(O)COc1cccc[n+]1[O-] 7a_100000211761_100011218427 [0,2,0,0,0,0|1,0,1]=4 15333 B12R1.125 CC(O)COc1ccccc1Br 34a_100000181306_100011218427 [0,2,0,0,0,0|1,0,0]=3 15334 B12R1.125 CC(O)COc1ccccc1Br 7a_100000181306_100011218427 [0,2,0,0,0,0|1,0,0]=3 15335 B12R1.125 CC(O)COc1ccccc1Cl 34a_100000210172_100011218427 [0,2,0,0,0,0|1,0,0]=3 15336 B12R1.125 CC(O)COc1ccccc1Cl 7a_100000210172_100011218427 [0,2,0,0,0,0|1,0,0]=3 15337 B12R1.125 CC(O)COc1ccccc1F 34a_100000210171_100011218427 [0,2,0,0,0,0|1,0,0]=3 15338 B12R1.125 CC(O)COc1ccccc1F 7a_100000210171_100011218427 [0,2,0,0,0,0|1,0,0]=3 15339 B12R1.125 CC(O)COc1ccccc1I 34a_100000739446_100011218427 [0,2,0,0,0,0|1,0,0]=3 15340 B12R1.125 CC(O)COc1ccccc1I 7a_100000739446_100011218427 [0,2,0,0,0,0|1,0,0]=3 15341 B12R1.125 CC(O)COc1ccccc1N 34a_100000185747_100011218427 [0,2,0,0,0,0|1,0,0]=3 15342 B12R1.125 CC(O)COc1ccccc1N 7a_100000185747_100011218427 [0,2,0,0,0,0|1,0,0]=3 15343 B12R1.125 CC(O)COc1cccnc1Br 34a_100000744436_100011218427 [0,2,0,0,0,0|2,0,0]=4 15344 B12R1.125 CC(O)COc1cccnc1Br 7a_100000744436_100011218427 [0,2,0,0,0,0|2,0,0]=4 15345 B12R1.125 CC(O)COc1cccnc1Cl 34a_100000757616_100011218427 [0,2,0,0,0,0|2,0,0]=4 15346 B12R1.125 CC(O)COc1cccnc1Cl 7a_100000757616_100011218427 [0,2,0,0,0,0|2,0,0]=4 15347 B12R1.125 CC(O)COc1cccnc1F 34a_100000061740_100011218427 [0,2,0,0,0,0|2,0,0]=4 15348 B12R1.125 CC(O)COc1cccnc1F 7a_100000061740_100011218427 [0,2,0,0,0,0|2,0,0]=4 15349 B12R1.125 CC(O)COc1cccnc1I 34a_100000034122_100011218427 [0,2,0,0,0,0|2,0,0]=4 15350 B12R1.125 CC(O)COc1cccnc1I 7a_100000034122_100011218427 [0,2,0,0,0,0|2,0,0]=4 15351 B12R1.125 CC(O)COc1cccnc1N 34a_100000211975_100011218427 [0,2,0,0,0,0|2,0,0]=4 15352 B12R1.125 CC(O)COc1cccnc1N 7a_100000211975_100011218427 [0,2,0,0,0,0|2,0,0]=4 15353 B12R1.125 CC(O)COc1cccoc1=O 34a_100000077404_100011218427 [0,2,0,0,0,0|1,0,1]=4 15354 B12R1.125 CC(O)COc1cccoc1=O 7a_100000077404_100011218427 [0,2,0,0,0,0|1,0,1]=4 15355 B12R1.125 CC(O)COc1ccncc1Br 34a_100011996408_100011218427 [0,2,0,0,0,0|2,0,0]=4 15356 B12R1.125 CC(O)COc1ccncc1Cl 34a_100011997054_100011218427 [0,2,0,0,0,0|2,0,0]=4 15357 B12R1.125 CC(O)COc1ccncc1F 34a_200000081243_100011218427 [0,2,0,0,0,0|2,0,0]=4 15358 B12R1.125 CC(O)COc1cnccc1Cl 34a_100011996695_100011218427 [0,2,0,0,0,0|2,0,0]=4 15359 B12R1.125 CC(O)COc1cnccc1I 34a_100000050107_100011218427 [0,2,0,0,0,0|2,0,0]=4 15360 B12R1.125 CC(O)COc1cnccc1N 34a_100000753702_100011218427 [0,2,0,0,0,0|2,0,0]=4 15361 B12R1.125 CC(O)COc1coccc1=O 34a_100000060831_100011218427 [0,2,0,0,0,0|1,0,1]=4 15362 B12R1.125 CC(O)COc1ncccc1Cl 34a_100011290957_100011218427 [0,2,0,0,0,0|2,0,0]=4 15363 B12R1.125 CC(O)COc1ncccc1F 34a_100011219419_100011218427 [0,2,0,0,0,0|2,0,0]=4 15364 B12R1.125 CC(O)COc1ncccc1N 34a_100000746358_100011218427 [0,2,0,0,0,0|2,0,0]=4 15365 B12R1.125 CC(O)CSc1c[nH]ccc1=O 62a_100009998708_100011218427 [0,2,0,0,0,0|1,0,1]=4 15366 B12R1.125 CC(O)CSc1c[nH]ccc1=O 62a_100011218427_100009998708 [0,2,0,0,0,0|1,0,1]=4 15367 B12R1.125 CC(O)CSc1c[nH]ccc1=S 62a_100011218427_200012280681 [0,2,0,0,0,0|1,1,0]=4 15368 B12R1.125 CC(O)CSc1c[nH]ccc1=S 62a_200012280681_100011218427 [0,2,0,0,0,0|1,1,0]=4 15369 B12R1.125 CC(O)CSc1cccc[n+]1C 62a_100011218427_100000212160 [0,2,0,0,0,0|2,0,0]=4 15370 B12R1.125 CC(O)CSc1cccc[n+]1[O-] 62a_100011218427_200000042595 [0,2,0,0,0,0|1,0,1]=4 15371 B12R1.125 CC(O)CSc1ccccc1Br 62a_100000695589_100011218427 [0,2,0,0,0,0|1,0,0]=3 15372 B12R1.125 CC(O)CSc1ccccc1Br 62a_100011218427_100000695589 [0,2,0,0,0,0|1,0,0]=3 15373 B12R1.125 CC(O)CSc1ccccc1Cl 62a_100000764095_100011218427 [0,2,0,0,0,0|1,0,0]=3 15374 B12R1.125 CC(O)CSc1ccccc1Cl 62a_100011218427_100000764095 [0,2,0,0,0,0|1,0,0]=3 15375 B12R1.125 CC(O)CSc1ccccc1F 62a_100011215700_100011218427 [0,2,0,0,0,0|1,0,0]=3 15376 B12R1.125 CC(O)CSc1ccccc1F 62a_100011218427_100011215700 [0,2,0,0,0,0|1,0,0]=3 15377 B12R1.125 CC(O)CSc1ccccc1N 62a_100000210017_100011218427 [0,2,0,0,0,0|1,0,0]=3 15378 B12R1.125 CC(O)CSc1ccccc1N 62a_100011218427_100000210017 [0,2,0,0,0,0|1,0,0]=3 15379 B12R1.125 CC(O)CSc1ccccc1O 62a_100000739446_100011218427 [0,2,0,0,0,0|0,0,0]=2 15380 B12R1.125 CC(O)CSc1ccccc1O 62a_100011218427_100000739446 [0,2,0,0,0,0|0,0,0]=2 15381 B12R1.125 CC(O)CSc1cccnc1Br 62a_100010202626_100011218427 [0,2,0,0,0,0|2,0,0]=4 15382 B12R1.125 CC(O)CSc1cccnc1Br 62a_100011218427_100010202626 [0,2,0,0,0,0|2,0,0]=4 15383 B12R1.125 CC(O)CSc1cccnc1Cl 62a_100000036424_100011218427 [0,2,0,0,0,0|2,0,0]=4 15384 B12R1.125 CC(O)CSc1cccnc1Cl 62a_100011218427_100000036424 [0,2,0,0,0,0|2,0,0]=4 15385 B12R1.125 CC(O)CSc1cccnc1F 62a_100009816115_100011218427 [0,2,0,0,0,0|2,0,0]=4 15386 B12R1.125 CC(O)CSc1cccnc1F 62a_100011218427_100009816115 [0,2,0,0,0,0|2,0,0]=4 15387 B12R1.125 CC(O)CSc1cccnc1N 62a_100000045569_100011218427 [0,2,0,0,0,0|2,0,0]=4 15388 B12R1.125 CC(O)CSc1cccnc1N 62a_100011218427_100000045569 [0,2,0,0,0,0|2,0,0]=4 15389 B12R1.125 CC(O)CSc1cccnc1O 62a_100000760158_100011218427 [0,2,0,0,0,0|1,0,0]=3 15390 B12R1.125 CC(O)CSc1cccnc1O 62a_100011218427_100000760158 [0,2,0,0,0,0|1,0,0]=3 15391 B12R1.125 CC(O)CSc1ccncc1Br 62a_100000726257_100011218427 [0,2,0,0,0,0|2,0,0]=4 15392 B12R1.125 CC(O)CSc1ccncc1Br 62a_100011218427_100000726257 [0,2,0,0,0,0|2,0,0]=4 15393 B12R1.125 CC(O)CSc1ccncc1Cl 62a_100000708259_100011218427 [0,2,0,0,0,0|2,0,0]=4 15394 B12R1.125 CC(O)CSc1ccncc1Cl 62a_100011218427_100000708259 [0,2,0,0,0,0|2,0,0]=4 15395 B12R1.125 CC(O)CSc1ccncc1F 62a_100000047030_100011218427 [0,2,0,0,0,0|2,0,0]=4 15396 B12R1.125 CC(O)CSc1ccncc1F 62a_100011218427_100000047030 [0,2,0,0,0,0|2,0,0]=4 15397 B12R1.125 CC(O)CSc1ccncc1N 62a_100000756074_100011218427 [0,2,0,0,0,0|2,0,0]=4 15398 B12R1.125 CC(O)CSc1ccncc1N 62a_100011218427_100000756074 [0,2,0,0,0,0|2,0,0]=4 15399 B12R1.125 CC(O)CSc1ccncc1O 62a_100009817591_100011218427 [0,2,0,0,0,0|1,0,0]=3 15400 B12R1.125 CC(O)CSc1ccncc1O 62a_100011218427_100009817591 [0,2,0,0,0,0|1,0,0]=3 15401 B12R1.125 CC(O)CSc1cnccc1Br 62a_100010138639_100011218427 [0,2,0,0,0,0|2,0,0]=4 15402 B12R1.125 CC(O)CSc1cnccc1Br 62a_100011218427_100010138639 [0,2,0,0,0,0|2,0,0]=4 15403 B12R1.125 CC(O)CSc1cnccc1Cl 62a_100009995489_100011218427 [0,2,0,0,0,0|2,0,0]=4 15404 B12R1.125 CC(O)CSc1cnccc1Cl 62a_100011218427_100009995489 [0,2,0,0,0,0|2,0,0]=4 15405 B12R1.125 CC(O)CSc1cnccc1F 62a_100009820683_100011218427 [0,2,0,0,0,0|2,0,0]=4 15406 B12R1.125 CC(O)CSc1cnccc1F 62a_100011218427_100009820683 [0,2,0,0,0,0|2,0,0]=4 15407 B12R1.125 CC(O)CSc1cnccc1N 62a_100000047001_100011218427 [0,2,0,0,0,0|2,0,0]=4 15408 B12R1.125 CC(O)CSc1cnccc1N 62a_100011218427_100000047001 [0,2,0,0,0,0|2,0,0]=4 15409 B12R1.125 CC(O)CSc1cncnc1O 62a_100000751107_100011218427 [0,2,0,0,0,0|2,0,0]=4 15410 B12R1.125 CC(O)CSc1cncnc1O 62a_100011218427_100000751107 [0,2,0,0,0,0|2,0,0]=4 15411 B12R1.125 CC(O)CSc1ncccc1Br 62a_100000696092_100011218427 [0,2,0,0,0,0|2,0,0]=4 15412 B12R1.125 CC(O)CSc1ncccc1Br 62a_100011218427_100000696092 [0,2,0,0,0,0|2,0,0]=4 15413 B12R1.125 CC(O)CSc1ncccc1Cl 62a_100011218427_100011356963 [0,2,0,0,0,0|2,0,0]=4 15414 B12R1.125 CC(O)CSc1ncccc1Cl 62a_100011356963_100011218427 [0,2,0,0,0,0|2,0,0]=4 15415 B12R1.125 CC(O)CSc1ncccc1F 62a_100000685392_100011218427 [0,2,0,0,0,0|2,0,0]=4 15416 B12R1.125 CC(O)CSc1ncccc1F 62a_100011218427_100000685392 [0,2,0,0,0,0|2,0,0]=4 15417 B12R1.125 CC(O)CSc1ncccc1N 62a_100000688686_100011218427 [0,2,0,0,0,0|2,0,0]=4 15418 B12R1.125 CC(O)CSc1ncccc1N 62a_100011218427_100000688686 [0,2,0,0,0,0|2,0,0]=4 15419 B12R1.125 CC(O)CSc1ncccc1O 62a_100000034122_100011218427 [0,2,0,0,0,0|1,0,0]=3 15420 B12R1.125 CC(O)CSc1ncccc1O 62a_100011218427_100000034122 [0,2,0,0,0,0|1,0,0]=3 15421 B12R1.125 CN(C)CCc1ccccc1Br 2230a_100102631434_100012161201 [0,2,0,0,0,0|1,0,0]=3 15422 B12R1.125 CN(C)CCc1ccccc1Br 269982a_100102631434_100012161201 [0,2,0,0,0,0|1,0,0]=3 15423 B12R1.125 CN(C)CCc1ccccc1Cl 2230a_100102631434_100011713703 [0,2,0,0,0,0|1,0,0]=3 15424 B12R1.125 CN(C)CCc1ccccc1Cl 269982a_100102631434_100011713703 [0,2,0,0,0,0|1,0,0]=3 15425 B12R1.125 CN(C)CCc1ccccc1Cl 270004a_100102631434_200011713468 [0,2,0,0,0,0|1,0,0]=3 15426 B12R1.125 CN(C)CCc1ccccc1F 2230a_100000232559_200000210301 [0,2,0,0,0,0|1,0,0]=3 15427 B12R1.125 CN(C)CCc1ccccc1F 2230a_100102631434_100011713696 [0,2,0,0,0,0|1,0,0]=3 15428 B12R1.125 CN(C)CCc1ccccc1F 269982a_100000232559_200000210301 [0,2,0,0,0,0|1,0,0]=3 15429 B12R1.125 CN(C)CCc1ccccc1F 269982a_100102631434_100011713696 [0,2,0,0,0,0|1,0,0]=3 15430 B12R1.125 CN(C)CCc1ccccc1F 34a_100000232559_200000210301 [0,2,0,0,0,0|1,0,0]=3 15431 B12R1.125 CN(C)CCc1ccccc1O 269982a_100102631434_100000722297 [0,2,0,0,0,0|0,0,0]=2 15432 B12R1.125 CN([13CH3])CCc1ccccc1F 2230a_100000232559_200025704644 [0,2,0,0,0,0|1,0,0]=3 15433 B12R1.125 CN([13CH3])CCc1ccccc1F 269982a_100000232559_200025704644 [0,2,0,0,0,0|1,0,0]=3 15434 B12R1.125 CN([13CH3])CCc1ccccc1F 34a_100000232559_200025704644 [0,2,0,0,0,0|1,0,0]=3 15435 B12R1.125 C[C@@H](O)CNc1ccccc1Br 34a_100000210017_100009817552 [0,2,0,0,0,0|1,0,0]=3 15436 B12R1.125 C[C@@H](O)CNc1ccccc1Cl 34a_100000185783_100009817552 [0,2,0,0,0,0|1,0,0]=3 15437 B12R1.125 C[C@@H](O)CNc1ccccc1F 34a_100000210422_100009817552 [0,2,0,0,0,0|1,0,0]=3 15438 B12R1.125 C[C@@H](O)CNc1ccccc1I 34a_100000210053_100009817552 [0,2,0,0,0,0|1,0,0]=3 15439 B12R1.125 C[C@@H](O)CNc1ccccc1O 34a_100000185747_100009817552 [0,2,0,0,0,0|0,0,0]=2 15440 B12R1.125 C[C@@H](O)COc1cccc[n+]1[O-] 7a_100000211761_100009817552 [0,2,0,0,0,0|1,0,1]=4 15441 B12R1.125 C[C@@H](O)COc1ccccc1Br 34a_100000181306_100009817552 [0,2,0,0,0,0|1,0,0]=3 15442 B12R1.125 C[C@@H](O)COc1ccccc1Br 7a_100000181306_100009817552 [0,2,0,0,0,0|1,0,0]=3 15443 B12R1.125 C[C@@H](O)COc1ccccc1Cl 34a_100000210172_100009817552 [0,2,0,0,0,0|1,0,0]=3 15444 B12R1.125 C[C@@H](O)COc1ccccc1Cl 7a_100000210172_100009817552 [0,2,0,0,0,0|1,0,0]=3 15445 B12R1.125 C[C@@H](O)COc1ccccc1F 34a_100000210171_100009817552 [0,2,0,0,0,0|1,0,0]=3 15446 B12R1.125 C[C@@H](O)COc1ccccc1F 7a_100000210171_100009817552 [0,2,0,0,0,0|1,0,0]=3 15447 B12R1.125 C[C@@H](O)COc1ccccc1I 34a_100000739446_100009817552 [0,2,0,0,0,0|1,0,0]=3 15448 B12R1.125 C[C@@H](O)COc1ccccc1I 7a_100000739446_100009817552 [0,2,0,0,0,0|1,0,0]=3 15449 B12R1.125 C[C@@H](O)COc1ccccc1N 34a_100000185747_100009817552 [0,2,0,0,0,0|1,0,0]=3 15450 B12R1.125 C[C@@H](O)COc1ccccc1N 7a_100000185747_100009817552 [0,2,0,0,0,0|1,0,0]=3 15451 B12R1.125 C[C@@H](O)COc1cccnc1Br 34a_100000744436_100009817552 [0,2,0,0,0,0|2,0,0]=4 15452 B12R1.125 C[C@@H](O)COc1cccnc1Br 7a_100000744436_100009817552 [0,2,0,0,0,0|2,0,0]=4 15453 B12R1.125 C[C@@H](O)COc1cccnc1Cl 34a_100000757616_100009817552 [0,2,0,0,0,0|2,0,0]=4 15454 B12R1.125 C[C@@H](O)COc1cccnc1Cl 7a_100000757616_100009817552 [0,2,0,0,0,0|2,0,0]=4 15455 B12R1.125 C[C@@H](O)COc1cccnc1F 34a_100000061740_100009817552 [0,2,0,0,0,0|2,0,0]=4 15456 B12R1.125 C[C@@H](O)COc1cccnc1F 7a_100000061740_100009817552 [0,2,0,0,0,0|2,0,0]=4 15457 B12R1.125 C[C@@H](O)COc1cccnc1I 34a_100000034122_100009817552 [0,2,0,0,0,0|2,0,0]=4 15458 B12R1.125 C[C@@H](O)COc1cccnc1I 7a_100000034122_100009817552 [0,2,0,0,0,0|2,0,0]=4 15459 B12R1.125 C[C@@H](O)COc1cccnc1N 34a_100000211975_100009817552 [0,2,0,0,0,0|2,0,0]=4 15460 B12R1.125 C[C@@H](O)COc1cccnc1N 7a_100000211975_100009817552 [0,2,0,0,0,0|2,0,0]=4 15461 B12R1.125 C[C@@H](O)COc1cccoc1=O 34a_100000077404_100009817552 [0,2,0,0,0,0|1,0,1]=4 15462 B12R1.125 C[C@@H](O)COc1cccoc1=O 7a_100000077404_100009817552 [0,2,0,0,0,0|1,0,1]=4 15463 B12R1.125 C[C@@H](O)COc1ccncc1Br 34a_100011996408_100009817552 [0,2,0,0,0,0|2,0,0]=4 15464 B12R1.125 C[C@@H](O)COc1ccncc1Cl 34a_100011997054_100009817552 [0,2,0,0,0,0|2,0,0]=4 15465 B12R1.125 C[C@@H](O)COc1ccncc1F 34a_200000081243_100009817552 [0,2,0,0,0,0|2,0,0]=4 15466 B12R1.125 C[C@@H](O)COc1cnccc1Cl 34a_100011996695_100009817552 [0,2,0,0,0,0|2,0,0]=4 15467 B12R1.125 C[C@@H](O)COc1cnccc1I 34a_100000050107_100009817552 [0,2,0,0,0,0|2,0,0]=4 15468 B12R1.125 C[C@@H](O)COc1cnccc1N 34a_100000753702_100009817552 [0,2,0,0,0,0|2,0,0]=4 15469 B12R1.125 C[C@@H](O)COc1coccc1=O 34a_100000060831_100009817552 [0,2,0,0,0,0|1,0,1]=4 15470 B12R1.125 C[C@@H](O)COc1ncccc1Cl 34a_100011290957_100009817552 [0,2,0,0,0,0|2,0,0]=4 15471 B12R1.125 C[C@@H](O)COc1ncccc1F 34a_100011219419_100009817552 [0,2,0,0,0,0|2,0,0]=4 15472 B12R1.125 C[C@@H](O)COc1ncccc1N 34a_100000746358_100009817552 [0,2,0,0,0,0|2,0,0]=4 15473 B12R1.125 C[C@@H](O)CSc1c[nH]ccc1=O 62a_100009817552_100009998708 [0,2,0,0,0,0|1,0,1]=4 15474 B12R1.125 C[C@@H](O)CSc1c[nH]ccc1=O 62a_100009998708_100009817552 [0,2,0,0,0,0|1,0,1]=4 15475 B12R1.125 C[C@@H](O)CSc1c[nH]ccc1=S 62a_100009817552_200012280681 [0,2,0,0,0,0|1,1,0]=4 15476 B12R1.125 C[C@@H](O)CSc1c[nH]ccc1=S 62a_200012280681_100009817552 [0,2,0,0,0,0|1,1,0]=4 15477 B12R1.125 C[C@@H](O)CSc1cccc[n+]1C 62a_100009817552_100000212160 [0,2,0,0,0,0|2,0,0]=4 15478 B12R1.125 C[C@@H](O)CSc1cccc[n+]1[O-] 62a_100009817552_200000042595 [0,2,0,0,0,0|1,0,1]=4 15479 B12R1.125 C[C@@H](O)CSc1ccccc1Br 62a_100000695589_100009817552 [0,2,0,0,0,0|1,0,0]=3 15480 B12R1.125 C[C@@H](O)CSc1ccccc1Br 62a_100009817552_100000695589 [0,2,0,0,0,0|1,0,0]=3 15481 B12R1.125 C[C@@H](O)CSc1ccccc1Cl 62a_100000764095_100009817552 [0,2,0,0,0,0|1,0,0]=3 15482 B12R1.125 C[C@@H](O)CSc1ccccc1Cl 62a_100009817552_100000764095 [0,2,0,0,0,0|1,0,0]=3 15483 B12R1.125 C[C@@H](O)CSc1ccccc1F 62a_100009817552_100011215700 [0,2,0,0,0,0|1,0,0]=3 15484 B12R1.125 C[C@@H](O)CSc1ccccc1F 62a_100011215700_100009817552 [0,2,0,0,0,0|1,0,0]=3 15485 B12R1.125 C[C@@H](O)CSc1ccccc1N 62a_100000210017_100009817552 [0,2,0,0,0,0|1,0,0]=3 15486 B12R1.125 C[C@@H](O)CSc1ccccc1N 62a_100009817552_100000210017 [0,2,0,0,0,0|1,0,0]=3 15487 B12R1.125 C[C@@H](O)CSc1ccccc1O 62a_100000739446_100009817552 [0,2,0,0,0,0|0,0,0]=2 15488 B12R1.125 C[C@@H](O)CSc1ccccc1O 62a_100009817552_100000739446 [0,2,0,0,0,0|0,0,0]=2 15489 B12R1.125 C[C@@H](O)CSc1cccnc1Br 62a_100009817552_100010202626 [0,2,0,0,0,0|2,0,0]=4 15490 B12R1.125 C[C@@H](O)CSc1cccnc1Br 62a_100010202626_100009817552 [0,2,0,0,0,0|2,0,0]=4 15491 B12R1.125 C[C@@H](O)CSc1cccnc1Cl 62a_100000036424_100009817552 [0,2,0,0,0,0|2,0,0]=4 15492 B12R1.125 C[C@@H](O)CSc1cccnc1Cl 62a_100009817552_100000036424 [0,2,0,0,0,0|2,0,0]=4 15493 B12R1.125 C[C@@H](O)CSc1cccnc1F 62a_100009816115_100009817552 [0,2,0,0,0,0|2,0,0]=4 15494 B12R1.125 C[C@@H](O)CSc1cccnc1F 62a_100009817552_100009816115 [0,2,0,0,0,0|2,0,0]=4 15495 B12R1.125 C[C@@H](O)CSc1cccnc1N 62a_100000045569_100009817552 [0,2,0,0,0,0|2,0,0]=4 15496 B12R1.125 C[C@@H](O)CSc1cccnc1N 62a_100009817552_100000045569 [0,2,0,0,0,0|2,0,0]=4 15497 B12R1.125 C[C@@H](O)CSc1cccnc1O 62a_100000760158_100009817552 [0,2,0,0,0,0|1,0,0]=3 15498 B12R1.125 C[C@@H](O)CSc1cccnc1O 62a_100009817552_100000760158 [0,2,0,0,0,0|1,0,0]=3 15499 B12R1.125 C[C@@H](O)CSc1ccncc1Br 62a_100000726257_100009817552 [0,2,0,0,0,0|2,0,0]=4 15500 B12R1.125 C[C@@H](O)CSc1ccncc1Br 62a_100009817552_100000726257 [0,2,0,0,0,0|2,0,0]=4 15501 B12R1.125 C[C@@H](O)CSc1ccncc1Cl 62a_100000708259_100009817552 [0,2,0,0,0,0|2,0,0]=4 15502 B12R1.125 C[C@@H](O)CSc1ccncc1Cl 62a_100009817552_100000708259 [0,2,0,0,0,0|2,0,0]=4 15503 B12R1.125 C[C@@H](O)CSc1ccncc1F 62a_100000047030_100009817552 [0,2,0,0,0,0|2,0,0]=4 15504 B12R1.125 C[C@@H](O)CSc1ccncc1F 62a_100009817552_100000047030 [0,2,0,0,0,0|2,0,0]=4 15505 B12R1.125 C[C@@H](O)CSc1ccncc1N 62a_100000756074_100009817552 [0,2,0,0,0,0|2,0,0]=4 15506 B12R1.125 C[C@@H](O)CSc1ccncc1N 62a_100009817552_100000756074 [0,2,0,0,0,0|2,0,0]=4 15507 B12R1.125 C[C@@H](O)CSc1ccncc1O 62a_100009817552_100009817591 [0,2,0,0,0,0|1,0,0]=3 15508 B12R1.125 C[C@@H](O)CSc1ccncc1O 62a_100009817591_100009817552 [0,2,0,0,0,0|1,0,0]=3 15509 B12R1.125 C[C@@H](O)CSc1cnccc1Br 62a_100009817552_100010138639 [0,2,0,0,0,0|2,0,0]=4 15510 B12R1.125 C[C@@H](O)CSc1cnccc1Br 62a_100010138639_100009817552 [0,2,0,0,0,0|2,0,0]=4 15511 B12R1.125 C[C@@H](O)CSc1cnccc1Cl 62a_100009817552_100009995489 [0,2,0,0,0,0|2,0,0]=4 15512 B12R1.125 C[C@@H](O)CSc1cnccc1Cl 62a_100009995489_100009817552 [0,2,0,0,0,0|2,0,0]=4 15513 B12R1.125 C[C@@H](O)CSc1cnccc1F 62a_100009817552_100009820683 [0,2,0,0,0,0|2,0,0]=4 15514 B12R1.125 C[C@@H](O)CSc1cnccc1F 62a_100009820683_100009817552 [0,2,0,0,0,0|2,0,0]=4 15515 B12R1.125 C[C@@H](O)CSc1cnccc1N 62a_100000047001_100009817552 [0,2,0,0,0,0|2,0,0]=4 15516 B12R1.125 C[C@@H](O)CSc1cnccc1N 62a_100009817552_100000047001 [0,2,0,0,0,0|2,0,0]=4 15517 B12R1.125 C[C@@H](O)CSc1cncnc1O 62a_100000751107_100009817552 [0,2,0,0,0,0|2,0,0]=4 15518 B12R1.125 C[C@@H](O)CSc1cncnc1O 62a_100009817552_100000751107 [0,2,0,0,0,0|2,0,0]=4 15519 B12R1.125 C[C@@H](O)CSc1ncccc1Br 62a_100000696092_100009817552 [0,2,0,0,0,0|2,0,0]=4 15520 B12R1.125 C[C@@H](O)CSc1ncccc1Br 62a_100009817552_100000696092 [0,2,0,0,0,0|2,0,0]=4 15521 B12R1.125 C[C@@H](O)CSc1ncccc1Cl 62a_100009817552_100011356963 [0,2,0,0,0,0|2,0,0]=4 15522 B12R1.125 C[C@@H](O)CSc1ncccc1Cl 62a_100011356963_100009817552 [0,2,0,0,0,0|2,0,0]=4 15523 B12R1.125 C[C@@H](O)CSc1ncccc1F 62a_100000685392_100009817552 [0,2,0,0,0,0|2,0,0]=4 15524 B12R1.125 C[C@@H](O)CSc1ncccc1F 62a_100009817552_100000685392 [0,2,0,0,0,0|2,0,0]=4 15525 B12R1.125 C[C@@H](O)CSc1ncccc1N 62a_100000688686_100009817552 [0,2,0,0,0,0|2,0,0]=4 15526 B12R1.125 C[C@@H](O)CSc1ncccc1N 62a_100009817552_100000688686 [0,2,0,0,0,0|2,0,0]=4 15527 B12R1.125 C[C@@H](O)CSc1ncccc1O 62a_100000034122_100009817552 [0,2,0,0,0,0|1,0,0]=3 15528 B12R1.125 C[C@@H](O)CSc1ncccc1O 62a_100009817552_100000034122 [0,2,0,0,0,0|1,0,0]=3 15529 B12R1.125 Cc1ccccc1C=CC(C)C 271570a_100016257149_100000210755 [0,2,0,0,0,0|1,0,1]=4 15530 B12R1.125 Cc1ccccc1C=CC(C)O 271570a_200011019289_100000210755 [0,2,0,0,0,0|1,0,1]=4 15531 B12R1.125 Cc1ccccc1CCC(=O)[13CH3] 1458a_100000748742_200025704644 [0,2,0,0,0,0|1,0,0]=3 15532 B12R1.125 Cc1ccccc1CCN(C)C 2230a_100102631434_100011713688 [0,2,0,0,0,0|1,0,0]=3 15533 B12R1.125 Cc1ccccc1CCN(C)C 269982a_100102631434_100011713688 [0,2,0,0,0,0|1,0,0]=3 15534 B12R1.125 Cc1ccccc1CNC(C)C 207a_100138425928_100000211143 [0,2,0,0,0,0|1,0,0]=3 15535 B12R1.125 Cc1ccccc1CNC(C)C 2230a_100138425928_100000211839 [0,2,0,0,0,0|1,0,0]=3 15536 B12R1.125 Cc1ccccc1CNC(C)C 34a_100000174972_100000210206 [0,2,0,0,0,0|1,0,0]=3 15537 B12R1.125 Cc1ccccc1CNC(C)C 34a_100138425928_100000211839 [0,2,0,0,0,0|1,0,0]=3 15538 B12R1.125 Cc1ccccc1COC(C)C 34a_100000212225_100000211839 [0,2,0,0,0,0|1,0,0]=3 15539 B12R1.125 Cc1ccccc1COC(C)C 34a_100000698903_100000210206 [0,2,0,0,0,0|1,0,0]=3 15540 B12R1.125 Cc1ccccc1COC(C)C 7a_100000698903_100000210206 [0,2,0,0,0,0|1,0,0]=3 15541 B12R1.125 Cc1ccccc1CSC(C)C 62a_100000210206_100000211839 [0,2,0,0,0,0|1,0,0]=3 15542 B12R1.125 Cc1ccccc1CSC(C)C 62a_100000211839_100000210206 [0,2,0,0,0,0|1,0,0]=3 15543 B12R1.125 Cc1ccccc1NCC(C)C 34a_100015192222_100000210624 [0,2,0,0,0,0|1,0,0]=3 15544 B12R1.125 Cc1ccccc1NCC(C)O 34a_100015192222_100011218427 [0,2,0,0,0,0|1,0,0]=3 15545 B12R1.125 Cc1ccccc1NCC(F)F 34a_100015192222_100011934356 [0,2,0,0,0,0|2,0,0]=4 15546 B12R1.125 Cc1ccccc1NC[C@@H](C)O 34a_100015192222_100009817552 [0,2,0,0,0,0|1,0,0]=3 15547 B12R1.125 Cc1ccccc1OCC(=O)[13CH3] 1458a_100000182418_200025704644 [0,2,0,0,0,0|1,0,1]=4 15548 B12R1.125 Cc1ccccc1OCC(C)C 34a_100000210338_100000210624 [0,2,0,0,0,0|1,0,0]=3 15549 B12R1.125 Cc1ccccc1OCC(C)C 7a_100000210338_100000210760 [0,2,0,0,0,0|1,0,0]=3 15550 B12R1.125 Cc1ccccc1OCC(C)O 34a_100000210338_100011218427 [0,2,0,0,0,0|1,0,0]=3 15551 B12R1.125 Cc1ccccc1OCC(C)O 7a_100000210338_100011218427 [0,2,0,0,0,0|1,0,0]=3 15552 B12R1.125 Cc1ccccc1OCC(F)F 34a_100000210338_100011934356 [0,2,0,0,0,0|2,0,0]=4 15553 B12R1.125 Cc1ccccc1OCC(F)F 7a_100000210338_100011934356 [0,2,0,0,0,0|2,0,0]=4 15554 B12R1.125 Cc1ccccc1OC[C@@H](C)O 34a_100000210338_100009817552 [0,2,0,0,0,0|1,0,0]=3 15555 B12R1.125 Cc1ccccc1OC[C@@H](C)O 7a_100000210338_100009817552 [0,2,0,0,0,0|1,0,0]=3 15556 B12R1.125 Cc1ccccc1SCC(=O)[13CH3] 1458a_100000183026_200025704644 [0,2,0,0,0,0|1,0,1]=4 15557 B12R1.125 Cc1ccccc1SCC(C)C 62a_100000210624_100000210755 [0,2,0,0,0,0|1,0,0]=3 15558 B12R1.125 Cc1ccccc1SCC(C)C 62a_100000210755_100000210760 [0,2,0,0,0,0|1,0,0]=3 15559 B12R1.125 Cc1ccccc1SCC(C)O 62a_100000210755_100011218427 [0,2,0,0,0,0|1,0,0]=3 15560 B12R1.125 Cc1ccccc1SCC(C)O 62a_100011218427_100000210755 [0,2,0,0,0,0|1,0,0]=3 15561 B12R1.125 Cc1ccccc1SCC(F)F 62a_100000210755_100011934356 [0,2,0,0,0,0|2,0,0]=4 15562 B12R1.125 Cc1ccccc1SCC(F)F 62a_100011934356_100000210755 [0,2,0,0,0,0|2,0,0]=4 15563 B12R1.125 Cc1ccccc1SC[C@@H](C)O 62a_100000210755_100009817552 [0,2,0,0,0,0|1,0,0]=3 15564 B12R1.125 Cc1ccccc1SC[C@@H](C)O 62a_100009817552_100000210755 [0,2,0,0,0,0|1,0,0]=3 15565 B12R1.125 Cc1cccnc1CNC(C)C 207a_100138425928_100000698913 [0,2,0,0,0,0|2,0,0]=4 15566 B12R1.125 Cc1cccnc1CNC(C)C 2230a_100138425928_100000696600 [0,2,0,0,0,0|2,0,0]=4 15567 B12R1.125 Cc1cccnc1CNC(C)C 34a_100011223789_100000210206 [0,2,0,0,0,0|2,0,0]=4 15568 B12R1.125 Cc1cccnc1CNC(C)C 34a_100138425928_100000696600 [0,2,0,0,0,0|2,0,0]=4 15569 B12R1.125 Cc1cccnc1COC(C)C 34a_100000212225_100000696600 [0,2,0,0,0,0|2,0,0]=4 15570 B12R1.125 Cc1cccnc1COC(C)C 34a_100000698912_100000210206 [0,2,0,0,0,0|2,0,0]=4 15571 B12R1.125 Cc1cccnc1CSC(C)C 62a_100000210206_100000696600 [0,2,0,0,0,0|2,0,0]=4 15572 B12R1.125 Cc1cccnc1CSC(C)C 62a_100000696600_100000210206 [0,2,0,0,0,0|2,0,0]=4 15573 B12R1.125 Cc1cccnc1SCC(C)C 62a_100000210624_100000751373 [0,2,0,0,0,0|2,0,0]=4 15574 B12R1.125 Cc1cccnc1SCC(C)C 62a_100000751373_100000210760 [0,2,0,0,0,0|2,0,0]=4 15575 B12R1.125 Cc1cccnc1SCC(C)O 62a_100000751373_100011218427 [0,2,0,0,0,0|2,0,0]=4 15576 B12R1.125 Cc1cccnc1SCC(C)O 62a_100011218427_100000751373 [0,2,0,0,0,0|2,0,0]=4 15577 B12R1.125 Cc1cccnc1SC[C@@H](C)O 62a_100000751373_100009817552 [0,2,0,0,0,0|2,0,0]=4 15578 B12R1.125 Cc1cccnc1SC[C@@H](C)O 62a_100009817552_100000751373 [0,2,0,0,0,0|2,0,0]=4 15579 B12R1.125 Cc1ccncc1CNC(C)C 207a_100138425928_100000685662 [0,2,0,0,0,0|2,0,0]=4 15580 B12R1.125 Cc1ccncc1CNC(C)C 2230a_100138425928_100000690890 [0,2,0,0,0,0|2,0,0]=4 15581 B12R1.125 Cc1ccncc1CNC(C)C 34a_100138425928_100000690890 [0,2,0,0,0,0|2,0,0]=4 15582 B12R1.125 Cc1ccncc1COC(C)C 34a_100000212225_100000690890 [0,2,0,0,0,0|2,0,0]=4 15583 B12R1.125 Cc1ccncc1COC(C)C 34a_100011996381_100000210206 [0,2,0,0,0,0|2,0,0]=4 15584 B12R1.125 Cc1ccncc1CSC(C)C 62a_100000210206_100000690890 [0,2,0,0,0,0|2,0,0]=4 15585 B12R1.125 Cc1ccncc1CSC(C)C 62a_100000690890_100000210206 [0,2,0,0,0,0|2,0,0]=4 15586 B12R1.125 Cc1ccncc1OCC(C)C 34a_100011997053_100000210624 [0,2,0,0,0,0|2,0,0]=4 15587 B12R1.125 Cc1ccncc1OCC(C)C 7a_100011997053_100000210760 [0,2,0,0,0,0|2,0,0]=4 15588 B12R1.125 Cc1ccncc1OCC(C)O 34a_100011997053_100011218427 [0,2,0,0,0,0|2,0,0]=4 15589 B12R1.125 Cc1ccncc1OCC(C)O 7a_100011997053_100011218427 [0,2,0,0,0,0|2,0,0]=4 15590 B12R1.125 Cc1ccncc1OC[C@@H](C)O 34a_100011997053_100009817552 [0,2,0,0,0,0|2,0,0]=4 15591 B12R1.125 Cc1ccncc1OC[C@@H](C)O 7a_100011997053_100009817552 [0,2,0,0,0,0|2,0,0]=4 15592 B12R1.125 Cc1ccncc1SCC(C)C 62a_100000210624_100000761580 [0,2,0,0,0,0|2,0,0]=4 15593 B12R1.125 Cc1ccncc1SCC(C)C 62a_100000761580_100000210760 [0,2,0,0,0,0|2,0,0]=4 15594 B12R1.125 Cc1ccncc1SCC(C)O 62a_100000761580_100011218427 [0,2,0,0,0,0|2,0,0]=4 15595 B12R1.125 Cc1ccncc1SCC(C)O 62a_100011218427_100000761580 [0,2,0,0,0,0|2,0,0]=4 15596 B12R1.125 Cc1ccncc1SC[C@@H](C)O 62a_100000761580_100009817552 [0,2,0,0,0,0|2,0,0]=4 15597 B12R1.125 Cc1ccncc1SC[C@@H](C)O 62a_100009817552_100000761580 [0,2,0,0,0,0|2,0,0]=4 15598 B12R1.125 Cc1cnccc1CNC(C)C 2230a_100138425928_100020672808 [0,2,0,0,0,0|2,0,0]=4 15599 B12R1.125 Cc1cnccc1CNC(C)C 34a_100138425928_100020672809 [0,2,0,0,0,0|2,0,0]=4 15600 B12R1.125 Cc1cnccc1COC(C)C 34a_100000212225_100020672809 [0,2,0,0,0,0|2,0,0]=4 15601 B12R1.125 Cc1cnccc1COC(C)C 34a_100011997032_100000210206 [0,2,0,0,0,0|2,0,0]=4 15602 B12R1.125 Cc1cnccc1CSC(C)C 62a_100000210206_100020672808 [0,2,0,0,0,0|2,0,0]=4 15603 B12R1.125 Cc1cnccc1CSC(C)C 62a_100020672808_100000210206 [0,2,0,0,0,0|2,0,0]=4 15604 B12R1.125 Cc1cnccc1NCC(C)C 27a_100000210953_100000765111 [0,2,0,0,0,0|2,0,0]=4 15605 B12R1.125 Cc1cnccc1NCC(C)O 27a_100000210904_100000765111 [0,2,0,0,0,0|2,0,0]=4 15606 B12R1.125 Cc1cnccc1OCC(C)C 34a_100000694293_100000210624 [0,2,0,0,0,0|2,0,0]=4 15607 B12R1.125 Cc1cnccc1OCC(C)O 34a_100000694293_100011218427 [0,2,0,0,0,0|2,0,0]=4 15608 B12R1.125 Cc1cnccc1OC[C@@H](C)O 34a_100000694293_100009817552 [0,2,0,0,0,0|2,0,0]=4 15609 B12R1.125 Cc1cnccc1SCC(C)C 62a_100000210624_100000765111 [0,2,0,0,0,0|2,0,0]=4 15610 B12R1.125 Cc1cnccc1SCC(C)C 62a_100000765111_100000210760 [0,2,0,0,0,0|2,0,0]=4 15611 B12R1.125 Cc1cnccc1SCC(C)O 62a_100000765111_100011218427 [0,2,0,0,0,0|2,0,0]=4 15612 B12R1.125 Cc1cnccc1SCC(C)O 62a_100011218427_100000765111 [0,2,0,0,0,0|2,0,0]=4 15613 B12R1.125 Cc1cnccc1SC[C@@H](C)O 62a_100000765111_100009817552 [0,2,0,0,0,0|2,0,0]=4 15614 B12R1.125 Cc1cnccc1SC[C@@H](C)O 62a_100009817552_100000765111 [0,2,0,0,0,0|2,0,0]=4 15615 B12R1.125 Cc1ncccc1CNC(C)C 207a_100138425928_100000751968 [0,2,0,0,0,0|2,0,0]=4 15616 B12R1.125 Cc1ncccc1CNC(C)C 2230a_100138425928_100000732876 [0,2,0,0,0,0|2,0,0]=4 15617 B12R1.125 Cc1ncccc1CNC(C)C 34a_100138425928_100000732876 [0,2,0,0,0,0|2,0,0]=4 15618 B12R1.125 Cc1ncccc1COC(C)C 34a_100000212225_100000732876 [0,2,0,0,0,0|2,0,0]=4 15619 B12R1.125 Cc1ncccc1COC(C)C 34a_100000729262_100000210206 [0,2,0,0,0,0|2,0,0]=4 15620 B12R1.125 Cc1ncccc1COC(C)C 7a_100000729262_100000210206 [0,2,0,0,0,0|2,0,0]=4 15621 B12R1.125 Cc1ncccc1CSC(C)C 62a_100000210206_100000732876 [0,2,0,0,0,0|2,0,0]=4 15622 B12R1.125 Cc1ncccc1CSC(C)C 62a_100000732876_100000210206 [0,2,0,0,0,0|2,0,0]=4 15623 B12R1.125 Cc1ncccc1OCC(C)C 34a_100000745507_100000210624 [0,2,0,0,0,0|2,0,0]=4 15624 B12R1.125 Cc1ncccc1OCC(C)C 7a_100000745507_100000210760 [0,2,0,0,0,0|2,0,0]=4 15625 B12R1.125 Cc1ncccc1OCC(C)O 34a_100000745507_100011218427 [0,2,0,0,0,0|2,0,0]=4 15626 B12R1.125 Cc1ncccc1OCC(C)O 7a_100000745507_100011218427 [0,2,0,0,0,0|2,0,0]=4 15627 B12R1.125 Cc1ncccc1OC[C@@H](C)O 34a_100000745507_100009817552 [0,2,0,0,0,0|2,0,0]=4 15628 B12R1.125 Cc1ncccc1OC[C@@H](C)O 7a_100000745507_100009817552 [0,2,0,0,0,0|2,0,0]=4 15629 B12R1.125 Cc1ncccc1SCC(C)C 62a_100000210624_100000751574 [0,2,0,0,0,0|2,0,0]=4 15630 B12R1.125 Cc1ncccc1SCC(C)C 62a_100000751574_100000210760 [0,2,0,0,0,0|2,0,0]=4 15631 B12R1.125 Cc1ncccc1SCC(C)O 62a_100000751574_100011218427 [0,2,0,0,0,0|2,0,0]=4 15632 B12R1.125 Cc1ncccc1SCC(C)O 62a_100011218427_100000751574 [0,2,0,0,0,0|2,0,0]=4 15633 B12R1.125 Cc1ncccc1SC[C@@H](C)O 62a_100000751574_100009817552 [0,2,0,0,0,0|2,0,0]=4 15634 B12R1.125 Cc1ncccc1SC[C@@H](C)O 62a_100009817552_100000751574 [0,2,0,0,0,0|2,0,0]=4 15635 B12R1.125 FC(F)CNc1ccccc1Br 34a_100000210017_100011934356 [0,2,0,0,0,0|2,0,0]=4 15636 B12R1.125 FC(F)CNc1ccccc1Cl 34a_100000185783_100011934356 [0,2,0,0,0,0|2,0,0]=4 15637 B12R1.125 FC(F)CNc1ccccc1I 34a_100000210053_100011934356 [0,2,0,0,0,0|2,0,0]=4 15638 B12R1.125 FC(F)COc1ccccc1Br 34a_100000181306_100011934356 [0,2,0,0,0,0|2,0,0]=4 15639 B12R1.125 FC(F)COc1ccccc1Br 7a_100000181306_100011934356 [0,2,0,0,0,0|2,0,0]=4 15640 B12R1.125 FC(F)COc1ccccc1Cl 34a_100000210172_100011934356 [0,2,0,0,0,0|2,0,0]=4 15641 B12R1.125 FC(F)COc1ccccc1Cl 7a_100000210172_100011934356 [0,2,0,0,0,0|2,0,0]=4 15642 B12R1.125 FC(F)COc1ccccc1I 34a_100000739446_100011934356 [0,2,0,0,0,0|2,0,0]=4 15643 B12R1.125 FC(F)COc1ccccc1I 7a_100000739446_100011934356 [0,2,0,0,0,0|2,0,0]=4 15644 B12R1.125 FC(F)CSc1ccccc1Br 62a_100000695589_100011934356 [0,2,0,0,0,0|2,0,0]=4 15645 B12R1.125 FC(F)CSc1ccccc1Br 62a_100011934356_100000695589 [0,2,0,0,0,0|2,0,0]=4 15646 B12R1.125 FC(F)CSc1ccccc1Cl 62a_100000764095_100011934356 [0,2,0,0,0,0|2,0,0]=4 15647 B12R1.125 FC(F)CSc1ccccc1Cl 62a_100011934356_100000764095 [0,2,0,0,0,0|2,0,0]=4 15648 B12R1.125 Fc1ccccc1NCC(F)F 34a_100000210422_100011934356 [0,2,0,0,0,0|2,0,0]=4 15649 B12R1.125 Fc1ccccc1OCC(F)F 34a_100000210171_100011934356 [0,2,0,0,0,0|2,0,0]=4 15650 B12R1.125 Fc1ccccc1OCC(F)F 7a_100000210171_100011934356 [0,2,0,0,0,0|2,0,0]=4 15651 B12R1.125 Fc1ccccc1SCC(F)F 62a_100011215700_100011934356 [0,2,0,0,0,0|2,0,0]=4 15652 B12R1.125 Fc1ccccc1SCC(F)F 62a_100011934356_100011215700 [0,2,0,0,0,0|2,0,0]=4 15653 B12R1.125 NC(=O)CCc1ccccc1O 271570a_203496583355_100009814947 [0,2,0,0,0,0|0,0,1]=3 15654 B12R1.125 NC(=O)CNc1ccccc1O 34a_100000185747_100000187820 [0,2,0,0,0,0|1,0,1]=4 15655 B12R1.125 NC(=O)COc1ccccc1O 271570a_203496583355_200000148491 [0,2,0,0,0,0|1,0,1]=4 15656 B12R1.125 NC(=O)CSc1ccccc1O 62a_100000739446_100000747473 [0,2,0,0,0,0|1,0,1]=4 15657 B12R1.125 NC(=O)CSc1ccccc1O 62a_100000747473_100000739446 [0,2,0,0,0,0|1,0,1]=4 15658 B12R1.125 Nc1ccccc1OCC(F)F 34a_100000185747_100011934356 [0,2,0,0,0,0|2,0,0]=4 15659 B12R1.125 Nc1ccccc1OCC(F)F 7a_100000185747_100011934356 [0,2,0,0,0,0|2,0,0]=4 15660 B12R1.125 Nc1ccccc1SCC(F)F 62a_100000210017_100011934356 [0,2,0,0,0,0|2,0,0]=4 15661 B12R1.125 Nc1ccccc1SCC(F)F 62a_100011934356_100000210017 [0,2,0,0,0,0|2,0,0]=4 15662 B12R1.125 O=C([O-])CNc1ccccc1O 34a_100000185747_100020667443 [0,2,0,0,0,0|1,0,1]=4 15663 B12R1.125 O=C([O-])CSc1ccccc1O 62a_100000739446_100020667443 [0,2,0,0,0,0|1,0,1]=4 15664 B12R1.125 O=C([O-])CSc1ccccc1O 62a_100020667443_100000739446 [0,2,0,0,0,0|1,0,1]=4 15665 B12R1.125 O=[N+]([O-])CNc1ccccc1O 34a_100000185747_100000761209 [0,2,0,0,0,0|2,0,0]=4 15666 B12R1.125 O=[N+]([O-])CSc1ccccc1O 62a_100000739446_100000761209 [0,2,0,0,0,0|2,0,0]=4 15667 B12R1.125 Oc1ccccc1NCC(F)F 34a_100000185747_100011934356 [0,2,0,0,0,0|1,0,0]=3 15668 B12R1.125 Oc1ccccc1OCC(F)F 271570a_203496583355_100000692002 [0,2,0,0,0,0|1,0,0]=3 15669 B12R1.125 Oc1ccccc1SCC(F)F 62a_100000739446_100011934356 [0,2,0,0,0,0|1,0,0]=3 15670 B12R1.125 Oc1ccccc1SCC(F)F 62a_100011934356_100000739446 [0,2,0,0,0,0|1,0,0]=3 15671 B12R1.125 Oc1cccnc1SCC(F)F 62a_100000034122_100011934356 [0,2,0,0,0,0|2,0,0]=4 15672 B12R1.125 Oc1cccnc1SCC(F)F 62a_100011934356_100000034122 [0,2,0,0,0,0|2,0,0]=4 15673 B12R1.125 Oc1cnccc1SCC(F)F 62a_100009817591_100011934356 [0,2,0,0,0,0|2,0,0]=4 15674 B12R1.125 Oc1cnccc1SCC(F)F 62a_100011934356_100009817591 [0,2,0,0,0,0|2,0,0]=4 15675 B12R1.125 Oc1ncccc1SCC(F)F 62a_100000760158_100011934356 [0,2,0,0,0,0|2,0,0]=4 15676 B12R1.125 Oc1ncccc1SCC(F)F 62a_100011934356_100000760158 [0,2,0,0,0,0|2,0,0]=4 15677 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1O 1458a_100016263591_200025704644 [0,2,0,0,0,0|0,0,2]=4 15678 B12R1.125 [13CH3]C(=O)CCc1ccccc1Br 1458a_100000740810_200025704644 [0,2,0,0,0,0|1,0,0]=3 15679 B12R1.125 [13CH3]C(=O)CCc1ccccc1Cl 1458a_100000184300_200025704644 [0,2,0,0,0,0|1,0,0]=3 15680 B12R1.125 [13CH3]C(=O)CCc1ccccc1F 1458a_100000189703_200025704644 [0,2,0,0,0,0|1,0,0]=3 15681 B12R1.125 [13CH3]C(=O)CCc1ccccc1I 1458a_100000037306_200025704644 [0,2,0,0,0,0|1,0,0]=3 15682 B12R1.125 [13CH3]C(=O)CCc1ccccc1O 1458a_100000181328_200025704644 [0,2,0,0,0,0|0,0,0]=2 15683 B12R1.125 [13CH3]C(=O)CCn1ccccc1=O 1458a_100000738505_200025704644 [0,2,0,0,0,0|1,0,1]=4 15684 B12R1.125 [13CH3]C(=O)COc1ccccc1Br 1458a_100000216496_200025704644 [0,2,0,0,0,0|1,0,1]=4 15685 B12R1.125 [13CH3]C(=O)COc1ccccc1Cl 1458a_100000185159_200025704644 [0,2,0,0,0,0|1,0,1]=4 15686 B12R1.125 [13CH3]C(=O)COc1ccccc1F 1458a_100000182486_200025704644 [0,2,0,0,0,0|1,0,1]=4 15687 B12R1.125 [13CH3]C(=O)COc1ccccc1O 1458a_100000183020_200025704644 [0,2,0,0,0,0|0,0,1]=3 15688 B12R1.125 [13CH3]C(=O)CSc1ccccc1F 1458a_100000179528_200025704644 [0,2,0,0,0,0|1,0,1]=4 15689 B12R1.125 [13CH3]C(=O)CSc1ccccc1O 1458a_100000695322_200025704644 [0,2,0,0,0,0|0,0,1]=3 15690 B12R1.267 BrCCOCc1ccccc1Br 34a_100000211926_100000184730 [0,2,0,0,0,0|1,0,0]=3 15691 B12R1.267 BrCCOCc1ccccc1I 34a_100000211926_100011215278 [0,2,0,0,0,0|1,0,0]=3 15692 B12R1.267 BrCCOCc1cccnc1Br 34a_100000211926_100010140945 [0,2,0,0,0,0|2,0,0]=4 15693 B12R1.267 BrCCOCc1ncccc1Br 34a_100000211926_100025702911 [0,2,0,0,0,0|2,0,0]=4 15694 B12R1.267 C#CCCNc1ccccc1Br 34a_100000210017_100000688953 [0,2,0,0,0,0|1,0,1]=4 15695 B12R1.267 C#CCCNc1ccccc1C 34a_100015192222_100000688953 [0,2,0,0,0,0|1,0,1]=4 15696 B12R1.267 C#CCCNc1ccccc1Cl 34a_100000185783_100000688953 [0,2,0,0,0,0|1,0,1]=4 15697 B12R1.267 C#CCCNc1ccccc1F 34a_100000210422_100000688953 [0,2,0,0,0,0|1,0,1]=4 15698 B12R1.267 C#CCCNc1ccccc1I 34a_100000210053_100000688953 [0,2,0,0,0,0|1,0,1]=4 15699 B12R1.267 C#CCCNc1ccccc1O 34a_100000185747_100000688953 [0,2,0,0,0,0|0,0,1]=3 15700 B12R1.267 C#CCCOc1ccccc1Br 34a_100000181306_100000688953 [0,2,0,0,0,0|1,0,1]=4 15701 B12R1.267 C#CCCOc1ccccc1Br 7a_100000181306_100000688953 [0,2,0,0,0,0|1,0,1]=4 15702 B12R1.267 C#CCCOc1ccccc1C 34a_100000210338_100000688953 [0,2,0,0,0,0|1,0,1]=4 15703 B12R1.267 C#CCCOc1ccccc1C 7a_100000210338_100000688953 [0,2,0,0,0,0|1,0,1]=4 15704 B12R1.267 C#CCCOc1ccccc1Cl 34a_100000210172_100000688953 [0,2,0,0,0,0|1,0,1]=4 15705 B12R1.267 C#CCCOc1ccccc1Cl 7a_100000210172_100000688953 [0,2,0,0,0,0|1,0,1]=4 15706 B12R1.267 C#CCCOc1ccccc1F 34a_100000210171_100000688953 [0,2,0,0,0,0|1,0,1]=4 15707 B12R1.267 C#CCCOc1ccccc1F 7a_100000210171_100000688953 [0,2,0,0,0,0|1,0,1]=4 15708 B12R1.267 C#CCCOc1ccccc1I 34a_100000739446_100000688953 [0,2,0,0,0,0|1,0,1]=4 15709 B12R1.267 C#CCCOc1ccccc1I 7a_100000739446_100000688953 [0,2,0,0,0,0|1,0,1]=4 15710 B12R1.267 C#CCCOc1ccccc1N 34a_100000185747_100000688953 [0,2,0,0,0,0|1,0,1]=4 15711 B12R1.267 C#CCCOc1ccccc1N 7a_100000185747_100000688953 [0,2,0,0,0,0|1,0,1]=4 15712 B12R1.267 C#CCCSc1ccccc1Br 62a_100000688953_100000695589 [0,2,0,0,0,0|1,0,1]=4 15713 B12R1.267 C#CCCSc1ccccc1Br 62a_100000695589_100000688953 [0,2,0,0,0,0|1,0,1]=4 15714 B12R1.267 C#CCCSc1ccccc1C 62a_100000210755_100000688953 [0,2,0,0,0,0|1,0,1]=4 15715 B12R1.267 C#CCCSc1ccccc1C 62a_100000688953_100000210755 [0,2,0,0,0,0|1,0,1]=4 15716 B12R1.267 C#CCCSc1ccccc1Cl 62a_100000688953_100000764095 [0,2,0,0,0,0|1,0,1]=4 15717 B12R1.267 C#CCCSc1ccccc1Cl 62a_100000764095_100000688953 [0,2,0,0,0,0|1,0,1]=4 15718 B12R1.267 C#CCCSc1ccccc1F 62a_100000688953_100011215700 [0,2,0,0,0,0|1,0,1]=4 15719 B12R1.267 C#CCCSc1ccccc1F 62a_100011215700_100000688953 [0,2,0,0,0,0|1,0,1]=4 15720 B12R1.267 C#CCCSc1ccccc1N 62a_100000210017_100000688953 [0,2,0,0,0,0|1,0,1]=4 15721 B12R1.267 C#CCCSc1ccccc1N 62a_100000688953_100000210017 [0,2,0,0,0,0|1,0,1]=4 15722 B12R1.267 C#CCCSc1ccccc1O 62a_100000688953_100000739446 [0,2,0,0,0,0|0,0,1]=3 15723 B12R1.267 C#CCCSc1ccccc1O 62a_100000739446_100000688953 [0,2,0,0,0,0|0,0,1]=3 15724 B12R1.267 C#CCCSc1cccnc1O 62a_100000688953_100000760158 [0,2,0,0,0,0|1,0,1]=4 15725 B12R1.267 C#CCCSc1cccnc1O 62a_100000760158_100000688953 [0,2,0,0,0,0|1,0,1]=4 15726 B12R1.267 C#CCCSc1ccncc1O 62a_100000688953_100009817591 [0,2,0,0,0,0|1,0,1]=4 15727 B12R1.267 C#CCCSc1ccncc1O 62a_100009817591_100000688953 [0,2,0,0,0,0|1,0,1]=4 15728 B12R1.267 C#CCCSc1ncccc1O 62a_100000034122_100000688953 [0,2,0,0,0,0|1,0,1]=4 15729 B12R1.267 C#CCCSc1ncccc1O 62a_100000688953_100000034122 [0,2,0,0,0,0|1,0,1]=4 15730 B12R1.267 C#CCNCc1ccccc1Br 2230a_100000689332_100000038162 [0,2,0,0,0,0|1,0,1]=4 15731 B12R1.267 C#CCNCc1ccccc1Br 34a_100000212058_100000184730 [0,2,0,0,0,0|1,0,1]=4 15732 B12R1.267 C#CCNCc1ccccc1Br 34a_100000689332_100000184674 [0,2,0,0,0,0|1,0,1]=4 15733 B12R1.267 C#CCNCc1ccccc1C 34a_100000174972_100000184674 [0,2,0,0,0,0|1,0,1]=4 15734 B12R1.267 C#CCNCc1ccccc1C 34a_100000212058_100000211839 [0,2,0,0,0,0|1,0,1]=4 15735 B12R1.267 C#CCNCc1ccccc1Cl 2230a_100000174879_100000038162 [0,2,0,0,0,0|1,0,1]=4 15736 B12R1.267 C#CCNCc1ccccc1Cl 34a_100000174879_100000184674 [0,2,0,0,0,0|1,0,1]=4 15737 B12R1.267 C#CCNCc1ccccc1Cl 34a_100000212058_100000187162 [0,2,0,0,0,0|1,0,1]=4 15738 B12R1.267 C#CCNCc1ccccc1F 34a_100000174869_100000184674 [0,2,0,0,0,0|1,0,1]=4 15739 B12R1.267 C#CCNCc1ccccc1F 34a_100000212058_100000211605 [0,2,0,0,0,0|1,0,1]=4 15740 B12R1.267 C#CCNCc1ccccc1I 34a_100000212058_100011215278 [0,2,0,0,0,0|1,0,1]=4 15741 B12R1.267 C#CCNCc1ccccc1O 34a_100000185550_100000184674 [0,2,0,0,0,0|0,0,1]=3 15742 B12R1.267 C#CCNCc1ncccc1O 34a_100000212058_200020655725 [0,2,0,0,0,0|1,0,1]=4 15743 B12R1.267 C#CCOCc1ccccc1Br 34a_100000210247_100000184730 [0,2,0,0,0,0|1,0,1]=4 15744 B12R1.267 C#CCOCc1ccccc1Br 34a_100000756307_100000184674 [0,2,0,0,0,0|1,0,1]=4 15745 B12R1.267 C#CCOCc1ccccc1Br 7a_100000756307_100000038162 [0,2,0,0,0,0|1,0,1]=4 15746 B12R1.267 C#CCOCc1ccccc1C 34a_100000210247_100000211839 [0,2,0,0,0,0|1,0,1]=4 15747 B12R1.267 C#CCOCc1ccccc1C 34a_100000698903_100000184674 [0,2,0,0,0,0|1,0,1]=4 15748 B12R1.267 C#CCOCc1ccccc1C 7a_100000698903_100000038162 [0,2,0,0,0,0|1,0,1]=4 15749 B12R1.267 C#CCOCc1ccccc1Cl 34a_100000210247_100000187162 [0,2,0,0,0,0|1,0,1]=4 15750 B12R1.267 C#CCOCc1ccccc1Cl 34a_100000210847_100000184674 [0,2,0,0,0,0|1,0,1]=4 15751 B12R1.267 C#CCOCc1ccccc1Cl 7a_100000210847_100000038162 [0,2,0,0,0,0|1,0,1]=4 15752 B12R1.267 C#CCOCc1ccccc1F 34a_100000210247_100000211605 [0,2,0,0,0,0|1,0,1]=4 15753 B12R1.267 C#CCOCc1ccccc1F 34a_100000211962_100000184674 [0,2,0,0,0,0|1,0,1]=4 15754 B12R1.267 C#CCOCc1ccccc1F 7a_100000211962_100000038162 [0,2,0,0,0,0|1,0,1]=4 15755 B12R1.267 C#CCOCc1ccccc1I 34a_100000187465_100000184674 [0,2,0,0,0,0|1,0,1]=4 15756 B12R1.267 C#CCOCc1ccccc1I 34a_100000210247_100011215278 [0,2,0,0,0,0|1,0,1]=4 15757 B12R1.267 C#CCOCc1ccccc1I 7a_100000187465_100000038162 [0,2,0,0,0,0|1,0,1]=4 15758 B12R1.267 C#CCOCc1ccccc1N 34a_100000212039_100000184674 [0,2,0,0,0,0|1,0,1]=4 15759 B12R1.267 C#CCOCc1ncccc1O 34a_100000210247_200020655725 [0,2,0,0,0,0|1,0,1]=4 15760 B12R1.267 C#CCSCc1ccccc1Br 62a_100000038162_100000184730 [0,2,0,0,0,0|1,0,1]=4 15761 B12R1.267 C#CCSCc1ccccc1C 62a_100000038162_100000211839 [0,2,0,0,0,0|1,0,1]=4 15762 B12R1.267 C#CCSCc1ccccc1Cl 62a_100000038162_100000187162 [0,2,0,0,0,0|1,0,1]=4 15763 B12R1.267 C#CCSCc1ccccc1F 62a_100000038162_100000211605 [0,2,0,0,0,0|1,0,1]=4 15764 B12R1.267 C#CCSCc1ccccc1I 62a_100000038162_100011216222 [0,2,0,0,0,0|1,0,1]=4 15765 B12R1.267 C#CCSCc1ncccc1O 62a_100000038162_200020655725 [0,2,0,0,0,0|1,0,1]=4 15766 B12R1.267 C/C=C/CNc1ccccc1Br 34a_100000210017_100102629194 [0,2,0,0,0,0|1,0,1]=4 15767 B12R1.267 C/C=C/CNc1ccccc1C 34a_100015192222_100102629194 [0,2,0,0,0,0|1,0,1]=4 15768 B12R1.267 C/C=C/CNc1ccccc1Cl 34a_100000185783_100102629194 [0,2,0,0,0,0|1,0,1]=4 15769 B12R1.267 C/C=C/CNc1ccccc1F 34a_100000210422_100102629194 [0,2,0,0,0,0|1,0,1]=4 15770 B12R1.267 C/C=C/CNc1ccccc1I 34a_100000210053_100102629194 [0,2,0,0,0,0|1,0,1]=4 15771 B12R1.267 C/C=C/CNc1ccccc1O 34a_100000185747_100102629194 [0,2,0,0,0,0|0,0,1]=3 15772 B12R1.267 C/C=C/COc1ccccc1Br 34a_100000181306_100102629194 [0,2,0,0,0,0|1,0,1]=4 15773 B12R1.267 C/C=C/COc1ccccc1Br 7a_100000181306_100102629194 [0,2,0,0,0,0|1,0,1]=4 15774 B12R1.267 C/C=C/COc1ccccc1C 34a_100000210338_100102629194 [0,2,0,0,0,0|1,0,1]=4 15775 B12R1.267 C/C=C/COc1ccccc1C 7a_100000210338_100102629194 [0,2,0,0,0,0|1,0,1]=4 15776 B12R1.267 C/C=C/COc1ccccc1Cl 34a_100000210172_100102629194 [0,2,0,0,0,0|1,0,1]=4 15777 B12R1.267 C/C=C/COc1ccccc1Cl 7a_100000210172_100102629194 [0,2,0,0,0,0|1,0,1]=4 15778 B12R1.267 C/C=C/COc1ccccc1F 34a_100000210171_100102629194 [0,2,0,0,0,0|1,0,1]=4 15779 B12R1.267 C/C=C/COc1ccccc1F 7a_100000210171_100102629194 [0,2,0,0,0,0|1,0,1]=4 15780 B12R1.267 C/C=C/COc1ccccc1I 34a_100000739446_100102629194 [0,2,0,0,0,0|1,0,1]=4 15781 B12R1.267 C/C=C/COc1ccccc1I 7a_100000739446_100102629194 [0,2,0,0,0,0|1,0,1]=4 15782 B12R1.267 C/C=C/COc1ccccc1N 34a_100000185747_100102629194 [0,2,0,0,0,0|1,0,1]=4 15783 B12R1.267 C/C=C/COc1ccccc1N 7a_100000185747_100102629194 [0,2,0,0,0,0|1,0,1]=4 15784 B12R1.267 C/C=C/CSc1ccccc1Br 62a_100000695589_100102629194 [0,2,0,0,0,0|1,0,1]=4 15785 B12R1.267 C/C=C/CSc1ccccc1Br 62a_100102629194_100000695589 [0,2,0,0,0,0|1,0,1]=4 15786 B12R1.267 C/C=C/CSc1ccccc1C 62a_100000210755_100102629194 [0,2,0,0,0,0|1,0,1]=4 15787 B12R1.267 C/C=C/CSc1ccccc1C 62a_100102629194_100000210755 [0,2,0,0,0,0|1,0,1]=4 15788 B12R1.267 C/C=C/CSc1ccccc1Cl 62a_100000764095_100102629194 [0,2,0,0,0,0|1,0,1]=4 15789 B12R1.267 C/C=C/CSc1ccccc1Cl 62a_100102629194_100000764095 [0,2,0,0,0,0|1,0,1]=4 15790 B12R1.267 C/C=C/CSc1ccccc1F 62a_100011215700_100102629194 [0,2,0,0,0,0|1,0,1]=4 15791 B12R1.267 C/C=C/CSc1ccccc1F 62a_100102629194_100011215700 [0,2,0,0,0,0|1,0,1]=4 15792 B12R1.267 C/C=C/CSc1ccccc1N 62a_100000210017_100102629194 [0,2,0,0,0,0|1,0,1]=4 15793 B12R1.267 C/C=C/CSc1ccccc1N 62a_100102629194_100000210017 [0,2,0,0,0,0|1,0,1]=4 15794 B12R1.267 C/C=C/CSc1ccccc1O 62a_100000739446_100102629194 [0,2,0,0,0,0|0,0,1]=3 15795 B12R1.267 C/C=C/CSc1ccccc1O 62a_100102629194_100000739446 [0,2,0,0,0,0|0,0,1]=3 15796 B12R1.267 C/C=C/CSc1cccnc1O 62a_100000760158_100102629194 [0,2,0,0,0,0|1,0,1]=4 15797 B12R1.267 C/C=C/CSc1cccnc1O 62a_100102629194_100000760158 [0,2,0,0,0,0|1,0,1]=4 15798 B12R1.267 C/C=C/CSc1ccncc1O 62a_100009817591_100102629194 [0,2,0,0,0,0|1,0,1]=4 15799 B12R1.267 C/C=C/CSc1ccncc1O 62a_100102629194_100009817591 [0,2,0,0,0,0|1,0,1]=4 15800 B12R1.267 C/C=C/CSc1ncccc1O 62a_100000034122_100102629194 [0,2,0,0,0,0|1,0,1]=4 15801 B12R1.267 C/C=C/CSc1ncccc1O 62a_100102629194_100000034122 [0,2,0,0,0,0|1,0,1]=4 15802 B12R1.267 C=CCCNc1ccccc1Br 34a_100000210017_100000754431 [0,2,0,0,0,0|1,0,1]=4 15803 B12R1.267 C=CCCNc1ccccc1C 34a_100015192222_100000754431 [0,2,0,0,0,0|1,0,1]=4 15804 B12R1.267 C=CCCNc1ccccc1Cl 34a_100000185783_100000754431 [0,2,0,0,0,0|1,0,1]=4 15805 B12R1.267 C=CCCNc1ccccc1F 34a_100000210422_100000754431 [0,2,0,0,0,0|1,0,1]=4 15806 B12R1.267 C=CCCNc1ccccc1I 34a_100000210053_100000754431 [0,2,0,0,0,0|1,0,1]=4 15807 B12R1.267 C=CCCNc1ccccc1O 34a_100000185747_100000754431 [0,2,0,0,0,0|0,0,1]=3 15808 B12R1.267 C=CCCOc1ccccc1Br 34a_100000181306_100000754431 [0,2,0,0,0,0|1,0,1]=4 15809 B12R1.267 C=CCCOc1ccccc1Br 7a_100000181306_100000754431 [0,2,0,0,0,0|1,0,1]=4 15810 B12R1.267 C=CCCOc1ccccc1C 34a_100000210338_100000754431 [0,2,0,0,0,0|1,0,1]=4 15811 B12R1.267 C=CCCOc1ccccc1C 7a_100000210338_100000754431 [0,2,0,0,0,0|1,0,1]=4 15812 B12R1.267 C=CCCOc1ccccc1Cl 34a_100000210172_100000754431 [0,2,0,0,0,0|1,0,1]=4 15813 B12R1.267 C=CCCOc1ccccc1Cl 7a_100000210172_100000754431 [0,2,0,0,0,0|1,0,1]=4 15814 B12R1.267 C=CCCOc1ccccc1F 34a_100000210171_100000754431 [0,2,0,0,0,0|1,0,1]=4 15815 B12R1.267 C=CCCOc1ccccc1F 7a_100000210171_100000754431 [0,2,0,0,0,0|1,0,1]=4 15816 B12R1.267 C=CCCOc1ccccc1I 34a_100000739446_100000754431 [0,2,0,0,0,0|1,0,1]=4 15817 B12R1.267 C=CCCOc1ccccc1I 7a_100000739446_100000754431 [0,2,0,0,0,0|1,0,1]=4 15818 B12R1.267 C=CCCOc1ccccc1N 34a_100000185747_100000754431 [0,2,0,0,0,0|1,0,1]=4 15819 B12R1.267 C=CCCOc1ccccc1N 7a_100000185747_100000754431 [0,2,0,0,0,0|1,0,1]=4 15820 B12R1.267 C=CCCSc1ccccc1Br 62a_100000695589_100000754431 [0,2,0,0,0,0|1,0,1]=4 15821 B12R1.267 C=CCCSc1ccccc1Br 62a_100000754431_100000695589 [0,2,0,0,0,0|1,0,1]=4 15822 B12R1.267 C=CCCSc1ccccc1C 62a_100000210755_100000754431 [0,2,0,0,0,0|1,0,1]=4 15823 B12R1.267 C=CCCSc1ccccc1C 62a_100000754431_100000210755 [0,2,0,0,0,0|1,0,1]=4 15824 B12R1.267 C=CCCSc1ccccc1Cl 62a_100000754431_100000764095 [0,2,0,0,0,0|1,0,1]=4 15825 B12R1.267 C=CCCSc1ccccc1Cl 62a_100000764095_100000754431 [0,2,0,0,0,0|1,0,1]=4 15826 B12R1.267 C=CCCSc1ccccc1F 62a_100000754431_100011215700 [0,2,0,0,0,0|1,0,1]=4 15827 B12R1.267 C=CCCSc1ccccc1F 62a_100011215700_100000754431 [0,2,0,0,0,0|1,0,1]=4 15828 B12R1.267 C=CCCSc1ccccc1N 62a_100000210017_100000754431 [0,2,0,0,0,0|1,0,1]=4 15829 B12R1.267 C=CCCSc1ccccc1N 62a_100000754431_100000210017 [0,2,0,0,0,0|1,0,1]=4 15830 B12R1.267 C=CCCSc1ccccc1O 62a_100000739446_100000754431 [0,2,0,0,0,0|0,0,1]=3 15831 B12R1.267 C=CCCSc1ccccc1O 62a_100000754431_100000739446 [0,2,0,0,0,0|0,0,1]=3 15832 B12R1.267 C=CCCSc1cccnc1O 62a_100000754431_100000760158 [0,2,0,0,0,0|1,0,1]=4 15833 B12R1.267 C=CCCSc1cccnc1O 62a_100000760158_100000754431 [0,2,0,0,0,0|1,0,1]=4 15834 B12R1.267 C=CCCSc1ccncc1O 62a_100000754431_100009817591 [0,2,0,0,0,0|1,0,1]=4 15835 B12R1.267 C=CCCSc1ccncc1O 62a_100009817591_100000754431 [0,2,0,0,0,0|1,0,1]=4 15836 B12R1.267 C=CCCSc1ncccc1O 62a_100000034122_100000754431 [0,2,0,0,0,0|1,0,1]=4 15837 B12R1.267 C=CCCSc1ncccc1O 62a_100000754431_100000034122 [0,2,0,0,0,0|1,0,1]=4 15838 B12R1.267 C=CCNCc1ccccc1Br 2230a_100000689332_100000210623 [0,2,0,0,0,0|1,0,1]=4 15839 B12R1.267 C=CCNCc1ccccc1Br 2230a_100020586998_100000184730 [0,2,0,0,0,0|1,0,1]=4 15840 B12R1.267 C=CCNCc1ccccc1Br 270004a_100020586998_100000211189 [0,2,0,0,0,0|1,0,1]=4 15841 B12R1.267 C=CCNCc1ccccc1Br 34a_100000689332_100015514636 [0,2,0,0,0,0|1,0,1]=4 15842 B12R1.267 C=CCNCc1ccccc1C 2230a_100020586998_100000211839 [0,2,0,0,0,0|1,0,1]=4 15843 B12R1.267 C=CCNCc1ccccc1C 270004a_100020586998_100000211143 [0,2,0,0,0,0|1,0,1]=4 15844 B12R1.267 C=CCNCc1ccccc1C 34a_100000174972_100015514636 [0,2,0,0,0,0|1,0,1]=4 15845 B12R1.267 C=CCNCc1ccccc1Cl 2230a_100000174879_100000210623 [0,2,0,0,0,0|1,0,1]=4 15846 B12R1.267 C=CCNCc1ccccc1Cl 2230a_100020586998_100000187162 [0,2,0,0,0,0|1,0,1]=4 15847 B12R1.267 C=CCNCc1ccccc1Cl 270004a_100020586998_100000210073 [0,2,0,0,0,0|1,0,1]=4 15848 B12R1.267 C=CCNCc1ccccc1Cl 34a_100000174879_100015514636 [0,2,0,0,0,0|1,0,1]=4 15849 B12R1.267 C=CCNCc1ccccc1F 2230a_100020586998_100000211605 [0,2,0,0,0,0|1,0,1]=4 15850 B12R1.267 C=CCNCc1ccccc1F 270004a_100020586998_100000210811 [0,2,0,0,0,0|1,0,1]=4 15851 B12R1.267 C=CCNCc1ccccc1F 34a_100000174869_100015514636 [0,2,0,0,0,0|1,0,1]=4 15852 B12R1.267 C=CCNCc1ccccc1I 2230a_100020586998_100011215278 [0,2,0,0,0,0|1,0,1]=4 15853 B12R1.267 C=CCNCc1ccccc1I 270004a_100020586998_100000010305 [0,2,0,0,0,0|1,0,1]=4 15854 B12R1.267 C=CCNCc1ccccc1O 34a_100000185550_100015514636 [0,2,0,0,0,0|0,0,1]=3 15855 B12R1.267 C=CCNCc1cccnc1O 270004a_100020586998_100011998315 [0,2,0,0,0,0|1,0,1]=4 15856 B12R1.267 C=CCOCc1ccccc1Br 34a_100000756307_100015514636 [0,2,0,0,0,0|1,0,1]=4 15857 B12R1.267 C=CCOCc1ccccc1Br 34a_200000210373_100000184730 [0,2,0,0,0,0|1,0,1]=4 15858 B12R1.267 C=CCOCc1ccccc1Br 7a_100000756307_100015514636 [0,2,0,0,0,0|1,0,1]=4 15859 B12R1.267 C=CCOCc1ccccc1C 34a_100000698903_100015514636 [0,2,0,0,0,0|1,0,1]=4 15860 B12R1.267 C=CCOCc1ccccc1C 34a_200000210373_100000211839 [0,2,0,0,0,0|1,0,1]=4 15861 B12R1.267 C=CCOCc1ccccc1C 7a_100000698903_100015514636 [0,2,0,0,0,0|1,0,1]=4 15862 B12R1.267 C=CCOCc1ccccc1Cl 34a_100000210847_100015514636 [0,2,0,0,0,0|1,0,1]=4 15863 B12R1.267 C=CCOCc1ccccc1Cl 34a_200000210373_100000187162 [0,2,0,0,0,0|1,0,1]=4 15864 B12R1.267 C=CCOCc1ccccc1Cl 7a_100000210847_100015514636 [0,2,0,0,0,0|1,0,1]=4 15865 B12R1.267 C=CCOCc1ccccc1F 34a_100000211962_100015514636 [0,2,0,0,0,0|1,0,1]=4 15866 B12R1.267 C=CCOCc1ccccc1F 34a_200000210373_100000211605 [0,2,0,0,0,0|1,0,1]=4 15867 B12R1.267 C=CCOCc1ccccc1F 7a_100000211962_100015514636 [0,2,0,0,0,0|1,0,1]=4 15868 B12R1.267 C=CCOCc1ccccc1I 34a_100000187465_100015514636 [0,2,0,0,0,0|1,0,1]=4 15869 B12R1.267 C=CCOCc1ccccc1I 34a_200000210373_100011215278 [0,2,0,0,0,0|1,0,1]=4 15870 B12R1.267 C=CCOCc1ccccc1I 7a_100000187465_100015514636 [0,2,0,0,0,0|1,0,1]=4 15871 B12R1.267 C=CCOCc1ccccc1N 34a_100000212039_100015514636 [0,2,0,0,0,0|1,0,1]=4 15872 B12R1.267 C=CCOCc1ncccc1O 34a_200000210373_200020655725 [0,2,0,0,0,0|1,0,1]=4 15873 B12R1.267 C=CCSCc1ccccc1Br 62a_100000184730_100000210623 [0,2,0,0,0,0|1,0,1]=4 15874 B12R1.267 C=CCSCc1ccccc1Br 62a_100000210623_100000184730 [0,2,0,0,0,0|1,0,1]=4 15875 B12R1.267 C=CCSCc1ccccc1C 62a_100000210623_100000211839 [0,2,0,0,0,0|1,0,1]=4 15876 B12R1.267 C=CCSCc1ccccc1C 62a_100000211839_100000210623 [0,2,0,0,0,0|1,0,1]=4 15877 B12R1.267 C=CCSCc1ccccc1Cl 62a_100000187162_100000210623 [0,2,0,0,0,0|1,0,1]=4 15878 B12R1.267 C=CCSCc1ccccc1Cl 62a_100000210623_100000187162 [0,2,0,0,0,0|1,0,1]=4 15879 B12R1.267 C=CCSCc1ccccc1F 62a_100000210623_100000211605 [0,2,0,0,0,0|1,0,1]=4 15880 B12R1.267 C=CCSCc1ccccc1F 62a_100000211605_100000210623 [0,2,0,0,0,0|1,0,1]=4 15881 B12R1.267 C=CCSCc1ccccc1I 62a_100000210623_100011216222 [0,2,0,0,0,0|1,0,1]=4 15882 B12R1.267 C=CCSCc1ccccc1I 62a_100011216222_100000210623 [0,2,0,0,0,0|1,0,1]=4 15883 B12R1.267 C=CCSCc1ncccc1O 62a_100000210623_200020655725 [0,2,0,0,0,0|1,0,1]=4 15884 B12R1.267 C=CCSCc1ncccc1O 62a_200020655725_100000210623 [0,2,0,0,0,0|1,0,1]=4 15885 B12R1.267 CC#CCNc1ccccc1Br 34a_100000210017_100000748600 [0,2,0,0,0,0|1,0,1]=4 15886 B12R1.267 CC#CCNc1ccccc1C 34a_100015192222_100000748600 [0,2,0,0,0,0|1,0,1]=4 15887 B12R1.267 CC#CCNc1ccccc1Cl 34a_100000185783_100000748600 [0,2,0,0,0,0|1,0,1]=4 15888 B12R1.267 CC#CCNc1ccccc1F 34a_100000210422_100000748600 [0,2,0,0,0,0|1,0,1]=4 15889 B12R1.267 CC#CCNc1ccccc1I 34a_100000210053_100000748600 [0,2,0,0,0,0|1,0,1]=4 15890 B12R1.267 CC#CCNc1ccccc1O 34a_100000185747_100000748600 [0,2,0,0,0,0|0,0,1]=3 15891 B12R1.267 CC#CCOc1ccccc1Br 34a_100000181306_100000748600 [0,2,0,0,0,0|1,0,1]=4 15892 B12R1.267 CC#CCOc1ccccc1Br 7a_100000181306_100000748600 [0,2,0,0,0,0|1,0,1]=4 15893 B12R1.267 CC#CCOc1ccccc1C 34a_100000210338_100000748600 [0,2,0,0,0,0|1,0,1]=4 15894 B12R1.267 CC#CCOc1ccccc1C 7a_100000210338_100000748600 [0,2,0,0,0,0|1,0,1]=4 15895 B12R1.267 CC#CCOc1ccccc1Cl 34a_100000210172_100000748600 [0,2,0,0,0,0|1,0,1]=4 15896 B12R1.267 CC#CCOc1ccccc1Cl 7a_100000210172_100000748600 [0,2,0,0,0,0|1,0,1]=4 15897 B12R1.267 CC#CCOc1ccccc1F 34a_100000210171_100000748600 [0,2,0,0,0,0|1,0,1]=4 15898 B12R1.267 CC#CCOc1ccccc1F 7a_100000210171_100000748600 [0,2,0,0,0,0|1,0,1]=4 15899 B12R1.267 CC#CCOc1ccccc1I 34a_100000739446_100000748600 [0,2,0,0,0,0|1,0,1]=4 15900 B12R1.267 CC#CCOc1ccccc1I 7a_100000739446_100000748600 [0,2,0,0,0,0|1,0,1]=4 15901 B12R1.267 CC#CCOc1ccccc1N 34a_100000185747_100000748600 [0,2,0,0,0,0|1,0,1]=4 15902 B12R1.267 CC#CCOc1ccccc1N 7a_100000185747_100000748600 [0,2,0,0,0,0|1,0,1]=4 15903 B12R1.267 CC#CCSc1ccccc1Br 62a_100000695589_100000748600 [0,2,0,0,0,0|1,0,1]=4 15904 B12R1.267 CC#CCSc1ccccc1Br 62a_100000748600_100000695589 [0,2,0,0,0,0|1,0,1]=4 15905 B12R1.267 CC#CCSc1ccccc1C 62a_100000210755_100000748600 [0,2,0,0,0,0|1,0,1]=4 15906 B12R1.267 CC#CCSc1ccccc1C 62a_100000748600_100000210755 [0,2,0,0,0,0|1,0,1]=4 15907 B12R1.267 CC#CCSc1ccccc1Cl 62a_100000748600_100000764095 [0,2,0,0,0,0|1,0,1]=4 15908 B12R1.267 CC#CCSc1ccccc1Cl 62a_100000764095_100000748600 [0,2,0,0,0,0|1,0,1]=4 15909 B12R1.267 CC#CCSc1ccccc1F 62a_100000748600_100011215700 [0,2,0,0,0,0|1,0,1]=4 15910 B12R1.267 CC#CCSc1ccccc1F 62a_100011215700_100000748600 [0,2,0,0,0,0|1,0,1]=4 15911 B12R1.267 CC#CCSc1ccccc1N 62a_100000210017_100000748600 [0,2,0,0,0,0|1,0,1]=4 15912 B12R1.267 CC#CCSc1ccccc1N 62a_100000748600_100000210017 [0,2,0,0,0,0|1,0,1]=4 15913 B12R1.267 CC#CCSc1ccccc1O 62a_100000739446_100000748600 [0,2,0,0,0,0|0,0,1]=3 15914 B12R1.267 CC#CCSc1ccccc1O 62a_100000748600_100000739446 [0,2,0,0,0,0|0,0,1]=3 15915 B12R1.267 CC#CCSc1cccnc1O 62a_100000748600_100000760158 [0,2,0,0,0,0|1,0,1]=4 15916 B12R1.267 CC#CCSc1cccnc1O 62a_100000760158_100000748600 [0,2,0,0,0,0|1,0,1]=4 15917 B12R1.267 CC#CCSc1ccncc1O 62a_100000748600_100009817591 [0,2,0,0,0,0|1,0,1]=4 15918 B12R1.267 CC#CCSc1ccncc1O 62a_100009817591_100000748600 [0,2,0,0,0,0|1,0,1]=4 15919 B12R1.267 CC#CCSc1ncccc1O 62a_100000034122_100000748600 [0,2,0,0,0,0|1,0,1]=4 15920 B12R1.267 CC#CCSc1ncccc1O 62a_100000748600_100000034122 [0,2,0,0,0,0|1,0,1]=4 15921 B12R1.267 CC=CCNc1ccccc1Br 34a_100000210017_100000070051 [0,2,0,0,0,0|1,0,1]=4 15922 B12R1.267 CC=CCNc1ccccc1C 34a_100015192222_100000070051 [0,2,0,0,0,0|1,0,1]=4 15923 B12R1.267 CC=CCNc1ccccc1Cl 34a_100000185783_100000070051 [0,2,0,0,0,0|1,0,1]=4 15924 B12R1.267 CC=CCNc1ccccc1F 34a_100000210422_100000070051 [0,2,0,0,0,0|1,0,1]=4 15925 B12R1.267 CC=CCNc1ccccc1I 34a_100000210053_100000070051 [0,2,0,0,0,0|1,0,1]=4 15926 B12R1.267 CC=CCNc1ccccc1O 34a_100000185747_100000070051 [0,2,0,0,0,0|0,0,1]=3 15927 B12R1.267 CC=CCOc1ccccc1Br 34a_100000181306_100000070051 [0,2,0,0,0,0|1,0,1]=4 15928 B12R1.267 CC=CCOc1ccccc1Br 7a_100000181306_100000070051 [0,2,0,0,0,0|1,0,1]=4 15929 B12R1.267 CC=CCOc1ccccc1C 34a_100000210338_100000070051 [0,2,0,0,0,0|1,0,1]=4 15930 B12R1.267 CC=CCOc1ccccc1C 7a_100000210338_100000070051 [0,2,0,0,0,0|1,0,1]=4 15931 B12R1.267 CC=CCOc1ccccc1Cl 34a_100000210172_100000070051 [0,2,0,0,0,0|1,0,1]=4 15932 B12R1.267 CC=CCOc1ccccc1Cl 7a_100000210172_100000070051 [0,2,0,0,0,0|1,0,1]=4 15933 B12R1.267 CC=CCOc1ccccc1F 34a_100000210171_100000070051 [0,2,0,0,0,0|1,0,1]=4 15934 B12R1.267 CC=CCOc1ccccc1F 7a_100000210171_100000070051 [0,2,0,0,0,0|1,0,1]=4 15935 B12R1.267 CC=CCOc1ccccc1I 34a_100000739446_100000070051 [0,2,0,0,0,0|1,0,1]=4 15936 B12R1.267 CC=CCOc1ccccc1I 7a_100000739446_100000070051 [0,2,0,0,0,0|1,0,1]=4 15937 B12R1.267 CC=CCOc1ccccc1N 34a_100000185747_100000070051 [0,2,0,0,0,0|1,0,1]=4 15938 B12R1.267 CC=CCOc1ccccc1N 7a_100000185747_100000070051 [0,2,0,0,0,0|1,0,1]=4 15939 B12R1.267 CC=CCSc1ccccc1Br 62a_100000070051_100000695589 [0,2,0,0,0,0|1,0,1]=4 15940 B12R1.267 CC=CCSc1ccccc1Br 62a_100000695589_100000070051 [0,2,0,0,0,0|1,0,1]=4 15941 B12R1.267 CC=CCSc1ccccc1C 62a_100000070051_100000210755 [0,2,0,0,0,0|1,0,1]=4 15942 B12R1.267 CC=CCSc1ccccc1C 62a_100000210755_100000070051 [0,2,0,0,0,0|1,0,1]=4 15943 B12R1.267 CC=CCSc1ccccc1Cl 62a_100000070051_100000764095 [0,2,0,0,0,0|1,0,1]=4 15944 B12R1.267 CC=CCSc1ccccc1Cl 62a_100000764095_100000070051 [0,2,0,0,0,0|1,0,1]=4 15945 B12R1.267 CC=CCSc1ccccc1F 62a_100000070051_100011215700 [0,2,0,0,0,0|1,0,1]=4 15946 B12R1.267 CC=CCSc1ccccc1F 62a_100011215700_100000070051 [0,2,0,0,0,0|1,0,1]=4 15947 B12R1.267 CC=CCSc1ccccc1N 62a_100000070051_100000210017 [0,2,0,0,0,0|1,0,1]=4 15948 B12R1.267 CC=CCSc1ccccc1N 62a_100000210017_100000070051 [0,2,0,0,0,0|1,0,1]=4 15949 B12R1.267 CC=CCSc1ccccc1O 62a_100000070051_100000739446 [0,2,0,0,0,0|0,0,1]=3 15950 B12R1.267 CC=CCSc1ccccc1O 62a_100000739446_100000070051 [0,2,0,0,0,0|0,0,1]=3 15951 B12R1.267 CC=CCSc1cccnc1O 62a_100000070051_100000760158 [0,2,0,0,0,0|1,0,1]=4 15952 B12R1.267 CC=CCSc1cccnc1O 62a_100000760158_100000070051 [0,2,0,0,0,0|1,0,1]=4 15953 B12R1.267 CC=CCSc1ccncc1O 62a_100000070051_100009817591 [0,2,0,0,0,0|1,0,1]=4 15954 B12R1.267 CC=CCSc1ccncc1O 62a_100009817591_100000070051 [0,2,0,0,0,0|1,0,1]=4 15955 B12R1.267 CC=CCSc1ncccc1O 62a_100000034122_100000070051 [0,2,0,0,0,0|1,0,1]=4 15956 B12R1.267 CC=CCSc1ncccc1O 62a_100000070051_100000034122 [0,2,0,0,0,0|1,0,1]=4 15957 B12R1.267 CC=NNCc1ccccc1Br 4a_200016993956_200000210099 [0,2,0,0,0,0|1,0,1]=4 15958 B12R1.267 CC=NNCc1ccccc1C 4a_100000737298_200000210099 [0,2,0,0,0,0|1,0,1]=4 15959 B12R1.267 CC=NNCc1ccccc1Cl 4a_100015187261_200000210099 [0,2,0,0,0,0|1,0,1]=4 15960 B12R1.267 CC=NNCc1ccccc1F 4a_100015200773_200000210099 [0,2,0,0,0,0|1,0,1]=4 15961 B12R1.267 CCC=NNc1ccccc1Br 4a_100000241748_100000210100 [0,2,0,0,0,0|1,0,1]=4 15962 B12R1.267 CCC=NNc1ccccc1C 4a_100000184220_100000210100 [0,2,0,0,0,0|1,0,1]=4 15963 B12R1.267 CCC=NNc1ccccc1Cl 4a_100000683529_100000210100 [0,2,0,0,0,0|1,0,1]=4 15964 B12R1.267 CCC=NNc1ccccc1F 4a_100000239246_100000210100 [0,2,0,0,0,0|1,0,1]=4 15965 B12R1.267 CCC=NNc1ccccc1I 4a_100011218156_100000210100 [0,2,0,0,0,0|1,0,1]=4 15966 B12R1.267 CCCC=Cc1c[nH]ccc1=O 271570a_100016258520_100009998708 [0,2,0,0,0,0|1,0,1]=4 15967 B12R1.267 CCCC=Cc1c[nH]ccc1=S 271570a_100016258520_200012280681 [0,2,0,0,0,0|1,1,0]=4 15968 B12R1.267 CCCC=Cc1ccc[nH]c1=O 271570a_100016258520_100000050042 [0,2,0,0,0,0|1,0,1]=4 15969 B12R1.267 CCCC=Cc1cccc[n+]1C 271570a_100016258520_100000212160 [0,2,0,0,0,0|2,0,0]=4 15970 B12R1.267 CCCC=Cc1cccc[n+]1[O-] 271570a_100016258520_200000042595 [0,2,0,0,0,0|1,0,1]=4 15971 B12R1.267 CCCC=Cc1ccccc1Br 271570a_100016258520_100000695589 [0,2,0,0,0,0|1,0,0]=3 15972 B12R1.267 CCCC=Cc1ccccc1C 271570a_100016258520_100000210755 [0,2,0,0,0,0|1,0,0]=3 15973 B12R1.267 CCCC=Cc1ccccc1Cl 271570a_100016258520_100000764095 [0,2,0,0,0,0|1,0,0]=3 15974 B12R1.267 CCCC=Cc1ccccc1F 271570a_100016258520_100011215700 [0,2,0,0,0,0|1,0,0]=3 15975 B12R1.267 CCCC=Cc1ccccc1N 271570a_100016258520_100000210017 [0,2,0,0,0,0|1,0,0]=3 15976 B12R1.267 CCCC=Cc1ccccc1O 271570a_100016258520_100000739446 [0,2,0,0,0,0|0,0,0]=2 15977 B12R1.267 CCCC=Cc1cccnc1Br 271570a_100016258520_100010202626 [0,2,0,0,0,0|2,0,0]=4 15978 B12R1.267 CCCC=Cc1cccnc1C 271570a_100016258520_100000751574 [0,2,0,0,0,0|2,0,0]=4 15979 B12R1.267 CCCC=Cc1cccnc1Cl 271570a_100016258520_100000036424 [0,2,0,0,0,0|2,0,0]=4 15980 B12R1.267 CCCC=Cc1cccnc1F 271570a_100016258520_100009816115 [0,2,0,0,0,0|2,0,0]=4 15981 B12R1.267 CCCC=Cc1cccnc1N 271570a_100016258520_100000045569 [0,2,0,0,0,0|2,0,0]=4 15982 B12R1.267 CCCC=Cc1ccncc1Br 271570a_100016258520_100000726257 [0,2,0,0,0,0|2,0,0]=4 15983 B12R1.267 CCCC=Cc1ccncc1C 271570a_100016258520_100015191297 [0,2,0,0,0,0|2,0,0]=4 15984 B12R1.267 CCCC=Cc1ccncc1Cl 271570a_100016258520_100000708259 [0,2,0,0,0,0|2,0,0]=4 15985 B12R1.267 CCCC=Cc1ccncc1F 271570a_100016258520_100000047030 [0,2,0,0,0,0|2,0,0]=4 15986 B12R1.267 CCCC=Cc1ccncc1N 271570a_100016258520_100009815883 [0,2,0,0,0,0|2,0,0]=4 15987 B12R1.267 CCCC=Cc1ccncc1O 271570a_100016258520_100009817591 [0,2,0,0,0,0|1,0,0]=3 15988 B12R1.267 CCCC=Cc1cnccc1Br 271570a_100016258520_100010138639 [0,2,0,0,0,0|2,0,0]=4 15989 B12R1.267 CCCC=Cc1cnccc1C 271570a_100016258520_100000761580 [0,2,0,0,0,0|2,0,0]=4 15990 B12R1.267 CCCC=Cc1cnccc1Cl 271570a_100016258520_100009995489 [0,2,0,0,0,0|2,0,0]=4 15991 B12R1.267 CCCC=Cc1cnccc1F 271570a_100016258520_100009820683 [0,2,0,0,0,0|2,0,0]=4 15992 B12R1.267 CCCC=Cc1cnccc1N 271570a_100016258520_100000047001 [0,2,0,0,0,0|2,0,0]=4 15993 B12R1.267 CCCC=Cc1cncnc1O 271570a_100016258520_100000751107 [0,2,0,0,0,0|2,0,0]=4 15994 B12R1.267 CCCC=Cc1ncccc1Br 271570a_100016258520_100000696092 [0,2,0,0,0,0|2,0,0]=4 15995 B12R1.267 CCCC=Cc1ncccc1C 271570a_100016258520_100000751373 [0,2,0,0,0,0|2,0,0]=4 15996 B12R1.267 CCCC=Cc1ncccc1Cl 271570a_100016258520_100011356963 [0,2,0,0,0,0|2,0,0]=4 15997 B12R1.267 CCCC=Cc1ncccc1F 271570a_100016258520_100000685392 [0,2,0,0,0,0|2,0,0]=4 15998 B12R1.267 CCCC=Cc1ncccc1N 271570a_100016258520_100000688686 [0,2,0,0,0,0|2,0,0]=4 15999 B12R1.267 CCCC=Cc1ncccc1O 271570a_100016258520_100000034122 [0,2,0,0,0,0|1,0,0]=3 16000 B12R1.267 CCCCCc1ncncc1O 271570a_203496583355_100009816991 [0,2,0,0,0,0|2,0,0]=4 16001 B12R1.267 CCCCNc1ccccc1Br 34a_100000210017_100000210210 [0,2,0,0,0,0|1,0,0]=3 16002 B12R1.267 CCCCNc1ccccc1C 34a_100015192222_100000210210 [0,2,0,0,0,0|1,0,0]=3 16003 B12R1.267 CCCCNc1ccccc1Cl 34a_100000185783_100000210210 [0,2,0,0,0,0|1,0,0]=3 16004 B12R1.267 CCCCNc1ccccc1F 34a_100000210422_100000210210 [0,2,0,0,0,0|1,0,0]=3 16005 B12R1.267 CCCCNc1ccccc1I 34a_100000210053_100000210210 [0,2,0,0,0,0|1,0,0]=3 16006 B12R1.267 CCCCNc1ccccc1O 34a_100000185747_100000210210 [0,2,0,0,0,0|0,0,0]=2 16007 B12R1.267 CCCCNc1ccncc1Br 27a_100000102301_100000726257 [0,2,0,0,0,0|2,0,0]=4 16008 B12R1.267 CCCCNc1ccncc1C 27a_100000102301_100000765111 [0,2,0,0,0,0|2,0,0]=4 16009 B12R1.267 CCCCNc1ccncc1F 27a_100000102301_100000035921 [0,2,0,0,0,0|2,0,0]=4 16010 B12R1.267 CCCCNc1ncccc1Br 27a_100000102301_100000696092 [0,2,0,0,0,0|2,0,0]=4 16011 B12R1.267 CCCCOc1cccc[n+]1[O-] 7a_100000211761_100000210211 [0,2,0,0,0,0|1,0,1]=4 16012 B12R1.267 CCCCOc1ccccc1Br 34a_100000181306_100000210210 [0,2,0,0,0,0|1,0,0]=3 16013 B12R1.267 CCCCOc1ccccc1Br 7a_100000181306_100000210211 [0,2,0,0,0,0|1,0,0]=3 16014 B12R1.267 CCCCOc1ccccc1C 34a_100000210338_100000210210 [0,2,0,0,0,0|1,0,0]=3 16015 B12R1.267 CCCCOc1ccccc1C 7a_100000210338_100000210211 [0,2,0,0,0,0|1,0,0]=3 16016 B12R1.267 CCCCOc1ccccc1Cl 34a_100000210172_100000210210 [0,2,0,0,0,0|1,0,0]=3 16017 B12R1.267 CCCCOc1ccccc1Cl 7a_100000210172_100000210211 [0,2,0,0,0,0|1,0,0]=3 16018 B12R1.267 CCCCOc1ccccc1F 34a_100000210171_100000210210 [0,2,0,0,0,0|1,0,0]=3 16019 B12R1.267 CCCCOc1ccccc1F 7a_100000210171_100000210211 [0,2,0,0,0,0|1,0,0]=3 16020 B12R1.267 CCCCOc1ccccc1I 34a_100000739446_100000210210 [0,2,0,0,0,0|1,0,0]=3 16021 B12R1.267 CCCCOc1ccccc1I 7a_100000739446_100000210211 [0,2,0,0,0,0|1,0,0]=3 16022 B12R1.267 CCCCOc1ccccc1N 34a_100000185747_100000210210 [0,2,0,0,0,0|1,0,0]=3 16023 B12R1.267 CCCCOc1ccccc1N 7a_100000185747_100000210211 [0,2,0,0,0,0|1,0,0]=3 16024 B12R1.267 CCCCOc1ccccc1O 271570a_203496583355_100000230755 [0,2,0,0,0,0|0,0,0]=2 16025 B12R1.267 CCCCOc1cccnc1Br 34a_100000744436_100000210210 [0,2,0,0,0,0|2,0,0]=4 16026 B12R1.267 CCCCOc1cccnc1Br 7a_100000744436_100000210211 [0,2,0,0,0,0|2,0,0]=4 16027 B12R1.267 CCCCOc1cccnc1C 34a_100000745507_100000210210 [0,2,0,0,0,0|2,0,0]=4 16028 B12R1.267 CCCCOc1cccnc1C 7a_100000745507_100000210211 [0,2,0,0,0,0|2,0,0]=4 16029 B12R1.267 CCCCOc1cccnc1Cl 34a_100000757616_100000210210 [0,2,0,0,0,0|2,0,0]=4 16030 B12R1.267 CCCCOc1cccnc1Cl 7a_100000757616_100000210211 [0,2,0,0,0,0|2,0,0]=4 16031 B12R1.267 CCCCOc1cccnc1F 34a_100000061740_100000210210 [0,2,0,0,0,0|2,0,0]=4 16032 B12R1.267 CCCCOc1cccnc1F 7a_100000061740_100000210211 [0,2,0,0,0,0|2,0,0]=4 16033 B12R1.267 CCCCOc1cccnc1I 34a_100000034122_100000210210 [0,2,0,0,0,0|2,0,0]=4 16034 B12R1.267 CCCCOc1cccnc1I 7a_100000034122_100000210211 [0,2,0,0,0,0|2,0,0]=4 16035 B12R1.267 CCCCOc1cccnc1N 34a_100000211975_100000210210 [0,2,0,0,0,0|2,0,0]=4 16036 B12R1.267 CCCCOc1cccnc1N 7a_100000211975_100000210211 [0,2,0,0,0,0|2,0,0]=4 16037 B12R1.267 CCCCOc1cccoc1=O 34a_100000077404_100000210210 [0,2,0,0,0,0|1,0,1]=4 16038 B12R1.267 CCCCOc1cccoc1=O 7a_100000077404_100000210211 [0,2,0,0,0,0|1,0,1]=4 16039 B12R1.267 CCCCOc1ccncc1Br 34a_100011996408_100000210210 [0,2,0,0,0,0|2,0,0]=4 16040 B12R1.267 CCCCOc1ccncc1C 34a_100000694293_100000210210 [0,2,0,0,0,0|2,0,0]=4 16041 B12R1.267 CCCCOc1ccncc1Cl 34a_100011997054_100000210210 [0,2,0,0,0,0|2,0,0]=4 16042 B12R1.267 CCCCOc1ccncc1F 34a_200000081243_100000210210 [0,2,0,0,0,0|2,0,0]=4 16043 B12R1.267 CCCCOc1cnccc1C 34a_100011997053_100000210210 [0,2,0,0,0,0|2,0,0]=4 16044 B12R1.267 CCCCOc1cnccc1C 7a_100011997053_100000210211 [0,2,0,0,0,0|2,0,0]=4 16045 B12R1.267 CCCCOc1cnccc1Cl 34a_100011996695_100000210210 [0,2,0,0,0,0|2,0,0]=4 16046 B12R1.267 CCCCOc1cnccc1I 34a_100000050107_100000210210 [0,2,0,0,0,0|2,0,0]=4 16047 B12R1.267 CCCCOc1cnccc1N 34a_100000753702_100000210210 [0,2,0,0,0,0|2,0,0]=4 16048 B12R1.267 CCCCOc1coccc1=O 34a_100000060831_100000210210 [0,2,0,0,0,0|1,0,1]=4 16049 B12R1.267 CCCCOc1ncccc1Cl 34a_100011290957_100000210210 [0,2,0,0,0,0|2,0,0]=4 16050 B12R1.267 CCCCOc1ncccc1F 34a_100011219419_100000210210 [0,2,0,0,0,0|2,0,0]=4 16051 B12R1.267 CCCCOc1ncccc1N 34a_100000746358_100000210210 [0,2,0,0,0,0|2,0,0]=4 16052 B12R1.267 CCCCSc1c[nH]ccc1=O 62a_100000210211_100009998708 [0,2,0,0,0,0|1,0,1]=4 16053 B12R1.267 CCCCSc1c[nH]ccc1=O 62a_100009998708_100000210210 [0,2,0,0,0,0|1,0,1]=4 16054 B12R1.267 CCCCSc1c[nH]ccc1=S 62a_100000210211_200012280681 [0,2,0,0,0,0|1,1,0]=4 16055 B12R1.267 CCCCSc1c[nH]ccc1=S 62a_200012280681_100000210210 [0,2,0,0,0,0|1,1,0]=4 16056 B12R1.267 CCCCSc1cccc[n+]1C 62a_100000210211_100000212160 [0,2,0,0,0,0|2,0,0]=4 16057 B12R1.267 CCCCSc1cccc[n+]1[O-] 62a_100000210211_200000042595 [0,2,0,0,0,0|1,0,1]=4 16058 B12R1.267 CCCCSc1ccccc1Br 62a_100000210211_100000695589 [0,2,0,0,0,0|1,0,0]=3 16059 B12R1.267 CCCCSc1ccccc1Br 62a_100000695589_100000210210 [0,2,0,0,0,0|1,0,0]=3 16060 B12R1.267 CCCCSc1ccccc1C 62a_100000210211_100000210755 [0,2,0,0,0,0|1,0,0]=3 16061 B12R1.267 CCCCSc1ccccc1C 62a_100000210755_100000210210 [0,2,0,0,0,0|1,0,0]=3 16062 B12R1.267 CCCCSc1ccccc1Cl 62a_100000210211_100000764095 [0,2,0,0,0,0|1,0,0]=3 16063 B12R1.267 CCCCSc1ccccc1Cl 62a_100000764095_100000210210 [0,2,0,0,0,0|1,0,0]=3 16064 B12R1.267 CCCCSc1ccccc1F 62a_100000210211_100011215700 [0,2,0,0,0,0|1,0,0]=3 16065 B12R1.267 CCCCSc1ccccc1F 62a_100011215700_100000210210 [0,2,0,0,0,0|1,0,0]=3 16066 B12R1.267 CCCCSc1ccccc1N 62a_100000210017_100000210210 [0,2,0,0,0,0|1,0,0]=3 16067 B12R1.267 CCCCSc1ccccc1N 62a_100000210211_100000210017 [0,2,0,0,0,0|1,0,0]=3 16068 B12R1.267 CCCCSc1ccccc1O 62a_100000210211_100000739446 [0,2,0,0,0,0|0,0,0]=2 16069 B12R1.267 CCCCSc1ccccc1O 62a_100000739446_100000210210 [0,2,0,0,0,0|0,0,0]=2 16070 B12R1.267 CCCCSc1cccnc1Br 62a_100000210211_100010202626 [0,2,0,0,0,0|2,0,0]=4 16071 B12R1.267 CCCCSc1cccnc1Br 62a_100010202626_100000210210 [0,2,0,0,0,0|2,0,0]=4 16072 B12R1.267 CCCCSc1cccnc1C 62a_100000210211_100000751574 [0,2,0,0,0,0|2,0,0]=4 16073 B12R1.267 CCCCSc1cccnc1C 62a_100000751574_100000210210 [0,2,0,0,0,0|2,0,0]=4 16074 B12R1.267 CCCCSc1cccnc1Cl 62a_100000036424_100000210210 [0,2,0,0,0,0|2,0,0]=4 16075 B12R1.267 CCCCSc1cccnc1Cl 62a_100000210211_100000036424 [0,2,0,0,0,0|2,0,0]=4 16076 B12R1.267 CCCCSc1cccnc1F 62a_100000210211_100009816115 [0,2,0,0,0,0|2,0,0]=4 16077 B12R1.267 CCCCSc1cccnc1F 62a_100009816115_100000210210 [0,2,0,0,0,0|2,0,0]=4 16078 B12R1.267 CCCCSc1cccnc1N 62a_100000045569_100000210210 [0,2,0,0,0,0|2,0,0]=4 16079 B12R1.267 CCCCSc1cccnc1N 62a_100000210211_100000045569 [0,2,0,0,0,0|2,0,0]=4 16080 B12R1.267 CCCCSc1cccnc1O 62a_100000210211_100000760158 [0,2,0,0,0,0|1,0,0]=3 16081 B12R1.267 CCCCSc1cccnc1O 62a_100000760158_100000210210 [0,2,0,0,0,0|1,0,0]=3 16082 B12R1.267 CCCCSc1ccncc1Br 62a_100000210211_100000726257 [0,2,0,0,0,0|2,0,0]=4 16083 B12R1.267 CCCCSc1ccncc1Br 62a_100000726257_100000210210 [0,2,0,0,0,0|2,0,0]=4 16084 B12R1.267 CCCCSc1ccncc1C 62a_100000210211_100000765111 [0,2,0,0,0,0|2,0,0]=4 16085 B12R1.267 CCCCSc1ccncc1C 62a_100000765111_100000210210 [0,2,0,0,0,0|2,0,0]=4 16086 B12R1.267 CCCCSc1ccncc1Cl 62a_100000210211_100000708259 [0,2,0,0,0,0|2,0,0]=4 16087 B12R1.267 CCCCSc1ccncc1Cl 62a_100000708259_100000210210 [0,2,0,0,0,0|2,0,0]=4 16088 B12R1.267 CCCCSc1ccncc1F 62a_100000047030_100000210210 [0,2,0,0,0,0|2,0,0]=4 16089 B12R1.267 CCCCSc1ccncc1F 62a_100000210211_100000047030 [0,2,0,0,0,0|2,0,0]=4 16090 B12R1.267 CCCCSc1ccncc1N 62a_100000210211_100000756074 [0,2,0,0,0,0|2,0,0]=4 16091 B12R1.267 CCCCSc1ccncc1N 62a_100000756074_100000210210 [0,2,0,0,0,0|2,0,0]=4 16092 B12R1.267 CCCCSc1ccncc1O 62a_100000210211_100009817591 [0,2,0,0,0,0|1,0,0]=3 16093 B12R1.267 CCCCSc1ccncc1O 62a_100009817591_100000210210 [0,2,0,0,0,0|1,0,0]=3 16094 B12R1.267 CCCCSc1cnccc1Br 62a_100000210211_100010138639 [0,2,0,0,0,0|2,0,0]=4 16095 B12R1.267 CCCCSc1cnccc1Br 62a_100010138639_100000210210 [0,2,0,0,0,0|2,0,0]=4 16096 B12R1.267 CCCCSc1cnccc1C 62a_100000210211_100000761580 [0,2,0,0,0,0|2,0,0]=4 16097 B12R1.267 CCCCSc1cnccc1C 62a_100000761580_100000210210 [0,2,0,0,0,0|2,0,0]=4 16098 B12R1.267 CCCCSc1cnccc1Cl 62a_100000210211_100009995489 [0,2,0,0,0,0|2,0,0]=4 16099 B12R1.267 CCCCSc1cnccc1Cl 62a_100009995489_100000210210 [0,2,0,0,0,0|2,0,0]=4 16100 B12R1.267 CCCCSc1cnccc1F 62a_100000210211_100009820683 [0,2,0,0,0,0|2,0,0]=4 16101 B12R1.267 CCCCSc1cnccc1F 62a_100009820683_100000210210 [0,2,0,0,0,0|2,0,0]=4 16102 B12R1.267 CCCCSc1cnccc1N 62a_100000047001_100000210210 [0,2,0,0,0,0|2,0,0]=4 16103 B12R1.267 CCCCSc1cnccc1N 62a_100000210211_100000047001 [0,2,0,0,0,0|2,0,0]=4 16104 B12R1.267 CCCCSc1cncnc1O 62a_100000210211_100000751107 [0,2,0,0,0,0|2,0,0]=4 16105 B12R1.267 CCCCSc1cncnc1O 62a_100000751107_100000210210 [0,2,0,0,0,0|2,0,0]=4 16106 B12R1.267 CCCCSc1ncccc1Br 62a_100000210211_100000696092 [0,2,0,0,0,0|2,0,0]=4 16107 B12R1.267 CCCCSc1ncccc1Br 62a_100000696092_100000210210 [0,2,0,0,0,0|2,0,0]=4 16108 B12R1.267 CCCCSc1ncccc1C 62a_100000210211_100000751373 [0,2,0,0,0,0|2,0,0]=4 16109 B12R1.267 CCCCSc1ncccc1C 62a_100000751373_100000210210 [0,2,0,0,0,0|2,0,0]=4 16110 B12R1.267 CCCCSc1ncccc1Cl 62a_100000210211_100011356963 [0,2,0,0,0,0|2,0,0]=4 16111 B12R1.267 CCCCSc1ncccc1Cl 62a_100011356963_100000210210 [0,2,0,0,0,0|2,0,0]=4 16112 B12R1.267 CCCCSc1ncccc1F 62a_100000210211_100000685392 [0,2,0,0,0,0|2,0,0]=4 16113 B12R1.267 CCCCSc1ncccc1F 62a_100000685392_100000210210 [0,2,0,0,0,0|2,0,0]=4 16114 B12R1.267 CCCCSc1ncccc1N 62a_100000210211_100000688686 [0,2,0,0,0,0|2,0,0]=4 16115 B12R1.267 CCCCSc1ncccc1N 62a_100000688686_100000210210 [0,2,0,0,0,0|2,0,0]=4 16116 B12R1.267 CCCCSc1ncccc1O 62a_100000034122_100000210210 [0,2,0,0,0,0|1,0,0]=3 16117 B12R1.267 CCCCSc1ncccc1O 62a_100000210211_100000034122 [0,2,0,0,0,0|1,0,0]=3 16118 B12R1.267 CCCNCc1ccccc1Br 207a_100020643023_100000211189 [0,2,0,0,0,0|1,0,0]=3 16119 B12R1.267 CCCNCc1ccccc1Br 2230a_100000689332_100000210303 [0,2,0,0,0,0|1,0,0]=3 16120 B12R1.267 CCCNCc1ccccc1Br 270004a_100020643023_100000211189 [0,2,0,0,0,0|1,0,0]=3 16121 B12R1.267 CCCNCc1ccccc1Br 34a_100000689332_100000210303 [0,2,0,0,0,0|1,0,0]=3 16122 B12R1.267 CCCNCc1ccccc1C 207a_100020643023_100000211143 [0,2,0,0,0,0|1,0,0]=3 16123 B12R1.267 CCCNCc1ccccc1C 270004a_100020643023_100000211143 [0,2,0,0,0,0|1,0,0]=3 16124 B12R1.267 CCCNCc1ccccc1C 34a_100000174972_100000210303 [0,2,0,0,0,0|1,0,0]=3 16125 B12R1.267 CCCNCc1ccccc1Cl 207a_100020643023_100000210073 [0,2,0,0,0,0|1,0,0]=3 16126 B12R1.267 CCCNCc1ccccc1Cl 2230a_100000174879_100000210303 [0,2,0,0,0,0|1,0,0]=3 16127 B12R1.267 CCCNCc1ccccc1Cl 270004a_100020643023_100000210073 [0,2,0,0,0,0|1,0,0]=3 16128 B12R1.267 CCCNCc1ccccc1Cl 34a_100000174879_100000210303 [0,2,0,0,0,0|1,0,0]=3 16129 B12R1.267 CCCNCc1ccccc1F 207a_100020643023_100000210811 [0,2,0,0,0,0|1,0,0]=3 16130 B12R1.267 CCCNCc1ccccc1F 270004a_100020643023_100000210811 [0,2,0,0,0,0|1,0,0]=3 16131 B12R1.267 CCCNCc1ccccc1F 34a_100000174869_100000210303 [0,2,0,0,0,0|1,0,0]=3 16132 B12R1.267 CCCNCc1ccccc1I 207a_100020643023_100000010305 [0,2,0,0,0,0|1,0,0]=3 16133 B12R1.267 CCCNCc1ccccc1I 270004a_100020643023_100000010305 [0,2,0,0,0,0|1,0,0]=3 16134 B12R1.267 CCCNCc1ccccc1O 271570a_203496583355_100000196483 [0,2,0,0,0,0|0,0,0]=2 16135 B12R1.267 CCCNCc1ccccc1O 34a_100000185550_100000210303 [0,2,0,0,0,0|0,0,0]=2 16136 B12R1.267 CCCNCc1cccnc1Br 2230a_100009818023_100000210303 [0,2,0,0,0,0|2,0,0]=4 16137 B12R1.267 CCCNCc1cccnc1Br 34a_100009818023_100000210303 [0,2,0,0,0,0|2,0,0]=4 16138 B12R1.267 CCCNCc1cccnc1C 207a_100020643023_100000751968 [0,2,0,0,0,0|2,0,0]=4 16139 B12R1.267 CCCNCc1cccnc1C 270004a_100020643023_100000751968 [0,2,0,0,0,0|2,0,0]=4 16140 B12R1.267 CCCNCc1cccnc1Cl 2230a_100015189234_100000210303 [0,2,0,0,0,0|2,0,0]=4 16141 B12R1.267 CCCNCc1cccnc1Cl 34a_100015189234_100000210303 [0,2,0,0,0,0|2,0,0]=4 16142 B12R1.267 CCCNCc1cccnc1F 34a_100000724633_100000210303 [0,2,0,0,0,0|2,0,0]=4 16143 B12R1.267 CCCNCc1cccnc1O 207a_100020643023_100011998315 [0,2,0,0,0,0|1,0,0]=3 16144 B12R1.267 CCCNCc1cccnc1O 270004a_100020643023_100011998315 [0,2,0,0,0,0|1,0,0]=3 16145 B12R1.267 CCCNCc1ccncc1Br 270004a_100020643023_100000755692 [0,2,0,0,0,0|2,0,0]=4 16146 B12R1.267 CCCNCc1ccncc1Cl 207a_100020643023_100011934409 [0,2,0,0,0,0|2,0,0]=4 16147 B12R1.267 CCCNCc1ccncc1Cl 270004a_100020643023_100011934409 [0,2,0,0,0,0|2,0,0]=4 16148 B12R1.267 CCCNCc1ccncc1F 34a_100011935246_100000210303 [0,2,0,0,0,0|2,0,0]=4 16149 B12R1.267 CCCNCc1cnccc1Br 270004a_100020643023_100009816821 [0,2,0,0,0,0|2,0,0]=4 16150 B12R1.267 CCCNCc1cnccc1C 207a_100020643023_100000685662 [0,2,0,0,0,0|2,0,0]=4 16151 B12R1.267 CCCNCc1cnccc1C 270004a_100020643023_100000685662 [0,2,0,0,0,0|2,0,0]=4 16152 B12R1.267 CCCNCc1cnccc1Cl 270004a_100020643023_100000050567 [0,2,0,0,0,0|2,0,0]=4 16153 B12R1.267 CCCNCc1ncccc1Br 207a_100020643023_100011934733 [0,2,0,0,0,0|2,0,0]=4 16154 B12R1.267 CCCNCc1ncccc1Br 270004a_100020643023_100011934733 [0,2,0,0,0,0|2,0,0]=4 16155 B12R1.267 CCCNCc1ncccc1C 207a_100020643023_100000698913 [0,2,0,0,0,0|2,0,0]=4 16156 B12R1.267 CCCNCc1ncccc1C 270004a_100020643023_100000698913 [0,2,0,0,0,0|2,0,0]=4 16157 B12R1.267 CCCNCc1ncccc1C 34a_100011223789_100000210303 [0,2,0,0,0,0|2,0,0]=4 16158 B12R1.267 CCCNCc1ncccc1Cl 207a_100020643023_100012001307 [0,2,0,0,0,0|2,0,0]=4 16159 B12R1.267 CCCNCc1ncccc1Cl 2230a_100015189233_100000210303 [0,2,0,0,0,0|2,0,0]=4 16160 B12R1.267 CCCNCc1ncccc1Cl 270004a_100020643023_100012001307 [0,2,0,0,0,0|2,0,0]=4 16161 B12R1.267 CCCNCc1ncccc1F 207a_100020643023_100011934734 [0,2,0,0,0,0|2,0,0]=4 16162 B12R1.267 CCCNCc1ncccc1F 270004a_100020643023_100011934734 [0,2,0,0,0,0|2,0,0]=4 16163 B12R1.267 CCCNCc1ncccc1F 34a_100000690088_100000210303 [0,2,0,0,0,0|2,0,0]=4 16164 B12R1.267 CCCOCc1ccccc1Br 34a_100000210258_100000184730 [0,2,0,0,0,0|1,0,0]=3 16165 B12R1.267 CCCOCc1ccccc1Br 34a_100000756307_100000210303 [0,2,0,0,0,0|1,0,0]=3 16166 B12R1.267 CCCOCc1ccccc1Br 7a_100000756307_100000210303 [0,2,0,0,0,0|1,0,0]=3 16167 B12R1.267 CCCOCc1ccccc1C 34a_100000210258_100000211839 [0,2,0,0,0,0|1,0,0]=3 16168 B12R1.267 CCCOCc1ccccc1C 34a_100000698903_100000210303 [0,2,0,0,0,0|1,0,0]=3 16169 B12R1.267 CCCOCc1ccccc1C 7a_100000698903_100000210303 [0,2,0,0,0,0|1,0,0]=3 16170 B12R1.267 CCCOCc1ccccc1Cl 34a_100000210258_100000187162 [0,2,0,0,0,0|1,0,0]=3 16171 B12R1.267 CCCOCc1ccccc1Cl 34a_100000210847_100000210303 [0,2,0,0,0,0|1,0,0]=3 16172 B12R1.267 CCCOCc1ccccc1Cl 7a_100000210847_100000210303 [0,2,0,0,0,0|1,0,0]=3 16173 B12R1.267 CCCOCc1ccccc1F 34a_100000210258_100000211605 [0,2,0,0,0,0|1,0,0]=3 16174 B12R1.267 CCCOCc1ccccc1F 34a_100000211962_100000210303 [0,2,0,0,0,0|1,0,0]=3 16175 B12R1.267 CCCOCc1ccccc1F 7a_100000211962_100000210303 [0,2,0,0,0,0|1,0,0]=3 16176 B12R1.267 CCCOCc1ccccc1I 34a_100000187465_100000210303 [0,2,0,0,0,0|1,0,0]=3 16177 B12R1.267 CCCOCc1ccccc1I 34a_100000210258_100011215278 [0,2,0,0,0,0|1,0,0]=3 16178 B12R1.267 CCCOCc1ccccc1I 7a_100000187465_100000210303 [0,2,0,0,0,0|1,0,0]=3 16179 B12R1.267 CCCOCc1ccccc1N 34a_100000212039_100000210303 [0,2,0,0,0,0|1,0,0]=3 16180 B12R1.267 CCCOCc1cccnc1Br 34a_100000210258_100010140945 [0,2,0,0,0,0|2,0,0]=4 16181 B12R1.267 CCCOCc1cccnc1Br 34a_100000719692_100000210303 [0,2,0,0,0,0|2,0,0]=4 16182 B12R1.267 CCCOCc1cccnc1Br 7a_100000719692_100000210303 [0,2,0,0,0,0|2,0,0]=4 16183 B12R1.267 CCCOCc1cccnc1C 34a_100000210258_100000732876 [0,2,0,0,0,0|2,0,0]=4 16184 B12R1.267 CCCOCc1cccnc1C 34a_100000729262_100000210303 [0,2,0,0,0,0|2,0,0]=4 16185 B12R1.267 CCCOCc1cccnc1C 7a_100000729262_100000210303 [0,2,0,0,0,0|2,0,0]=4 16186 B12R1.267 CCCOCc1cccnc1Cl 34a_100000210258_100000045678 [0,2,0,0,0,0|2,0,0]=4 16187 B12R1.267 CCCOCc1cccnc1Cl 34a_100000748726_100000210303 [0,2,0,0,0,0|2,0,0]=4 16188 B12R1.267 CCCOCc1cccnc1Cl 7a_100000748726_100000210303 [0,2,0,0,0,0|2,0,0]=4 16189 B12R1.267 CCCOCc1cccnc1F 34a_100000079888_100000210303 [0,2,0,0,0,0|2,0,0]=4 16190 B12R1.267 CCCOCc1cccnc1F 34a_100000210258_100000099810 [0,2,0,0,0,0|2,0,0]=4 16191 B12R1.267 CCCOCc1cccnc1F 7a_100000079888_100000210303 [0,2,0,0,0,0|2,0,0]=4 16192 B12R1.267 CCCOCc1ccncc1C 34a_100000210258_100020672809 [0,2,0,0,0,0|2,0,0]=4 16193 B12R1.267 CCCOCc1ccncc1C 34a_100011997032_100000210303 [0,2,0,0,0,0|2,0,0]=4 16194 B12R1.267 CCCOCc1ccncc1F 34a_100012172863_100000210303 [0,2,0,0,0,0|2,0,0]=4 16195 B12R1.267 CCCOCc1cnccc1C 34a_100000210258_100000690890 [0,2,0,0,0,0|2,0,0]=4 16196 B12R1.267 CCCOCc1cnccc1C 34a_100011996381_100000210303 [0,2,0,0,0,0|2,0,0]=4 16197 B12R1.267 CCCOCc1cnccc1Cl 34a_100000117392_100000210303 [0,2,0,0,0,0|2,0,0]=4 16198 B12R1.267 CCCOCc1ncccc1Br 34a_100000210258_100025702911 [0,2,0,0,0,0|2,0,0]=4 16199 B12R1.267 CCCOCc1ncccc1Br 34a_100011996772_100000210303 [0,2,0,0,0,0|2,0,0]=4 16200 B12R1.267 CCCOCc1ncccc1C 34a_100000210258_100000696600 [0,2,0,0,0,0|2,0,0]=4 16201 B12R1.267 CCCOCc1ncccc1C 34a_100000698912_100000210303 [0,2,0,0,0,0|2,0,0]=4 16202 B12R1.267 CCCOCc1ncccc1Cl 34a_100012002383_100000210303 [0,2,0,0,0,0|2,0,0]=4 16203 B12R1.267 CCCOCc1ncccc1F 34a_100000210258_100000104219 [0,2,0,0,0,0|2,0,0]=4 16204 B12R1.267 CCCOCc1ncccc1F 34a_100011934865_100000210303 [0,2,0,0,0,0|2,0,0]=4 16205 B12R1.267 CCCOCc1ncccc1N 34a_114873767017_100000210303 [0,2,0,0,0,0|2,0,0]=4 16206 B12R1.267 CCCOCc1ncccc1O 34a_100000210258_200020655725 [0,2,0,0,0,0|1,0,0]=3 16207 B12R1.267 CCCSCc1ccccc1Br 62a_100000184730_100000210303 [0,2,0,0,0,0|1,0,0]=3 16208 B12R1.267 CCCSCc1ccccc1Br 62a_100000210303_100000184730 [0,2,0,0,0,0|1,0,0]=3 16209 B12R1.267 CCCSCc1ccccc1C 62a_100000210303_100000211839 [0,2,0,0,0,0|1,0,0]=3 16210 B12R1.267 CCCSCc1ccccc1C 62a_100000211839_100000210303 [0,2,0,0,0,0|1,0,0]=3 16211 B12R1.267 CCCSCc1ccccc1Cl 62a_100000187162_100000210303 [0,2,0,0,0,0|1,0,0]=3 16212 B12R1.267 CCCSCc1ccccc1Cl 62a_100000210303_100000187162 [0,2,0,0,0,0|1,0,0]=3 16213 B12R1.267 CCCSCc1ccccc1F 62a_100000210303_100000211605 [0,2,0,0,0,0|1,0,0]=3 16214 B12R1.267 CCCSCc1ccccc1F 62a_100000211605_100000210303 [0,2,0,0,0,0|1,0,0]=3 16215 B12R1.267 CCCSCc1ccccc1I 62a_100000210303_100011216222 [0,2,0,0,0,0|1,0,0]=3 16216 B12R1.267 CCCSCc1ccccc1I 62a_100011216222_100000210303 [0,2,0,0,0,0|1,0,0]=3 16217 B12R1.267 CCCSCc1ccccc1O 271570a_203496583355_200000173363 [0,2,0,0,0,0|0,0,0]=2 16218 B12R1.267 CCCSCc1cccnc1Br 62a_100000210303_100010140945 [0,2,0,0,0,0|2,0,0]=4 16219 B12R1.267 CCCSCc1cccnc1Br 62a_100010140945_100000210303 [0,2,0,0,0,0|2,0,0]=4 16220 B12R1.267 CCCSCc1cccnc1C 62a_100000210303_100000732876 [0,2,0,0,0,0|2,0,0]=4 16221 B12R1.267 CCCSCc1cccnc1C 62a_100000732876_100000210303 [0,2,0,0,0,0|2,0,0]=4 16222 B12R1.267 CCCSCc1cccnc1Cl 62a_100000045678_100000210303 [0,2,0,0,0,0|2,0,0]=4 16223 B12R1.267 CCCSCc1cccnc1Cl 62a_100000210303_100000045678 [0,2,0,0,0,0|2,0,0]=4 16224 B12R1.267 CCCSCc1cccnc1F 62a_100000099810_100000210303 [0,2,0,0,0,0|2,0,0]=4 16225 B12R1.267 CCCSCc1cccnc1F 62a_100000210303_100000099810 [0,2,0,0,0,0|2,0,0]=4 16226 B12R1.267 CCCSCc1ccncc1C 62a_100000210303_100020672808 [0,2,0,0,0,0|2,0,0]=4 16227 B12R1.267 CCCSCc1ccncc1C 62a_100020672808_100000210303 [0,2,0,0,0,0|2,0,0]=4 16228 B12R1.267 CCCSCc1ccncc1Cl 62a_100000210303_100000763264 [0,2,0,0,0,0|2,0,0]=4 16229 B12R1.267 CCCSCc1ccncc1Cl 62a_100000763264_100000210303 [0,2,0,0,0,0|2,0,0]=4 16230 B12R1.267 CCCSCc1cnccc1C 62a_100000210303_100000690890 [0,2,0,0,0,0|2,0,0]=4 16231 B12R1.267 CCCSCc1cnccc1C 62a_100000690890_100000210303 [0,2,0,0,0,0|2,0,0]=4 16232 B12R1.267 CCCSCc1ncccc1Br 62a_100000210303_100025702911 [0,2,0,0,0,0|2,0,0]=4 16233 B12R1.267 CCCSCc1ncccc1Br 62a_100025702911_100000210303 [0,2,0,0,0,0|2,0,0]=4 16234 B12R1.267 CCCSCc1ncccc1C 62a_100000210303_100000696600 [0,2,0,0,0,0|2,0,0]=4 16235 B12R1.267 CCCSCc1ncccc1C 62a_100000696600_100000210303 [0,2,0,0,0,0|2,0,0]=4 16236 B12R1.267 CCCSCc1ncccc1Cl 62a_100000099807_100000210303 [0,2,0,0,0,0|2,0,0]=4 16237 B12R1.267 CCCSCc1ncccc1Cl 62a_100000210303_100000099807 [0,2,0,0,0,0|2,0,0]=4 16238 B12R1.267 CCCSCc1ncccc1F 62a_100000104219_100000210303 [0,2,0,0,0,0|2,0,0]=4 16239 B12R1.267 CCCSCc1ncccc1F 62a_100000210303_100000104219 [0,2,0,0,0,0|2,0,0]=4 16240 B12R1.267 CCCSCc1ncccc1O 62a_100000210303_200020655725 [0,2,0,0,0,0|1,0,0]=3 16241 B12R1.267 CCCSCc1ncccc1O 62a_200020655725_100000210303 [0,2,0,0,0,0|1,0,0]=3 16242 B12R1.267 CCNCCc1ccccc1Br 2230a_100000747383_100000210202 [0,2,0,0,0,0|1,0,0]=3 16243 B12R1.267 CCNCCc1ccccc1Br 2230a_100015525214_100012161201 [0,2,0,0,0,0|1,0,0]=3 16244 B12R1.267 CCNCCc1ccccc1Br 34a_100000747383_100000210202 [0,2,0,0,0,0|1,0,0]=3 16245 B12R1.267 CCNCCc1ccccc1C 2230a_100000685071_100000210202 [0,2,0,0,0,0|1,0,0]=3 16246 B12R1.267 CCNCCc1ccccc1C 2230a_100015525214_100011713688 [0,2,0,0,0,0|1,0,0]=3 16247 B12R1.267 CCNCCc1ccccc1C 34a_100000685071_100000210202 [0,2,0,0,0,0|1,0,0]=3 16248 B12R1.267 CCNCCc1ccccc1Cl 2230a_100011207228_100000210202 [0,2,0,0,0,0|1,0,0]=3 16249 B12R1.267 CCNCCc1ccccc1Cl 2230a_100015525214_100011713703 [0,2,0,0,0,0|1,0,0]=3 16250 B12R1.267 CCNCCc1ccccc1Cl 270004a_100015525214_200011713468 [0,2,0,0,0,0|1,0,0]=3 16251 B12R1.267 CCNCCc1ccccc1Cl 34a_100011207228_100000210202 [0,2,0,0,0,0|1,0,0]=3 16252 B12R1.267 CCNCCc1ccccc1F 2230a_100000185272_100000210202 [0,2,0,0,0,0|1,0,0]=3 16253 B12R1.267 CCNCCc1ccccc1F 2230a_100015525214_100011713696 [0,2,0,0,0,0|1,0,0]=3 16254 B12R1.267 CCNCCc1ccccc1F 34a_100000185272_100000210202 [0,2,0,0,0,0|1,0,0]=3 16255 B12R1.267 CCNCCc1ccccc1O 34a_100011207237_100000210202 [0,2,0,0,0,0|0,0,0]=2 16256 B12R1.267 CCNCCn1ccccc1=O 2230a_100000687133_100000210202 [0,2,0,0,0,0|1,0,1]=4 16257 B12R1.267 CCNN=Cc1ccccc1Br 4a_100000756455_100000211189 [0,2,0,0,0,0|1,0,1]=4 16258 B12R1.267 CCNN=Cc1ccccc1C 4a_100000756455_100000211143 [0,2,0,0,0,0|1,0,1]=4 16259 B12R1.267 CCNN=Cc1ccccc1Cl 4a_100000756455_100000210073 [0,2,0,0,0,0|1,0,1]=4 16260 B12R1.267 CCNN=Cc1ccccc1F 4a_100000756455_100000210811 [0,2,0,0,0,0|1,0,1]=4 16261 B12R1.267 CCNN=Cc1ccccc1I 4a_100000756455_100000010305 [0,2,0,0,0,0|1,0,1]=4 16262 B12R1.267 CCNN=Cc1ccccc1O 4a_100000756455_100000185834 [0,2,0,0,0,0|0,0,1]=3 16263 B12R1.267 CCNN=Cc1cccnc1O 4a_100000756455_100011998315 [0,2,0,0,0,0|1,0,1]=4 16264 B12R1.267 CCNN=Cc1ccncc1O 4a_100000756455_100000077405 [0,2,0,0,0,0|1,0,1]=4 16265 B12R1.267 CCNN=Cc1ncccc1O 4a_100000756455_100000042352 [0,2,0,0,0,0|1,0,1]=4 16266 B12R1.267 CCOC=Cc1ccccc1Br 271570a_100016256518_100000695589 [0,2,0,0,0,0|1,0,1]=4 16267 B12R1.267 CCOC=Cc1ccccc1C 271570a_100016256518_100000210755 [0,2,0,0,0,0|1,0,1]=4 16268 B12R1.267 CCOC=Cc1ccccc1Cl 271570a_100016256518_100000764095 [0,2,0,0,0,0|1,0,1]=4 16269 B12R1.267 CCOC=Cc1ccccc1F 271570a_100016256518_100011215700 [0,2,0,0,0,0|1,0,1]=4 16270 B12R1.267 CCOC=Cc1ccccc1N 271570a_100016256518_100000210017 [0,2,0,0,0,0|1,0,1]=4 16271 B12R1.267 CCOC=Cc1ccccc1O 271570a_100016256518_100000739446 [0,2,0,0,0,0|0,0,1]=3 16272 B12R1.267 CCOC=Cc1ccncc1O 271570a_100016256518_100009817591 [0,2,0,0,0,0|1,0,1]=4 16273 B12R1.267 CCOC=Cc1ncccc1O 271570a_100016256518_100000034122 [0,2,0,0,0,0|1,0,1]=4 16274 B12R1.267 CCOCCc1ccccc1Br 34a_100000731337_100000210202 [0,2,0,0,0,0|1,0,0]=3 16275 B12R1.267 CCOCCc1ccccc1Br 34a_100121572206_100012161201 [0,2,0,0,0,0|1,0,0]=3 16276 B12R1.267 CCOCCc1ccccc1Br 7a_100000731337_100000210202 [0,2,0,0,0,0|1,0,0]=3 16277 B12R1.267 CCOCCc1ccccc1C 34a_100011220023_100000210202 [0,2,0,0,0,0|1,0,0]=3 16278 B12R1.267 CCOCCc1ccccc1C 34a_100121572206_100011713688 [0,2,0,0,0,0|1,0,0]=3 16279 B12R1.267 CCOCCc1ccccc1C 7a_100011220023_100000210202 [0,2,0,0,0,0|1,0,0]=3 16280 B12R1.267 CCOCCc1ccccc1Cl 34a_100011215284_100000210202 [0,2,0,0,0,0|1,0,0]=3 16281 B12R1.267 CCOCCc1ccccc1Cl 34a_100121572206_100011713703 [0,2,0,0,0,0|1,0,0]=3 16282 B12R1.267 CCOCCc1ccccc1Cl 7a_100011215284_100000210202 [0,2,0,0,0,0|1,0,0]=3 16283 B12R1.267 CCOCCc1ccccc1F 34a_100000753711_100000210202 [0,2,0,0,0,0|1,0,0]=3 16284 B12R1.267 CCOCCc1ccccc1F 34a_100121572206_100000720011 [0,2,0,0,0,0|1,0,0]=3 16285 B12R1.267 CCOCCc1ccccc1F 7a_100000753711_100000210202 [0,2,0,0,0,0|1,0,0]=3 16286 B12R1.267 CCOCCc1ccccc1I 34a_100010255290_100000210202 [0,2,0,0,0,0|1,0,0]=3 16287 B12R1.267 CCOCCc1ccccc1I 7a_100010255290_100000210202 [0,2,0,0,0,0|1,0,0]=3 16288 B12R1.267 CCOCCc1ccccc1N 34a_100011215289_100000210202 [0,2,0,0,0,0|1,0,0]=3 16289 B12R1.267 CCOCCc1ccccc1O 34a_100121572206_100000722297 [0,2,0,0,0,0|0,0,0]=2 16290 B12R1.267 CCOCCc1ncccc1C 34a_100011997706_100000210202 [0,2,0,0,0,0|2,0,0]=4 16291 B12R1.267 CCOCCc1ncccc1C 7a_100011997706_100000210202 [0,2,0,0,0,0|2,0,0]=4 16292 B12R1.267 CCOCSc1c[nH]ccc1=O 62a_100000739092_100009998708 [0,2,0,0,0,0|1,0,1]=4 16293 B12R1.267 CCOCSc1c[nH]ccc1=O 62a_100009998708_100000739092 [0,2,0,0,0,0|1,0,1]=4 16294 B12R1.267 CCOCSc1c[nH]ccc1=S 62a_100000739092_200012280681 [0,2,0,0,0,0|1,1,0]=4 16295 B12R1.267 CCOCSc1c[nH]ccc1=S 62a_200012280681_100000739092 [0,2,0,0,0,0|1,1,0]=4 16296 B12R1.267 CCOCSc1cccc[n+]1C 62a_100000739092_100000212160 [0,2,0,0,0,0|2,0,0]=4 16297 B12R1.267 CCOCSc1cccc[n+]1[O-] 62a_100000739092_200000042595 [0,2,0,0,0,0|1,0,1]=4 16298 B12R1.267 CCOCSc1ccccc1Br 62a_100000695589_100000739092 [0,2,0,0,0,0|1,0,0]=3 16299 B12R1.267 CCOCSc1ccccc1Br 62a_100000739092_100000695589 [0,2,0,0,0,0|1,0,0]=3 16300 B12R1.267 CCOCSc1ccccc1C 62a_100000210755_100000739092 [0,2,0,0,0,0|1,0,0]=3 16301 B12R1.267 CCOCSc1ccccc1C 62a_100000739092_100000210755 [0,2,0,0,0,0|1,0,0]=3 16302 B12R1.267 CCOCSc1ccccc1Cl 62a_100000739092_100000764095 [0,2,0,0,0,0|1,0,0]=3 16303 B12R1.267 CCOCSc1ccccc1Cl 62a_100000764095_100000739092 [0,2,0,0,0,0|1,0,0]=3 16304 B12R1.267 CCOCSc1ccccc1F 62a_100000739092_100011215700 [0,2,0,0,0,0|1,0,0]=3 16305 B12R1.267 CCOCSc1ccccc1F 62a_100011215700_100000739092 [0,2,0,0,0,0|1,0,0]=3 16306 B12R1.267 CCOCSc1ccccc1N 62a_100000210017_100000739092 [0,2,0,0,0,0|1,0,0]=3 16307 B12R1.267 CCOCSc1ccccc1N 62a_100000739092_100000210017 [0,2,0,0,0,0|1,0,0]=3 16308 B12R1.267 CCOCSc1ccccc1O 62a_100000739092_100000739446 [0,2,0,0,0,0|0,0,0]=2 16309 B12R1.267 CCOCSc1ccccc1O 62a_100000739446_100000739092 [0,2,0,0,0,0|0,0,0]=2 16310 B12R1.267 CCOCSc1cccnc1Br 62a_100000739092_100010202626 [0,2,0,0,0,0|2,0,0]=4 16311 B12R1.267 CCOCSc1cccnc1Br 62a_100010202626_100000739092 [0,2,0,0,0,0|2,0,0]=4 16312 B12R1.267 CCOCSc1cccnc1C 62a_100000739092_100000751574 [0,2,0,0,0,0|2,0,0]=4 16313 B12R1.267 CCOCSc1cccnc1C 62a_100000751574_100000739092 [0,2,0,0,0,0|2,0,0]=4 16314 B12R1.267 CCOCSc1cccnc1Cl 62a_100000036424_100000739092 [0,2,0,0,0,0|2,0,0]=4 16315 B12R1.267 CCOCSc1cccnc1Cl 62a_100000739092_100000036424 [0,2,0,0,0,0|2,0,0]=4 16316 B12R1.267 CCOCSc1cccnc1F 62a_100000739092_100009816115 [0,2,0,0,0,0|2,0,0]=4 16317 B12R1.267 CCOCSc1cccnc1F 62a_100009816115_100000739092 [0,2,0,0,0,0|2,0,0]=4 16318 B12R1.267 CCOCSc1cccnc1N 62a_100000045569_100000739092 [0,2,0,0,0,0|2,0,0]=4 16319 B12R1.267 CCOCSc1cccnc1N 62a_100000739092_100000045569 [0,2,0,0,0,0|2,0,0]=4 16320 B12R1.267 CCOCSc1cccnc1O 62a_100000739092_100000760158 [0,2,0,0,0,0|1,0,0]=3 16321 B12R1.267 CCOCSc1cccnc1O 62a_100000760158_100000739092 [0,2,0,0,0,0|1,0,0]=3 16322 B12R1.267 CCOCSc1ccncc1Br 62a_100000726257_100000739092 [0,2,0,0,0,0|2,0,0]=4 16323 B12R1.267 CCOCSc1ccncc1Br 62a_100000739092_100000726257 [0,2,0,0,0,0|2,0,0]=4 16324 B12R1.267 CCOCSc1ccncc1C 62a_100000739092_100000765111 [0,2,0,0,0,0|2,0,0]=4 16325 B12R1.267 CCOCSc1ccncc1C 62a_100000765111_100000739092 [0,2,0,0,0,0|2,0,0]=4 16326 B12R1.267 CCOCSc1ccncc1Cl 62a_100000708259_100000739092 [0,2,0,0,0,0|2,0,0]=4 16327 B12R1.267 CCOCSc1ccncc1Cl 62a_100000739092_100000708259 [0,2,0,0,0,0|2,0,0]=4 16328 B12R1.267 CCOCSc1ccncc1F 62a_100000047030_100000739092 [0,2,0,0,0,0|2,0,0]=4 16329 B12R1.267 CCOCSc1ccncc1F 62a_100000739092_100000047030 [0,2,0,0,0,0|2,0,0]=4 16330 B12R1.267 CCOCSc1ccncc1N 62a_100000739092_100000756074 [0,2,0,0,0,0|2,0,0]=4 16331 B12R1.267 CCOCSc1ccncc1N 62a_100000756074_100000739092 [0,2,0,0,0,0|2,0,0]=4 16332 B12R1.267 CCOCSc1ccncc1O 62a_100000739092_100009817591 [0,2,0,0,0,0|1,0,0]=3 16333 B12R1.267 CCOCSc1ccncc1O 62a_100009817591_100000739092 [0,2,0,0,0,0|1,0,0]=3 16334 B12R1.267 CCOCSc1cnccc1Br 62a_100000739092_100010138639 [0,2,0,0,0,0|2,0,0]=4 16335 B12R1.267 CCOCSc1cnccc1Br 62a_100010138639_100000739092 [0,2,0,0,0,0|2,0,0]=4 16336 B12R1.267 CCOCSc1cnccc1C 62a_100000739092_100000761580 [0,2,0,0,0,0|2,0,0]=4 16337 B12R1.267 CCOCSc1cnccc1C 62a_100000761580_100000739092 [0,2,0,0,0,0|2,0,0]=4 16338 B12R1.267 CCOCSc1cnccc1Cl 62a_100000739092_100009995489 [0,2,0,0,0,0|2,0,0]=4 16339 B12R1.267 CCOCSc1cnccc1Cl 62a_100009995489_100000739092 [0,2,0,0,0,0|2,0,0]=4 16340 B12R1.267 CCOCSc1cnccc1F 62a_100000739092_100009820683 [0,2,0,0,0,0|2,0,0]=4 16341 B12R1.267 CCOCSc1cnccc1F 62a_100009820683_100000739092 [0,2,0,0,0,0|2,0,0]=4 16342 B12R1.267 CCOCSc1cnccc1N 62a_100000047001_100000739092 [0,2,0,0,0,0|2,0,0]=4 16343 B12R1.267 CCOCSc1cnccc1N 62a_100000739092_100000047001 [0,2,0,0,0,0|2,0,0]=4 16344 B12R1.267 CCOCSc1cncnc1O 62a_100000739092_100000751107 [0,2,0,0,0,0|2,0,0]=4 16345 B12R1.267 CCOCSc1cncnc1O 62a_100000751107_100000739092 [0,2,0,0,0,0|2,0,0]=4 16346 B12R1.267 CCOCSc1ncccc1Br 62a_100000696092_100000739092 [0,2,0,0,0,0|2,0,0]=4 16347 B12R1.267 CCOCSc1ncccc1Br 62a_100000739092_100000696092 [0,2,0,0,0,0|2,0,0]=4 16348 B12R1.267 CCOCSc1ncccc1C 62a_100000739092_100000751373 [0,2,0,0,0,0|2,0,0]=4 16349 B12R1.267 CCOCSc1ncccc1C 62a_100000751373_100000739092 [0,2,0,0,0,0|2,0,0]=4 16350 B12R1.267 CCOCSc1ncccc1Cl 62a_100000739092_100011356963 [0,2,0,0,0,0|2,0,0]=4 16351 B12R1.267 CCOCSc1ncccc1Cl 62a_100011356963_100000739092 [0,2,0,0,0,0|2,0,0]=4 16352 B12R1.267 CCOCSc1ncccc1F 62a_100000685392_100000739092 [0,2,0,0,0,0|2,0,0]=4 16353 B12R1.267 CCOCSc1ncccc1F 62a_100000739092_100000685392 [0,2,0,0,0,0|2,0,0]=4 16354 B12R1.267 CCOCSc1ncccc1N 62a_100000688686_100000739092 [0,2,0,0,0,0|2,0,0]=4 16355 B12R1.267 CCOCSc1ncccc1N 62a_100000739092_100000688686 [0,2,0,0,0,0|2,0,0]=4 16356 B12R1.267 CCOCSc1ncccc1O 62a_100000034122_100000739092 [0,2,0,0,0,0|1,0,0]=3 16357 B12R1.267 CCOCSc1ncccc1O 62a_100000739092_100000034122 [0,2,0,0,0,0|1,0,0]=3 16358 B12R1.267 CCSCCc1ccccc1Br 62a_100000210202_100012161201 [0,2,0,0,0,0|1,0,0]=3 16359 B12R1.267 CCSCCc1ccccc1Br 62a_100012161201_100000210202 [0,2,0,0,0,0|1,0,0]=3 16360 B12R1.267 CCSCCc1ccccc1C 62a_100000210202_100011713688 [0,2,0,0,0,0|1,0,0]=3 16361 B12R1.267 CCSCCc1ccccc1C 62a_100011713688_100000210202 [0,2,0,0,0,0|1,0,0]=3 16362 B12R1.267 CCSCCc1ccccc1Cl 62a_100000210202_100011713703 [0,2,0,0,0,0|1,0,0]=3 16363 B12R1.267 CCSCCc1ccccc1Cl 62a_100011713703_100000210202 [0,2,0,0,0,0|1,0,0]=3 16364 B12R1.267 CCSCCc1ccccc1F 62a_100000210202_100011713696 [0,2,0,0,0,0|1,0,0]=3 16365 B12R1.267 CCSCCc1ccccc1F 62a_100011713696_100000210202 [0,2,0,0,0,0|1,0,0]=3 16366 B12R1.267 CCSCCc1ccccc1O 62a_100000210202_100000722297 [0,2,0,0,0,0|0,0,0]=2 16367 B12R1.267 CCSCCc1ccccc1O 62a_100000722297_100000210202 [0,2,0,0,0,0|0,0,0]=2 16368 B12R1.267 CNCC#Cc1ccccc1Br 2230a_106832991635_100010706765 [0,2,0,0,0,0|1,0,1]=4 16369 B12R1.267 CNCC#Cc1ccccc1Br 34a_100102657272_100010706765 [0,2,0,0,0,0|1,0,1]=4 16370 B12R1.267 CNCC#Cc1ccccc1Br 7a_106832991635_100010706765 [0,2,0,0,0,0|1,0,1]=4 16371 B12R1.267 CNCC#Cc1ccccc1F 2230a_106832991635_100010404167 [0,2,0,0,0,0|1,0,1]=4 16372 B12R1.267 CNCC#Cc1ccccc1F 34a_100102657272_100010404167 [0,2,0,0,0,0|1,0,1]=4 16373 B12R1.267 CNCC#Cc1ccccc1F 7a_106832991635_100010404167 [0,2,0,0,0,0|1,0,1]=4 16374 B12R1.267 CNCC=Cc1ccccc1Br 270004a_106832991635_200016268969 [0,2,0,0,0,0|1,0,1]=4 16375 B12R1.267 CNCC=Cc1ccccc1Cl 270004a_106832991635_200102525841 [0,2,0,0,0,0|1,0,1]=4 16376 B12R1.267 CNCC=Cc1ccccc1F 270004a_106832991635_200102525844 [0,2,0,0,0,0|1,0,1]=4 16377 B12R1.267 CNCCCc1ccccc1Br 2230a_106832991635_200011713681 [0,2,0,0,0,0|1,0,0]=3 16378 B12R1.267 CNCCCc1ccccc1Br 34a_100102657272_200011713681 [0,2,0,0,0,0|1,0,0]=3 16379 B12R1.267 CNCCCc1ccccc1Br 7a_106832991635_200011713681 [0,2,0,0,0,0|1,0,0]=3 16380 B12R1.267 CNCCCc1ccccc1F 2230a_100000724733_200000210301 [0,2,0,0,0,0|1,0,0]=3 16381 B12R1.267 CNCCCc1ccccc1F 34a_100000724733_200000210301 [0,2,0,0,0,0|1,0,0]=3 16382 B12R1.267 CNCCOc1ccccc1Br 2230a_100000744007_200000210301 [0,2,0,0,0,0|1,0,0]=3 16383 B12R1.267 CNCCOc1ccccc1Br 2230a_106832991635_100000695877 [0,2,0,0,0,0|1,0,0]=3 16384 B12R1.267 CNCCOc1ccccc1Br 34a_100000744007_200000210301 [0,2,0,0,0,0|1,0,0]=3 16385 B12R1.267 CNCCOc1ccccc1Br 34a_100102657272_100000695877 [0,2,0,0,0,0|1,0,0]=3 16386 B12R1.267 CNCCOc1ccccc1Br 7a_106832991635_100000695877 [0,2,0,0,0,0|1,0,0]=3 16387 B12R1.267 CNCCOc1ccccc1C 2230a_100000743344_200000210301 [0,2,0,0,0,0|1,0,0]=3 16388 B12R1.267 CNCCOc1ccccc1C 2230a_106832991635_100000184434 [0,2,0,0,0,0|1,0,0]=3 16389 B12R1.267 CNCCOc1ccccc1C 34a_100000743344_200000210301 [0,2,0,0,0,0|1,0,0]=3 16390 B12R1.267 CNCCOc1ccccc1C 34a_100102657272_100000184434 [0,2,0,0,0,0|1,0,0]=3 16391 B12R1.267 CNCCOc1ccccc1C 7a_106832991635_100000184434 [0,2,0,0,0,0|1,0,0]=3 16392 B12R1.267 CNCCOc1ccccc1Cl 2230a_100000174932_200000210301 [0,2,0,0,0,0|1,0,0]=3 16393 B12R1.267 CNCCOc1ccccc1Cl 34a_100000174932_200000210301 [0,2,0,0,0,0|1,0,0]=3 16394 B12R1.267 CNCCOc1ccccc1F 2230a_100000683764_200000210301 [0,2,0,0,0,0|1,0,0]=3 16395 B12R1.267 CNCCOc1ccccc1F 2230a_106832991635_100000183290 [0,2,0,0,0,0|1,0,0]=3 16396 B12R1.267 CNCCOc1ccccc1F 34a_100000683764_200000210301 [0,2,0,0,0,0|1,0,0]=3 16397 B12R1.267 CNCCOc1ccccc1F 34a_100102657272_100000183290 [0,2,0,0,0,0|1,0,0]=3 16398 B12R1.267 CNCCOc1ccccc1F 7a_106832991635_100000183290 [0,2,0,0,0,0|1,0,0]=3 16399 B12R1.267 COCC#Cc1ccccc1Br 34a_100009814404_200000210301 [0,2,0,0,0,0|1,0,1]=4 16400 B12R1.267 COCC#Cc1ccccc1Br 34a_100138415774_100010706765 [0,2,0,0,0,0|1,0,1]=4 16401 B12R1.267 COCC#Cc1ccccc1Br 7a_100009814404_200000210301 [0,2,0,0,0,0|1,0,1]=4 16402 B12R1.267 COCC#Cc1ccccc1C 34a_200011352491_200000210301 [0,2,0,0,0,0|1,0,1]=4 16403 B12R1.267 COCC#Cc1ccccc1C 7a_200011352491_200000210301 [0,2,0,0,0,0|1,0,1]=4 16404 B12R1.267 COCC#Cc1ccccc1Cl 34a_100011219350_200000210301 [0,2,0,0,0,0|1,0,1]=4 16405 B12R1.267 COCC#Cc1ccccc1Cl 7a_100011219350_200000210301 [0,2,0,0,0,0|1,0,1]=4 16406 B12R1.267 COCC#Cc1ccccc1F 34a_100011219114_200000210301 [0,2,0,0,0,0|1,0,1]=4 16407 B12R1.267 COCC#Cc1ccccc1F 34a_100138415774_100010404167 [0,2,0,0,0,0|1,0,1]=4 16408 B12R1.267 COCC#Cc1ccccc1F 7a_100011219114_200000210301 [0,2,0,0,0,0|1,0,1]=4 16409 B12R1.267 COCC=Cc1ccccc1Br 271570a_100016286323_100000695589 [0,2,0,0,0,0|1,0,1]=4 16410 B12R1.267 COCC=Cc1ccccc1C 271570a_100016286323_100000210755 [0,2,0,0,0,0|1,0,1]=4 16411 B12R1.267 COCC=Cc1ccccc1Cl 271570a_100016286323_100000764095 [0,2,0,0,0,0|1,0,1]=4 16412 B12R1.267 COCC=Cc1ccccc1F 271570a_100016286323_100011215700 [0,2,0,0,0,0|1,0,1]=4 16413 B12R1.267 COCC=Cc1ccccc1N 271570a_100016286323_100000210017 [0,2,0,0,0,0|1,0,1]=4 16414 B12R1.267 COCC=Cc1ccccc1O 271570a_100016286323_100000739446 [0,2,0,0,0,0|0,0,1]=3 16415 B12R1.267 COCC=Cc1ccncc1O 271570a_100016286323_100009817591 [0,2,0,0,0,0|1,0,1]=4 16416 B12R1.267 COCC=Cc1ncccc1O 271570a_100016286323_100000034122 [0,2,0,0,0,0|1,0,1]=4 16417 B12R1.267 COCCCc1ccccc1Br 34a_100000699526_200000210301 [0,2,0,0,0,0|1,0,0]=3 16418 B12R1.267 COCCCc1ccccc1Br 34a_100138415774_200011713681 [0,2,0,0,0,0|1,0,0]=3 16419 B12R1.267 COCCCc1ccccc1Br 7a_100000699526_200000210301 [0,2,0,0,0,0|1,0,0]=3 16420 B12R1.267 COCCCc1ccccc1Cl 34a_100011709251_200000210301 [0,2,0,0,0,0|1,0,0]=3 16421 B12R1.267 COCCCc1ccccc1Cl 7a_100011709251_200000210301 [0,2,0,0,0,0|1,0,0]=3 16422 B12R1.267 COCCCc1ccccc1F 34a_100011709249_200000210301 [0,2,0,0,0,0|1,0,0]=3 16423 B12R1.267 COCCCc1ccccc1F 7a_100011709249_200000210301 [0,2,0,0,0,0|1,0,0]=3 16424 B12R1.267 COCCNc1ccccc1Br 34a_100000210017_100011201679 [0,2,0,0,0,0|1,0,0]=3 16425 B12R1.267 COCCNc1ccccc1C 34a_100011233185_200000210301 [0,2,0,0,0,0|1,0,0]=3 16426 B12R1.267 COCCNc1ccccc1C 34a_100015192222_100011201679 [0,2,0,0,0,0|1,0,0]=3 16427 B12R1.267 COCCNc1ccccc1Cl 34a_100000185783_100011201679 [0,2,0,0,0,0|1,0,0]=3 16428 B12R1.267 COCCNc1ccccc1F 34a_100000210422_100011201679 [0,2,0,0,0,0|1,0,0]=3 16429 B12R1.267 COCCNc1ccccc1I 34a_100000210053_100011201679 [0,2,0,0,0,0|1,0,0]=3 16430 B12R1.267 COCCNc1ccccc1N 34a_100000683943_200000210301 [0,2,0,0,0,0|1,0,0]=3 16431 B12R1.267 COCCNc1ccccc1O 34a_100000185747_100011201679 [0,2,0,0,0,0|0,0,0]=2 16432 B12R1.267 COCCNc1ccncc1Br 27a_100000209980_100000726257 [0,2,0,0,0,0|2,0,0]=4 16433 B12R1.267 COCCNc1ccncc1C 27a_100000209980_100000765111 [0,2,0,0,0,0|2,0,0]=4 16434 B12R1.267 COCCNc1ccncc1F 27a_100000209980_100000035921 [0,2,0,0,0,0|2,0,0]=4 16435 B12R1.267 COCCNc1ncccc1Br 27a_100000209980_100000696092 [0,2,0,0,0,0|2,0,0]=4 16436 B12R1.267 COCCOc1cccc[n+]1[O-] 7a_100000211761_100000233755 [0,2,0,0,0,0|1,0,1]=4 16437 B12R1.267 COCCOc1ccccc1Br 34a_100000181306_100011201679 [0,2,0,0,0,0|1,0,0]=3 16438 B12R1.267 COCCOc1ccccc1Br 34a_100000230753_200000210301 [0,2,0,0,0,0|1,0,0]=3 16439 B12R1.267 COCCOc1ccccc1Br 34a_100138415774_100000695877 [0,2,0,0,0,0|1,0,0]=3 16440 B12R1.267 COCCOc1ccccc1Br 7a_100000181306_100000233755 [0,2,0,0,0,0|1,0,0]=3 16441 B12R1.267 COCCOc1ccccc1Br 7a_100000230753_200000210301 [0,2,0,0,0,0|1,0,0]=3 16442 B12R1.267 COCCOc1ccccc1C 34a_100000210338_100011201679 [0,2,0,0,0,0|1,0,0]=3 16443 B12R1.267 COCCOc1ccccc1C 34a_100138415774_100000184434 [0,2,0,0,0,0|1,0,0]=3 16444 B12R1.267 COCCOc1ccccc1C 7a_100000210338_100000233755 [0,2,0,0,0,0|1,0,0]=3 16445 B12R1.267 COCCOc1ccccc1Cl 34a_100000210172_100011201679 [0,2,0,0,0,0|1,0,0]=3 16446 B12R1.267 COCCOc1ccccc1Cl 34a_200000230518_200000210301 [0,2,0,0,0,0|1,0,0]=3 16447 B12R1.267 COCCOc1ccccc1Cl 7a_100000210172_100000233755 [0,2,0,0,0,0|1,0,0]=3 16448 B12R1.267 COCCOc1ccccc1Cl 7a_200000230518_200000210301 [0,2,0,0,0,0|1,0,0]=3 16449 B12R1.267 COCCOc1ccccc1F 34a_100000210171_100011201679 [0,2,0,0,0,0|1,0,0]=3 16450 B12R1.267 COCCOc1ccccc1F 34a_100000756447_200000210301 [0,2,0,0,0,0|1,0,0]=3 16451 B12R1.267 COCCOc1ccccc1F 34a_100138415774_100000183290 [0,2,0,0,0,0|1,0,0]=3 16452 B12R1.267 COCCOc1ccccc1F 7a_100000210171_100000233755 [0,2,0,0,0,0|1,0,0]=3 16453 B12R1.267 COCCOc1ccccc1F 7a_100000756447_200000210301 [0,2,0,0,0,0|1,0,0]=3 16454 B12R1.267 COCCOc1ccccc1I 34a_100000739446_100011201679 [0,2,0,0,0,0|1,0,0]=3 16455 B12R1.267 COCCOc1ccccc1I 7a_100000739446_100000233755 [0,2,0,0,0,0|1,0,0]=3 16456 B12R1.267 COCCOc1ccccc1N 34a_100000185747_100011201679 [0,2,0,0,0,0|1,0,0]=3 16457 B12R1.267 COCCOc1ccccc1N 34a_100132302172_200000210301 [0,2,0,0,0,0|1,0,0]=3 16458 B12R1.267 COCCOc1ccccc1N 7a_100000185747_100000233755 [0,2,0,0,0,0|1,0,0]=3 16459 B12R1.267 COCCOc1ccccc1O 271570a_203496583355_100000234100 [0,2,0,0,0,0|0,0,0]=2 16460 B12R1.267 COCCOc1cccnc1Br 34a_100000744436_100011201679 [0,2,0,0,0,0|2,0,0]=4 16461 B12R1.267 COCCOc1cccnc1Br 7a_100000744436_100000233755 [0,2,0,0,0,0|2,0,0]=4 16462 B12R1.267 COCCOc1cccnc1C 34a_100000745507_100011201679 [0,2,0,0,0,0|2,0,0]=4 16463 B12R1.267 COCCOc1cccnc1C 7a_100000745507_100000233755 [0,2,0,0,0,0|2,0,0]=4 16464 B12R1.267 COCCOc1cccnc1Cl 34a_100000757616_100011201679 [0,2,0,0,0,0|2,0,0]=4 16465 B12R1.267 COCCOc1cccnc1Cl 7a_100000757616_100000233755 [0,2,0,0,0,0|2,0,0]=4 16466 B12R1.267 COCCOc1cccnc1F 34a_100000061740_100011201679 [0,2,0,0,0,0|2,0,0]=4 16467 B12R1.267 COCCOc1cccnc1F 7a_100000061740_100000233755 [0,2,0,0,0,0|2,0,0]=4 16468 B12R1.267 COCCOc1cccnc1I 34a_100000034122_100011201679 [0,2,0,0,0,0|2,0,0]=4 16469 B12R1.267 COCCOc1cccnc1I 7a_100000034122_100000233755 [0,2,0,0,0,0|2,0,0]=4 16470 B12R1.267 COCCOc1cccnc1N 34a_100000211975_100011201679 [0,2,0,0,0,0|2,0,0]=4 16471 B12R1.267 COCCOc1cccnc1N 7a_100000211975_100000233755 [0,2,0,0,0,0|2,0,0]=4 16472 B12R1.267 COCCOc1cccoc1=O 34a_100000077404_100011201679 [0,2,0,0,0,0|1,0,1]=4 16473 B12R1.267 COCCOc1cccoc1=O 7a_100000077404_100000233755 [0,2,0,0,0,0|1,0,1]=4 16474 B12R1.267 COCCOc1ccncc1Br 34a_100011996408_100011201679 [0,2,0,0,0,0|2,0,0]=4 16475 B12R1.267 COCCOc1ccncc1C 34a_100000694293_100011201679 [0,2,0,0,0,0|2,0,0]=4 16476 B12R1.267 COCCOc1ccncc1Cl 34a_100011997054_100011201679 [0,2,0,0,0,0|2,0,0]=4 16477 B12R1.267 COCCOc1ccncc1F 34a_200000081243_100011201679 [0,2,0,0,0,0|2,0,0]=4 16478 B12R1.267 COCCOc1cnccc1C 34a_100011997053_100011201679 [0,2,0,0,0,0|2,0,0]=4 16479 B12R1.267 COCCOc1cnccc1C 7a_100011997053_100000233755 [0,2,0,0,0,0|2,0,0]=4 16480 B12R1.267 COCCOc1cnccc1Cl 34a_100011996695_100011201679 [0,2,0,0,0,0|2,0,0]=4 16481 B12R1.267 COCCOc1cnccc1I 34a_100000050107_100011201679 [0,2,0,0,0,0|2,0,0]=4 16482 B12R1.267 COCCOc1cnccc1N 34a_100000753702_100011201679 [0,2,0,0,0,0|2,0,0]=4 16483 B12R1.267 COCCOc1coccc1=O 34a_100000060831_100011201679 [0,2,0,0,0,0|1,0,1]=4 16484 B12R1.267 COCCOc1ncccc1Cl 34a_100011290957_100011201679 [0,2,0,0,0,0|2,0,0]=4 16485 B12R1.267 COCCOc1ncccc1F 34a_100011219419_100011201679 [0,2,0,0,0,0|2,0,0]=4 16486 B12R1.267 COCCOc1ncccc1N 34a_100000746358_100011201679 [0,2,0,0,0,0|2,0,0]=4 16487 B12R1.267 COCCOc1ncccc1O 271570a_203496583355_100000754258 [0,2,0,0,0,0|1,0,0]=3 16488 B12R1.267 COCCSc1c[nH]ccc1=O 62a_100000233755_100009998708 [0,2,0,0,0,0|1,0,1]=4 16489 B12R1.267 COCCSc1c[nH]ccc1=O 62a_100009998708_100000233755 [0,2,0,0,0,0|1,0,1]=4 16490 B12R1.267 COCCSc1c[nH]ccc1=S 62a_100000233755_200012280681 [0,2,0,0,0,0|1,1,0]=4 16491 B12R1.267 COCCSc1c[nH]ccc1=S 62a_200012280681_100000233755 [0,2,0,0,0,0|1,1,0]=4 16492 B12R1.267 COCCSc1cccc[n+]1C 62a_100000233755_100000212160 [0,2,0,0,0,0|2,0,0]=4 16493 B12R1.267 COCCSc1cccc[n+]1[O-] 62a_100000233755_200000042595 [0,2,0,0,0,0|1,0,1]=4 16494 B12R1.267 COCCSc1ccccc1Br 34a_200000230852_200000210301 [0,2,0,0,0,0|1,0,0]=3 16495 B12R1.267 COCCSc1ccccc1Br 62a_100000233755_100000695589 [0,2,0,0,0,0|1,0,0]=3 16496 B12R1.267 COCCSc1ccccc1Br 62a_100000695589_100000233755 [0,2,0,0,0,0|1,0,0]=3 16497 B12R1.267 COCCSc1ccccc1Br 7a_200000230852_200000210301 [0,2,0,0,0,0|1,0,0]=3 16498 B12R1.267 COCCSc1ccccc1C 62a_100000210755_100000233755 [0,2,0,0,0,0|1,0,0]=3 16499 B12R1.267 COCCSc1ccccc1C 62a_100000233755_100000210755 [0,2,0,0,0,0|1,0,0]=3 16500 B12R1.267 COCCSc1ccccc1Cl 34a_200000230572_200000210301 [0,2,0,0,0,0|1,0,0]=3 16501 B12R1.267 COCCSc1ccccc1Cl 62a_100000233755_100000764095 [0,2,0,0,0,0|1,0,0]=3 16502 B12R1.267 COCCSc1ccccc1Cl 62a_100000764095_100000233755 [0,2,0,0,0,0|1,0,0]=3 16503 B12R1.267 COCCSc1ccccc1Cl 7a_200000230572_200000210301 [0,2,0,0,0,0|1,0,0]=3 16504 B12R1.267 COCCSc1ccccc1F 34a_200000230732_200000210301 [0,2,0,0,0,0|1,0,0]=3 16505 B12R1.267 COCCSc1ccccc1F 62a_100000233755_100011215700 [0,2,0,0,0,0|1,0,0]=3 16506 B12R1.267 COCCSc1ccccc1F 62a_100011215700_100000233755 [0,2,0,0,0,0|1,0,0]=3 16507 B12R1.267 COCCSc1ccccc1F 7a_200000230732_200000210301 [0,2,0,0,0,0|1,0,0]=3 16508 B12R1.267 COCCSc1ccccc1N 62a_100000210017_100000233755 [0,2,0,0,0,0|1,0,0]=3 16509 B12R1.267 COCCSc1ccccc1N 62a_100000233755_100000210017 [0,2,0,0,0,0|1,0,0]=3 16510 B12R1.267 COCCSc1ccccc1O 271570a_203496583355_200016336083 [0,2,0,0,0,0|0,0,0]=2 16511 B12R1.267 COCCSc1ccccc1O 62a_100000233755_100000739446 [0,2,0,0,0,0|0,0,0]=2 16512 B12R1.267 COCCSc1ccccc1O 62a_100000739446_100000233755 [0,2,0,0,0,0|0,0,0]=2 16513 B12R1.267 COCCSc1cccnc1Br 62a_100000233755_100010202626 [0,2,0,0,0,0|2,0,0]=4 16514 B12R1.267 COCCSc1cccnc1Br 62a_100010202626_100000233755 [0,2,0,0,0,0|2,0,0]=4 16515 B12R1.267 COCCSc1cccnc1C 62a_100000233755_100000751574 [0,2,0,0,0,0|2,0,0]=4 16516 B12R1.267 COCCSc1cccnc1C 62a_100000751574_100000233755 [0,2,0,0,0,0|2,0,0]=4 16517 B12R1.267 COCCSc1cccnc1Cl 62a_100000036424_100000233755 [0,2,0,0,0,0|2,0,0]=4 16518 B12R1.267 COCCSc1cccnc1Cl 62a_100000233755_100000036424 [0,2,0,0,0,0|2,0,0]=4 16519 B12R1.267 COCCSc1cccnc1F 62a_100000233755_100009816115 [0,2,0,0,0,0|2,0,0]=4 16520 B12R1.267 COCCSc1cccnc1F 62a_100009816115_100000233755 [0,2,0,0,0,0|2,0,0]=4 16521 B12R1.267 COCCSc1cccnc1N 62a_100000045569_100000233755 [0,2,0,0,0,0|2,0,0]=4 16522 B12R1.267 COCCSc1cccnc1N 62a_100000233755_100000045569 [0,2,0,0,0,0|2,0,0]=4 16523 B12R1.267 COCCSc1cccnc1O 62a_100000233755_100000760158 [0,2,0,0,0,0|1,0,0]=3 16524 B12R1.267 COCCSc1cccnc1O 62a_100000760158_100000233755 [0,2,0,0,0,0|1,0,0]=3 16525 B12R1.267 COCCSc1ccncc1Br 62a_100000233755_100000726257 [0,2,0,0,0,0|2,0,0]=4 16526 B12R1.267 COCCSc1ccncc1Br 62a_100000726257_100000233755 [0,2,0,0,0,0|2,0,0]=4 16527 B12R1.267 COCCSc1ccncc1C 62a_100000233755_100000765111 [0,2,0,0,0,0|2,0,0]=4 16528 B12R1.267 COCCSc1ccncc1C 62a_100000765111_100000233755 [0,2,0,0,0,0|2,0,0]=4 16529 B12R1.267 COCCSc1ccncc1Cl 62a_100000233755_100000708259 [0,2,0,0,0,0|2,0,0]=4 16530 B12R1.267 COCCSc1ccncc1Cl 62a_100000708259_100000233755 [0,2,0,0,0,0|2,0,0]=4 16531 B12R1.267 COCCSc1ccncc1F 62a_100000047030_100000233755 [0,2,0,0,0,0|2,0,0]=4 16532 B12R1.267 COCCSc1ccncc1F 62a_100000233755_100000047030 [0,2,0,0,0,0|2,0,0]=4 16533 B12R1.267 COCCSc1ccncc1N 62a_100000233755_100000756074 [0,2,0,0,0,0|2,0,0]=4 16534 B12R1.267 COCCSc1ccncc1N 62a_100000756074_100000233755 [0,2,0,0,0,0|2,0,0]=4 16535 B12R1.267 COCCSc1ccncc1O 62a_100000233755_100009817591 [0,2,0,0,0,0|1,0,0]=3 16536 B12R1.267 COCCSc1ccncc1O 62a_100009817591_100000233755 [0,2,0,0,0,0|1,0,0]=3 16537 B12R1.267 COCCSc1cnccc1Br 62a_100000233755_100010138639 [0,2,0,0,0,0|2,0,0]=4 16538 B12R1.267 COCCSc1cnccc1Br 62a_100010138639_100000233755 [0,2,0,0,0,0|2,0,0]=4 16539 B12R1.267 COCCSc1cnccc1C 62a_100000233755_100000761580 [0,2,0,0,0,0|2,0,0]=4 16540 B12R1.267 COCCSc1cnccc1C 62a_100000761580_100000233755 [0,2,0,0,0,0|2,0,0]=4 16541 B12R1.267 COCCSc1cnccc1Cl 62a_100000233755_100009995489 [0,2,0,0,0,0|2,0,0]=4 16542 B12R1.267 COCCSc1cnccc1Cl 62a_100009995489_100000233755 [0,2,0,0,0,0|2,0,0]=4 16543 B12R1.267 COCCSc1cnccc1F 62a_100000233755_100009820683 [0,2,0,0,0,0|2,0,0]=4 16544 B12R1.267 COCCSc1cnccc1F 62a_100009820683_100000233755 [0,2,0,0,0,0|2,0,0]=4 16545 B12R1.267 COCCSc1cnccc1N 62a_100000047001_100000233755 [0,2,0,0,0,0|2,0,0]=4 16546 B12R1.267 COCCSc1cnccc1N 62a_100000233755_100000047001 [0,2,0,0,0,0|2,0,0]=4 16547 B12R1.267 COCCSc1cncnc1O 62a_100000233755_100000751107 [0,2,0,0,0,0|2,0,0]=4 16548 B12R1.267 COCCSc1cncnc1O 62a_100000751107_100000233755 [0,2,0,0,0,0|2,0,0]=4 16549 B12R1.267 COCCSc1ncccc1Br 62a_100000233755_100000696092 [0,2,0,0,0,0|2,0,0]=4 16550 B12R1.267 COCCSc1ncccc1Br 62a_100000696092_100000233755 [0,2,0,0,0,0|2,0,0]=4 16551 B12R1.267 COCCSc1ncccc1C 62a_100000233755_100000751373 [0,2,0,0,0,0|2,0,0]=4 16552 B12R1.267 COCCSc1ncccc1C 62a_100000751373_100000233755 [0,2,0,0,0,0|2,0,0]=4 16553 B12R1.267 COCCSc1ncccc1Cl 62a_100000233755_100011356963 [0,2,0,0,0,0|2,0,0]=4 16554 B12R1.267 COCCSc1ncccc1Cl 62a_100011356963_100000233755 [0,2,0,0,0,0|2,0,0]=4 16555 B12R1.267 COCCSc1ncccc1F 62a_100000233755_100000685392 [0,2,0,0,0,0|2,0,0]=4 16556 B12R1.267 COCCSc1ncccc1F 62a_100000685392_100000233755 [0,2,0,0,0,0|2,0,0]=4 16557 B12R1.267 COCCSc1ncccc1N 62a_100000233755_100000688686 [0,2,0,0,0,0|2,0,0]=4 16558 B12R1.267 COCCSc1ncccc1N 62a_100000688686_100000233755 [0,2,0,0,0,0|2,0,0]=4 16559 B12R1.267 COCCSc1ncccc1O 62a_100000034122_100000233755 [0,2,0,0,0,0|1,0,0]=3 16560 B12R1.267 COCCSc1ncccc1O 62a_100000233755_100000034122 [0,2,0,0,0,0|1,0,0]=3 16561 B12R1.267 COCNCc1ccccc1Br 2230a_100000689332_100000766300 [0,2,0,0,0,0|1,0,0]=3 16562 B12R1.267 COCNCc1ccccc1Cl 2230a_100000174879_100000766300 [0,2,0,0,0,0|1,0,0]=3 16563 B12R1.267 COCNCc1cccnc1Br 2230a_100009818023_100000766300 [0,2,0,0,0,0|2,0,0]=4 16564 B12R1.267 COCNCc1cccnc1Cl 2230a_100015189234_100000766300 [0,2,0,0,0,0|2,0,0]=4 16565 B12R1.267 COCNCc1ncccc1Cl 2230a_100015189233_100000766300 [0,2,0,0,0,0|2,0,0]=4 16566 B12R1.267 COCSCc1ccccc1Br 62a_100000184730_100000766300 [0,2,0,0,0,0|1,0,0]=3 16567 B12R1.267 COCSCc1ccccc1Br 62a_100000766300_100000184730 [0,2,0,0,0,0|1,0,0]=3 16568 B12R1.267 COCSCc1ccccc1C 62a_100000211839_100000766300 [0,2,0,0,0,0|1,0,0]=3 16569 B12R1.267 COCSCc1ccccc1C 62a_100000766300_100000211839 [0,2,0,0,0,0|1,0,0]=3 16570 B12R1.267 COCSCc1ccccc1Cl 62a_100000187162_100000766300 [0,2,0,0,0,0|1,0,0]=3 16571 B12R1.267 COCSCc1ccccc1Cl 62a_100000766300_100000187162 [0,2,0,0,0,0|1,0,0]=3 16572 B12R1.267 COCSCc1ccccc1F 62a_100000211605_100000766300 [0,2,0,0,0,0|1,0,0]=3 16573 B12R1.267 COCSCc1ccccc1F 62a_100000766300_100000211605 [0,2,0,0,0,0|1,0,0]=3 16574 B12R1.267 COCSCc1ccccc1I 62a_100000766300_100011216222 [0,2,0,0,0,0|1,0,0]=3 16575 B12R1.267 COCSCc1ccccc1I 62a_100011216222_100000766300 [0,2,0,0,0,0|1,0,0]=3 16576 B12R1.267 COCSCc1cccnc1Br 62a_100000766300_100010140945 [0,2,0,0,0,0|2,0,0]=4 16577 B12R1.267 COCSCc1cccnc1Br 62a_100010140945_100000766300 [0,2,0,0,0,0|2,0,0]=4 16578 B12R1.267 COCSCc1cccnc1C 62a_100000732876_100000766300 [0,2,0,0,0,0|2,0,0]=4 16579 B12R1.267 COCSCc1cccnc1C 62a_100000766300_100000732876 [0,2,0,0,0,0|2,0,0]=4 16580 B12R1.267 COCSCc1cccnc1Cl 62a_100000045678_100000766300 [0,2,0,0,0,0|2,0,0]=4 16581 B12R1.267 COCSCc1cccnc1Cl 62a_100000766300_100000045678 [0,2,0,0,0,0|2,0,0]=4 16582 B12R1.267 COCSCc1cccnc1F 62a_100000099810_100000766300 [0,2,0,0,0,0|2,0,0]=4 16583 B12R1.267 COCSCc1cccnc1F 62a_100000766300_100000099810 [0,2,0,0,0,0|2,0,0]=4 16584 B12R1.267 COCSCc1ccncc1C 62a_100000766300_100020672808 [0,2,0,0,0,0|2,0,0]=4 16585 B12R1.267 COCSCc1ccncc1C 62a_100020672808_100000766300 [0,2,0,0,0,0|2,0,0]=4 16586 B12R1.267 COCSCc1ccncc1Cl 62a_100000763264_100000766300 [0,2,0,0,0,0|2,0,0]=4 16587 B12R1.267 COCSCc1ccncc1Cl 62a_100000766300_100000763264 [0,2,0,0,0,0|2,0,0]=4 16588 B12R1.267 COCSCc1cnccc1C 62a_100000690890_100000766300 [0,2,0,0,0,0|2,0,0]=4 16589 B12R1.267 COCSCc1cnccc1C 62a_100000766300_100000690890 [0,2,0,0,0,0|2,0,0]=4 16590 B12R1.267 COCSCc1ncccc1Br 62a_100000766300_100025702911 [0,2,0,0,0,0|2,0,0]=4 16591 B12R1.267 COCSCc1ncccc1Br 62a_100025702911_100000766300 [0,2,0,0,0,0|2,0,0]=4 16592 B12R1.267 COCSCc1ncccc1C 62a_100000696600_100000766300 [0,2,0,0,0,0|2,0,0]=4 16593 B12R1.267 COCSCc1ncccc1C 62a_100000766300_100000696600 [0,2,0,0,0,0|2,0,0]=4 16594 B12R1.267 COCSCc1ncccc1Cl 62a_100000099807_100000766300 [0,2,0,0,0,0|2,0,0]=4 16595 B12R1.267 COCSCc1ncccc1Cl 62a_100000766300_100000099807 [0,2,0,0,0,0|2,0,0]=4 16596 B12R1.267 COCSCc1ncccc1F 62a_100000104219_100000766300 [0,2,0,0,0,0|2,0,0]=4 16597 B12R1.267 COCSCc1ncccc1F 62a_100000766300_100000104219 [0,2,0,0,0,0|2,0,0]=4 16598 B12R1.267 COCSCc1ncccc1O 62a_100000766300_200020655725 [0,2,0,0,0,0|1,0,0]=3 16599 B12R1.267 COCSCc1ncccc1O 62a_200020655725_100000766300 [0,2,0,0,0,0|1,0,0]=3 16600 B12R1.267 CSCC#Cc1ccccc1Br 62a_100010706765_200000210301 [0,2,0,0,0,0|1,0,1]=4 16601 B12R1.267 CSCC#Cc1ccccc1Br 62a_200000210301_100010706765 [0,2,0,0,0,0|1,0,1]=4 16602 B12R1.267 CSCC#Cc1ccccc1F 62a_100010404167_200000210301 [0,2,0,0,0,0|1,0,1]=4 16603 B12R1.267 CSCC#Cc1ccccc1F 62a_200000210301_100010404167 [0,2,0,0,0,0|1,0,1]=4 16604 B12R1.267 CSCCCc1ccccc1Br 62a_200000210301_200011713681 [0,2,0,0,0,0|1,0,0]=3 16605 B12R1.267 CSCCCc1ccccc1Br 62a_200011713681_200000210301 [0,2,0,0,0,0|1,0,0]=3 16606 B12R1.267 CSCCNc1ccccc1Br 34a_100000210017_100000212216 [0,2,0,0,0,0|1,0,0]=3 16607 B12R1.267 CSCCNc1ccccc1C 34a_100015192222_100000212216 [0,2,0,0,0,0|1,0,0]=3 16608 B12R1.267 CSCCNc1ccccc1Cl 34a_100000185783_100000212216 [0,2,0,0,0,0|1,0,0]=3 16609 B12R1.267 CSCCNc1ccccc1F 34a_100000210422_100000212216 [0,2,0,0,0,0|1,0,0]=3 16610 B12R1.267 CSCCNc1ccccc1I 34a_100000210053_100000212216 [0,2,0,0,0,0|1,0,0]=3 16611 B12R1.267 CSCCNc1ccccc1O 34a_100000185747_100000212216 [0,2,0,0,0,0|0,0,0]=2 16612 B12R1.267 CSCCNc1ccncc1Br 27a_100020590264_100000726257 [0,2,0,0,0,0|2,0,0]=4 16613 B12R1.267 CSCCNc1ccncc1C 27a_100020590264_100000765111 [0,2,0,0,0,0|2,0,0]=4 16614 B12R1.267 CSCCNc1ccncc1F 27a_100020590264_100000035921 [0,2,0,0,0,0|2,0,0]=4 16615 B12R1.267 CSCCNc1ncccc1Br 27a_100020590264_100000696092 [0,2,0,0,0,0|2,0,0]=4 16616 B12R1.267 CSCCOc1cccc[n+]1[O-] 7a_100000211761_100000212216 [0,2,0,0,0,0|1,0,1]=4 16617 B12R1.267 CSCCOc1ccccc1Br 34a_100000181306_100000212216 [0,2,0,0,0,0|1,0,0]=3 16618 B12R1.267 CSCCOc1ccccc1Br 62a_100000695877_200000210301 [0,2,0,0,0,0|1,0,0]=3 16619 B12R1.267 CSCCOc1ccccc1Br 62a_200000210301_100000695877 [0,2,0,0,0,0|1,0,0]=3 16620 B12R1.267 CSCCOc1ccccc1Br 7a_100000181306_100000212216 [0,2,0,0,0,0|1,0,0]=3 16621 B12R1.267 CSCCOc1ccccc1C 34a_100000210338_100000212216 [0,2,0,0,0,0|1,0,0]=3 16622 B12R1.267 CSCCOc1ccccc1C 62a_100000184434_200000210301 [0,2,0,0,0,0|1,0,0]=3 16623 B12R1.267 CSCCOc1ccccc1C 62a_200000210301_100000184434 [0,2,0,0,0,0|1,0,0]=3 16624 B12R1.267 CSCCOc1ccccc1C 7a_100000210338_100000212216 [0,2,0,0,0,0|1,0,0]=3 16625 B12R1.267 CSCCOc1ccccc1Cl 34a_100000210172_100000212216 [0,2,0,0,0,0|1,0,0]=3 16626 B12R1.267 CSCCOc1ccccc1Cl 7a_100000210172_100000212216 [0,2,0,0,0,0|1,0,0]=3 16627 B12R1.267 CSCCOc1ccccc1F 34a_100000210171_100000212216 [0,2,0,0,0,0|1,0,0]=3 16628 B12R1.267 CSCCOc1ccccc1F 62a_100000183290_200000210301 [0,2,0,0,0,0|1,0,0]=3 16629 B12R1.267 CSCCOc1ccccc1F 62a_200000210301_100000183290 [0,2,0,0,0,0|1,0,0]=3 16630 B12R1.267 CSCCOc1ccccc1F 7a_100000210171_100000212216 [0,2,0,0,0,0|1,0,0]=3 16631 B12R1.267 CSCCOc1ccccc1I 34a_100000739446_100000212216 [0,2,0,0,0,0|1,0,0]=3 16632 B12R1.267 CSCCOc1ccccc1I 7a_100000739446_100000212216 [0,2,0,0,0,0|1,0,0]=3 16633 B12R1.267 CSCCOc1ccccc1N 34a_100000185747_100000212216 [0,2,0,0,0,0|1,0,0]=3 16634 B12R1.267 CSCCOc1ccccc1N 7a_100000185747_100000212216 [0,2,0,0,0,0|1,0,0]=3 16635 B12R1.267 CSCCOc1cccnc1Br 34a_100000744436_100000212216 [0,2,0,0,0,0|2,0,0]=4 16636 B12R1.267 CSCCOc1cccnc1Br 7a_100000744436_100000212216 [0,2,0,0,0,0|2,0,0]=4 16637 B12R1.267 CSCCOc1cccnc1C 34a_100000745507_100000212216 [0,2,0,0,0,0|2,0,0]=4 16638 B12R1.267 CSCCOc1cccnc1C 7a_100000745507_100000212216 [0,2,0,0,0,0|2,0,0]=4 16639 B12R1.267 CSCCOc1cccnc1Cl 34a_100000757616_100000212216 [0,2,0,0,0,0|2,0,0]=4 16640 B12R1.267 CSCCOc1cccnc1Cl 7a_100000757616_100000212216 [0,2,0,0,0,0|2,0,0]=4 16641 B12R1.267 CSCCOc1cccnc1F 34a_100000061740_100000212216 [0,2,0,0,0,0|2,0,0]=4 16642 B12R1.267 CSCCOc1cccnc1F 7a_100000061740_100000212216 [0,2,0,0,0,0|2,0,0]=4 16643 B12R1.267 CSCCOc1cccnc1I 34a_100000034122_100000212216 [0,2,0,0,0,0|2,0,0]=4 16644 B12R1.267 CSCCOc1cccnc1I 7a_100000034122_100000212216 [0,2,0,0,0,0|2,0,0]=4 16645 B12R1.267 CSCCOc1cccnc1N 34a_100000211975_100000212216 [0,2,0,0,0,0|2,0,0]=4 16646 B12R1.267 CSCCOc1cccnc1N 7a_100000211975_100000212216 [0,2,0,0,0,0|2,0,0]=4 16647 B12R1.267 CSCCOc1cccoc1=O 34a_100000077404_100000212216 [0,2,0,0,0,0|1,0,1]=4 16648 B12R1.267 CSCCOc1cccoc1=O 7a_100000077404_100000212216 [0,2,0,0,0,0|1,0,1]=4 16649 B12R1.267 CSCCOc1ccncc1Br 34a_100011996408_100000212216 [0,2,0,0,0,0|2,0,0]=4 16650 B12R1.267 CSCCOc1ccncc1C 34a_100000694293_100000212216 [0,2,0,0,0,0|2,0,0]=4 16651 B12R1.267 CSCCOc1ccncc1Cl 34a_100011997054_100000212216 [0,2,0,0,0,0|2,0,0]=4 16652 B12R1.267 CSCCOc1ccncc1F 34a_200000081243_100000212216 [0,2,0,0,0,0|2,0,0]=4 16653 B12R1.267 CSCCOc1cnccc1C 34a_100011997053_100000212216 [0,2,0,0,0,0|2,0,0]=4 16654 B12R1.267 CSCCOc1cnccc1C 7a_100011997053_100000212216 [0,2,0,0,0,0|2,0,0]=4 16655 B12R1.267 CSCCOc1cnccc1Cl 34a_100011996695_100000212216 [0,2,0,0,0,0|2,0,0]=4 16656 B12R1.267 CSCCOc1cnccc1I 34a_100000050107_100000212216 [0,2,0,0,0,0|2,0,0]=4 16657 B12R1.267 CSCCOc1cnccc1N 34a_100000753702_100000212216 [0,2,0,0,0,0|2,0,0]=4 16658 B12R1.267 CSCCOc1coccc1=O 34a_100000060831_100000212216 [0,2,0,0,0,0|1,0,1]=4 16659 B12R1.267 CSCCOc1ncccc1Cl 34a_100011290957_100000212216 [0,2,0,0,0,0|2,0,0]=4 16660 B12R1.267 CSCCOc1ncccc1F 34a_100011219419_100000212216 [0,2,0,0,0,0|2,0,0]=4 16661 B12R1.267 CSCCOc1ncccc1N 34a_100000746358_100000212216 [0,2,0,0,0,0|2,0,0]=4 16662 B12R1.267 CSCCSc1c[nH]ccc1=O 62a_100000212216_100009998708 [0,2,0,0,0,0|1,0,1]=4 16663 B12R1.267 CSCCSc1c[nH]ccc1=O 62a_100009998708_100000751147 [0,2,0,0,0,0|1,0,1]=4 16664 B12R1.267 CSCCSc1c[nH]ccc1=S 62a_100000212216_200012280681 [0,2,0,0,0,0|1,1,0]=4 16665 B12R1.267 CSCCSc1c[nH]ccc1=S 62a_200012280681_100000751147 [0,2,0,0,0,0|1,1,0]=4 16666 B12R1.267 CSCCSc1cccc[n+]1C 62a_100000212216_100000212160 [0,2,0,0,0,0|2,0,0]=4 16667 B12R1.267 CSCCSc1cccc[n+]1[O-] 62a_100000212216_200000042595 [0,2,0,0,0,0|1,0,1]=4 16668 B12R1.267 CSCCSc1ccccc1Br 62a_100000212216_100000695589 [0,2,0,0,0,0|1,0,0]=3 16669 B12R1.267 CSCCSc1ccccc1Br 62a_100000695589_100000751147 [0,2,0,0,0,0|1,0,0]=3 16670 B12R1.267 CSCCSc1ccccc1C 62a_100000210755_100000751147 [0,2,0,0,0,0|1,0,0]=3 16671 B12R1.267 CSCCSc1ccccc1C 62a_100000212216_100000210755 [0,2,0,0,0,0|1,0,0]=3 16672 B12R1.267 CSCCSc1ccccc1Cl 62a_100000212216_100000764095 [0,2,0,0,0,0|1,0,0]=3 16673 B12R1.267 CSCCSc1ccccc1Cl 62a_100000764095_100000751147 [0,2,0,0,0,0|1,0,0]=3 16674 B12R1.267 CSCCSc1ccccc1F 62a_100000212216_100011215700 [0,2,0,0,0,0|1,0,0]=3 16675 B12R1.267 CSCCSc1ccccc1F 62a_100011215700_100000751147 [0,2,0,0,0,0|1,0,0]=3 16676 B12R1.267 CSCCSc1ccccc1N 62a_100000210017_100000751147 [0,2,0,0,0,0|1,0,0]=3 16677 B12R1.267 CSCCSc1ccccc1N 62a_100000212216_100000210017 [0,2,0,0,0,0|1,0,0]=3 16678 B12R1.267 CSCCSc1ccccc1O 62a_100000212216_100000739446 [0,2,0,0,0,0|0,0,0]=2 16679 B12R1.267 CSCCSc1ccccc1O 62a_100000739446_100000751147 [0,2,0,0,0,0|0,0,0]=2 16680 B12R1.267 CSCCSc1cccnc1Br 62a_100000212216_100010202626 [0,2,0,0,0,0|2,0,0]=4 16681 B12R1.267 CSCCSc1cccnc1Br 62a_100010202626_100000751147 [0,2,0,0,0,0|2,0,0]=4 16682 B12R1.267 CSCCSc1cccnc1C 62a_100000212216_100000751574 [0,2,0,0,0,0|2,0,0]=4 16683 B12R1.267 CSCCSc1cccnc1C 62a_100000751574_100000751147 [0,2,0,0,0,0|2,0,0]=4 16684 B12R1.267 CSCCSc1cccnc1Cl 62a_100000036424_100000751147 [0,2,0,0,0,0|2,0,0]=4 16685 B12R1.267 CSCCSc1cccnc1Cl 62a_100000212216_100000036424 [0,2,0,0,0,0|2,0,0]=4 16686 B12R1.267 CSCCSc1cccnc1F 62a_100000212216_100009816115 [0,2,0,0,0,0|2,0,0]=4 16687 B12R1.267 CSCCSc1cccnc1F 62a_100009816115_100000751147 [0,2,0,0,0,0|2,0,0]=4 16688 B12R1.267 CSCCSc1cccnc1N 62a_100000045569_100000751147 [0,2,0,0,0,0|2,0,0]=4 16689 B12R1.267 CSCCSc1cccnc1N 62a_100000212216_100000045569 [0,2,0,0,0,0|2,0,0]=4 16690 B12R1.267 CSCCSc1cccnc1O 62a_100000212216_100000760158 [0,2,0,0,0,0|1,0,0]=3 16691 B12R1.267 CSCCSc1cccnc1O 62a_100000760158_100000751147 [0,2,0,0,0,0|1,0,0]=3 16692 B12R1.267 CSCCSc1ccncc1Br 62a_100000212216_100000726257 [0,2,0,0,0,0|2,0,0]=4 16693 B12R1.267 CSCCSc1ccncc1Br 62a_100000726257_100000751147 [0,2,0,0,0,0|2,0,0]=4 16694 B12R1.267 CSCCSc1ccncc1C 62a_100000212216_100000765111 [0,2,0,0,0,0|2,0,0]=4 16695 B12R1.267 CSCCSc1ccncc1C 62a_100000765111_100000751147 [0,2,0,0,0,0|2,0,0]=4 16696 B12R1.267 CSCCSc1ccncc1Cl 62a_100000212216_100000708259 [0,2,0,0,0,0|2,0,0]=4 16697 B12R1.267 CSCCSc1ccncc1Cl 62a_100000708259_100000751147 [0,2,0,0,0,0|2,0,0]=4 16698 B12R1.267 CSCCSc1ccncc1F 62a_100000047030_100000751147 [0,2,0,0,0,0|2,0,0]=4 16699 B12R1.267 CSCCSc1ccncc1F 62a_100000212216_100000047030 [0,2,0,0,0,0|2,0,0]=4 16700 B12R1.267 CSCCSc1ccncc1N 62a_100000212216_100000756074 [0,2,0,0,0,0|2,0,0]=4 16701 B12R1.267 CSCCSc1ccncc1N 62a_100000756074_100000751147 [0,2,0,0,0,0|2,0,0]=4 16702 B12R1.267 CSCCSc1ccncc1O 62a_100000212216_100009817591 [0,2,0,0,0,0|1,0,0]=3 16703 B12R1.267 CSCCSc1ccncc1O 62a_100009817591_100000751147 [0,2,0,0,0,0|1,0,0]=3 16704 B12R1.267 CSCCSc1cnccc1Br 62a_100000212216_100010138639 [0,2,0,0,0,0|2,0,0]=4 16705 B12R1.267 CSCCSc1cnccc1Br 62a_100010138639_100000751147 [0,2,0,0,0,0|2,0,0]=4 16706 B12R1.267 CSCCSc1cnccc1C 62a_100000212216_100000761580 [0,2,0,0,0,0|2,0,0]=4 16707 B12R1.267 CSCCSc1cnccc1C 62a_100000761580_100000751147 [0,2,0,0,0,0|2,0,0]=4 16708 B12R1.267 CSCCSc1cnccc1Cl 62a_100000212216_100009995489 [0,2,0,0,0,0|2,0,0]=4 16709 B12R1.267 CSCCSc1cnccc1Cl 62a_100009995489_100000751147 [0,2,0,0,0,0|2,0,0]=4 16710 B12R1.267 CSCCSc1cnccc1F 62a_100000212216_100009820683 [0,2,0,0,0,0|2,0,0]=4 16711 B12R1.267 CSCCSc1cnccc1F 62a_100009820683_100000751147 [0,2,0,0,0,0|2,0,0]=4 16712 B12R1.267 CSCCSc1cnccc1N 62a_100000047001_100000751147 [0,2,0,0,0,0|2,0,0]=4 16713 B12R1.267 CSCCSc1cnccc1N 62a_100000212216_100000047001 [0,2,0,0,0,0|2,0,0]=4 16714 B12R1.267 CSCCSc1cncnc1O 62a_100000212216_100000751107 [0,2,0,0,0,0|2,0,0]=4 16715 B12R1.267 CSCCSc1cncnc1O 62a_100000751107_100000751147 [0,2,0,0,0,0|2,0,0]=4 16716 B12R1.267 CSCCSc1ncccc1Br 62a_100000212216_100000696092 [0,2,0,0,0,0|2,0,0]=4 16717 B12R1.267 CSCCSc1ncccc1Br 62a_100000696092_100000751147 [0,2,0,0,0,0|2,0,0]=4 16718 B12R1.267 CSCCSc1ncccc1C 62a_100000212216_100000751373 [0,2,0,0,0,0|2,0,0]=4 16719 B12R1.267 CSCCSc1ncccc1C 62a_100000751373_100000751147 [0,2,0,0,0,0|2,0,0]=4 16720 B12R1.267 CSCCSc1ncccc1Cl 62a_100000212216_100011356963 [0,2,0,0,0,0|2,0,0]=4 16721 B12R1.267 CSCCSc1ncccc1Cl 62a_100011356963_100000751147 [0,2,0,0,0,0|2,0,0]=4 16722 B12R1.267 CSCCSc1ncccc1F 62a_100000212216_100000685392 [0,2,0,0,0,0|2,0,0]=4 16723 B12R1.267 CSCCSc1ncccc1F 62a_100000685392_100000751147 [0,2,0,0,0,0|2,0,0]=4 16724 B12R1.267 CSCCSc1ncccc1N 62a_100000212216_100000688686 [0,2,0,0,0,0|2,0,0]=4 16725 B12R1.267 CSCCSc1ncccc1N 62a_100000688686_100000751147 [0,2,0,0,0,0|2,0,0]=4 16726 B12R1.267 CSCCSc1ncccc1O 62a_100000034122_100000751147 [0,2,0,0,0,0|1,0,0]=3 16727 B12R1.267 CSCCSc1ncccc1O 62a_100000212216_100000034122 [0,2,0,0,0,0|1,0,0]=3 16728 B12R1.267 CSCNCc1ccccc1Br 2230a_100000689332_100011218213 [0,2,0,0,0,0|1,0,0]=3 16729 B12R1.267 CSCNCc1ccccc1Br 34a_100000689332_100011218213 [0,2,0,0,0,0|1,0,0]=3 16730 B12R1.267 CSCNCc1ccccc1C 34a_100000174972_100011218213 [0,2,0,0,0,0|1,0,0]=3 16731 B12R1.267 CSCNCc1ccccc1Cl 2230a_100000174879_100011218213 [0,2,0,0,0,0|1,0,0]=3 16732 B12R1.267 CSCNCc1ccccc1Cl 34a_100000174879_100011218213 [0,2,0,0,0,0|1,0,0]=3 16733 B12R1.267 CSCNCc1ccccc1F 34a_100000174869_100011218213 [0,2,0,0,0,0|1,0,0]=3 16734 B12R1.267 CSCNCc1ccccc1O 34a_100000185550_100011218213 [0,2,0,0,0,0|0,0,0]=2 16735 B12R1.267 CSCNCc1cccnc1Br 2230a_100009818023_100011218213 [0,2,0,0,0,0|2,0,0]=4 16736 B12R1.267 CSCNCc1cccnc1Br 34a_100009818023_100011218213 [0,2,0,0,0,0|2,0,0]=4 16737 B12R1.267 CSCNCc1cccnc1Cl 2230a_100015189234_100011218213 [0,2,0,0,0,0|2,0,0]=4 16738 B12R1.267 CSCNCc1cccnc1Cl 34a_100015189234_100011218213 [0,2,0,0,0,0|2,0,0]=4 16739 B12R1.267 CSCNCc1cccnc1F 34a_100000724633_100011218213 [0,2,0,0,0,0|2,0,0]=4 16740 B12R1.267 CSCNCc1ccncc1F 34a_100011935246_100011218213 [0,2,0,0,0,0|2,0,0]=4 16741 B12R1.267 CSCNCc1ncccc1C 34a_100011223789_100011218213 [0,2,0,0,0,0|2,0,0]=4 16742 B12R1.267 CSCNCc1ncccc1Cl 2230a_100015189233_100011218213 [0,2,0,0,0,0|2,0,0]=4 16743 B12R1.267 CSCNCc1ncccc1F 34a_100000690088_100011218213 [0,2,0,0,0,0|2,0,0]=4 16744 B12R1.267 CSCOCc1ccccc1Br 34a_100000756307_100011218213 [0,2,0,0,0,0|1,0,0]=3 16745 B12R1.267 CSCOCc1ccccc1C 34a_100000698903_100011218213 [0,2,0,0,0,0|1,0,0]=3 16746 B12R1.267 CSCOCc1ccccc1Cl 34a_100000210847_100011218213 [0,2,0,0,0,0|1,0,0]=3 16747 B12R1.267 CSCOCc1ccccc1F 34a_100000211962_100011218213 [0,2,0,0,0,0|1,0,0]=3 16748 B12R1.267 CSCOCc1ccccc1I 34a_100000187465_100011218213 [0,2,0,0,0,0|1,0,0]=3 16749 B12R1.267 CSCOCc1ccccc1N 34a_100000212039_100011218213 [0,2,0,0,0,0|1,0,0]=3 16750 B12R1.267 CSCOCc1cccnc1Br 34a_100000719692_100011218213 [0,2,0,0,0,0|2,0,0]=4 16751 B12R1.267 CSCOCc1cccnc1C 34a_100000729262_100011218213 [0,2,0,0,0,0|2,0,0]=4 16752 B12R1.267 CSCOCc1cccnc1Cl 34a_100000748726_100011218213 [0,2,0,0,0,0|2,0,0]=4 16753 B12R1.267 CSCOCc1cccnc1F 34a_100000079888_100011218213 [0,2,0,0,0,0|2,0,0]=4 16754 B12R1.267 CSCOCc1ccncc1C 34a_100011997032_100011218213 [0,2,0,0,0,0|2,0,0]=4 16755 B12R1.267 CSCOCc1ccncc1F 34a_100012172863_100011218213 [0,2,0,0,0,0|2,0,0]=4 16756 B12R1.267 CSCOCc1cnccc1C 34a_100011996381_100011218213 [0,2,0,0,0,0|2,0,0]=4 16757 B12R1.267 CSCOCc1cnccc1Cl 34a_100000117392_100011218213 [0,2,0,0,0,0|2,0,0]=4 16758 B12R1.267 CSCOCc1ncccc1Br 34a_100011996772_100011218213 [0,2,0,0,0,0|2,0,0]=4 16759 B12R1.267 CSCOCc1ncccc1C 34a_100000698912_100011218213 [0,2,0,0,0,0|2,0,0]=4 16760 B12R1.267 CSCOCc1ncccc1Cl 34a_100012002383_100011218213 [0,2,0,0,0,0|2,0,0]=4 16761 B12R1.267 CSCOCc1ncccc1F 34a_100011934865_100011218213 [0,2,0,0,0,0|2,0,0]=4 16762 B12R1.267 CSCOCc1ncccc1N 34a_114873767017_100011218213 [0,2,0,0,0,0|2,0,0]=4 16763 B12R1.267 CSCSCc1ccccc1Br 62a_100000184730_100011218213 [0,2,0,0,0,0|1,0,0]=3 16764 B12R1.267 CSCSCc1ccccc1Br 62a_100011218213_100000184730 [0,2,0,0,0,0|1,0,0]=3 16765 B12R1.267 CSCSCc1ccccc1C 62a_100000211839_100011218213 [0,2,0,0,0,0|1,0,0]=3 16766 B12R1.267 CSCSCc1ccccc1C 62a_100011218213_100000211839 [0,2,0,0,0,0|1,0,0]=3 16767 B12R1.267 CSCSCc1ccccc1Cl 62a_100000187162_100011218213 [0,2,0,0,0,0|1,0,0]=3 16768 B12R1.267 CSCSCc1ccccc1Cl 62a_100011218213_100000187162 [0,2,0,0,0,0|1,0,0]=3 16769 B12R1.267 CSCSCc1ccccc1F 62a_100000211605_100011218213 [0,2,0,0,0,0|1,0,0]=3 16770 B12R1.267 CSCSCc1ccccc1F 62a_100011218213_100000211605 [0,2,0,0,0,0|1,0,0]=3 16771 B12R1.267 CSCSCc1ccccc1I 62a_100011216222_100011218213 [0,2,0,0,0,0|1,0,0]=3 16772 B12R1.267 CSCSCc1ccccc1I 62a_100011218213_100011216222 [0,2,0,0,0,0|1,0,0]=3 16773 B12R1.267 CSCSCc1cccnc1Br 62a_100010140945_100011218213 [0,2,0,0,0,0|2,0,0]=4 16774 B12R1.267 CSCSCc1cccnc1Br 62a_100011218213_100010140945 [0,2,0,0,0,0|2,0,0]=4 16775 B12R1.267 CSCSCc1cccnc1C 62a_100000732876_100011218213 [0,2,0,0,0,0|2,0,0]=4 16776 B12R1.267 CSCSCc1cccnc1C 62a_100011218213_100000732876 [0,2,0,0,0,0|2,0,0]=4 16777 B12R1.267 CSCSCc1cccnc1Cl 62a_100000045678_100011218213 [0,2,0,0,0,0|2,0,0]=4 16778 B12R1.267 CSCSCc1cccnc1Cl 62a_100011218213_100000045678 [0,2,0,0,0,0|2,0,0]=4 16779 B12R1.267 CSCSCc1cccnc1F 62a_100000099810_100011218213 [0,2,0,0,0,0|2,0,0]=4 16780 B12R1.267 CSCSCc1cccnc1F 62a_100011218213_100000099810 [0,2,0,0,0,0|2,0,0]=4 16781 B12R1.267 CSCSCc1ccncc1C 62a_100011218213_100020672808 [0,2,0,0,0,0|2,0,0]=4 16782 B12R1.267 CSCSCc1ccncc1C 62a_100020672808_100011218213 [0,2,0,0,0,0|2,0,0]=4 16783 B12R1.267 CSCSCc1ccncc1Cl 62a_100000763264_100011218213 [0,2,0,0,0,0|2,0,0]=4 16784 B12R1.267 CSCSCc1ccncc1Cl 62a_100011218213_100000763264 [0,2,0,0,0,0|2,0,0]=4 16785 B12R1.267 CSCSCc1cnccc1C 62a_100000690890_100011218213 [0,2,0,0,0,0|2,0,0]=4 16786 B12R1.267 CSCSCc1cnccc1C 62a_100011218213_100000690890 [0,2,0,0,0,0|2,0,0]=4 16787 B12R1.267 CSCSCc1ncccc1Br 62a_100011218213_100025702911 [0,2,0,0,0,0|2,0,0]=4 16788 B12R1.267 CSCSCc1ncccc1Br 62a_100025702911_100011218213 [0,2,0,0,0,0|2,0,0]=4 16789 B12R1.267 CSCSCc1ncccc1C 62a_100000696600_100011218213 [0,2,0,0,0,0|2,0,0]=4 16790 B12R1.267 CSCSCc1ncccc1C 62a_100011218213_100000696600 [0,2,0,0,0,0|2,0,0]=4 16791 B12R1.267 CSCSCc1ncccc1Cl 62a_100000099807_100011218213 [0,2,0,0,0,0|2,0,0]=4 16792 B12R1.267 CSCSCc1ncccc1Cl 62a_100011218213_100000099807 [0,2,0,0,0,0|2,0,0]=4 16793 B12R1.267 CSCSCc1ncccc1F 62a_100000104219_100011218213 [0,2,0,0,0,0|2,0,0]=4 16794 B12R1.267 CSCSCc1ncccc1F 62a_100011218213_100000104219 [0,2,0,0,0,0|2,0,0]=4 16795 B12R1.267 CSCSCc1ncccc1O 62a_100011218213_200020655725 [0,2,0,0,0,0|1,0,0]=3 16796 B12R1.267 CSCSCc1ncccc1O 62a_200020655725_100011218213 [0,2,0,0,0,0|1,0,0]=3 16797 B12R1.267 C[n+]1ccccc1SCCCF 62a_100011934791_100000212160 [0,2,0,0,0,0|2,0,0]=4 16798 B12R1.267 C[n+]1ccccc1SCCCO 62a_100011215043_100000212160 [0,2,0,0,0,0|2,0,0]=4 16799 B12R1.267 Cc1ccccc1C#CCO[13CH3] 34a_200011352491_200025704644 [0,2,0,0,0,0|1,0,1]=4 16800 B12R1.267 Cc1ccccc1C#CCO[13CH3] 7a_200011352491_200025704644 [0,2,0,0,0,0|1,0,1]=4 16801 B12R1.267 Cc1ccccc1CCNCF 34a_100000685071_100015361967 [0,2,0,0,0,0|1,0,0]=3 16802 B12R1.267 Cc1ccccc1CCOCF 34a_100011220023_100015361967 [0,2,0,0,0,0|1,0,0]=3 16803 B12R1.267 Cc1ccccc1CCOCF 7a_100011220023_100015361967 [0,2,0,0,0,0|1,0,0]=3 16804 B12R1.267 Cc1ccccc1CCSCF 62a_100011713688_100015361967 [0,2,0,0,0,0|1,0,0]=3 16805 B12R1.267 Cc1ccccc1CCSCF 62a_100015361967_100011713688 [0,2,0,0,0,0|1,0,0]=3 16806 B12R1.267 Cc1ccccc1CNCC=O 34a_100000174972_200009817547 [0,2,0,0,0,0|1,0,1]=4 16807 B12R1.267 Cc1ccccc1CNCCF 34a_100000174972_100011217306 [0,2,0,0,0,0|1,0,0]=3 16808 B12R1.267 Cc1ccccc1CNCCF 34a_100000724931_100000211839 [0,2,0,0,0,0|1,0,0]=3 16809 B12R1.267 Cc1ccccc1CNCCO 207a_100000210304_100000211143 [0,2,0,0,0,0|1,0,0]=3 16810 B12R1.267 Cc1ccccc1CNCCO 2230a_100016997473_100000211839 [0,2,0,0,0,0|1,0,0]=3 16811 B12R1.267 Cc1ccccc1CNCCO 270004a_100000210304_100000211143 [0,2,0,0,0,0|1,0,0]=3 16812 B12R1.267 Cc1ccccc1CNCCO 34a_100000174972_100000211926 [0,2,0,0,0,0|1,0,0]=3 16813 B12R1.267 Cc1ccccc1CNCCO 34a_100016990907_100000211839 [0,2,0,0,0,0|1,0,0]=3 16814 B12R1.267 Cc1ccccc1COCC#N 7a_100000698903_100011215382 [0,2,0,0,0,0|1,0,1]=4 16815 B12R1.267 Cc1ccccc1COCC=O 34a_100000698903_200009817547 [0,2,0,0,0,0|1,0,1]=4 16816 B12R1.267 Cc1ccccc1COCC=O 7a_100000698903_200015260668 [0,2,0,0,0,0|1,0,1]=4 16817 B12R1.267 Cc1ccccc1COCCBr 34a_100000211926_100000211839 [0,2,0,0,0,0|1,0,0]=3 16818 B12R1.267 Cc1ccccc1COCCF 34a_100000698903_100011217306 [0,2,0,0,0,0|1,0,0]=3 16819 B12R1.267 Cc1ccccc1COCCF 7a_100000698903_100011217306 [0,2,0,0,0,0|1,0,0]=3 16820 B12R1.267 Cc1ccccc1COCCN 34a_100000210304_100000211839 [0,2,0,0,0,0|1,0,0]=3 16821 B12R1.267 Cc1ccccc1COCCO 34a_100000698903_100000211926 [0,2,0,0,0,0|1,0,0]=3 16822 B12R1.267 Cc1ccccc1COCCO 7a_100000698903_100000211926 [0,2,0,0,0,0|1,0,0]=3 16823 B12R1.267 Cc1ccccc1CSCC#N 62a_100000211839_100011215382 [0,2,0,0,0,0|1,0,1]=4 16824 B12R1.267 Cc1ccccc1CSCC#N 62a_100011215382_100000211839 [0,2,0,0,0,0|1,0,1]=4 16825 B12R1.267 Cc1ccccc1CSCC=O 62a_100000211839_200015260668 [0,2,0,0,0,0|1,0,1]=4 16826 B12R1.267 Cc1ccccc1CSCC=O 62a_200015260668_100000211839 [0,2,0,0,0,0|1,0,1]=4 16827 B12R1.267 Cc1ccccc1CSCCF 62a_100000211839_100011217306 [0,2,0,0,0,0|1,0,0]=3 16828 B12R1.267 Cc1ccccc1CSCCF 62a_100011217306_100000211839 [0,2,0,0,0,0|1,0,0]=3 16829 B12R1.267 Cc1ccccc1CSCCO 62a_100000211839_100000211926 [0,2,0,0,0,0|1,0,0]=3 16830 B12R1.267 Cc1ccccc1CSCCO 62a_100000211926_100000211839 [0,2,0,0,0,0|1,0,0]=3 16831 B12R1.267 Cc1ccccc1NCCCF 34a_100015192222_100011934791 [0,2,0,0,0,0|1,0,0]=3 16832 B12R1.267 Cc1ccccc1NCCCO 34a_100015192222_100000230001 [0,2,0,0,0,0|1,0,0]=3 16833 B12R1.267 Cc1ccccc1NCCO[13CH3] 34a_100011233185_200025704644 [0,2,0,0,0,0|1,0,0]=3 16834 B12R1.267 Cc1ccccc1OCCC#N 7a_100000210338_100000184422 [0,2,0,0,0,0|1,0,1]=4 16835 B12R1.267 Cc1ccccc1OCCCF 34a_100000210338_100011934791 [0,2,0,0,0,0|1,0,0]=3 16836 B12R1.267 Cc1ccccc1OCCCF 7a_100000210338_100011934791 [0,2,0,0,0,0|1,0,0]=3 16837 B12R1.267 Cc1ccccc1OCCCO 34a_100000210338_100000230001 [0,2,0,0,0,0|1,0,0]=3 16838 B12R1.267 Cc1ccccc1OCCCO 7a_100000210338_100011215043 [0,2,0,0,0,0|1,0,0]=3 16839 B12R1.267 Cc1ccccc1OCCN[13CH3] 2230a_100000743344_200025704644 [0,2,0,0,0,0|1,0,0]=3 16840 B12R1.267 Cc1ccccc1OCCN[13CH3] 34a_100000743344_200025704644 [0,2,0,0,0,0|1,0,0]=3 16841 B12R1.267 Cc1ccccc1OCCS[13CH3] 62a_100000184434_200025704644 [0,2,0,0,0,0|1,0,0]=3 16842 B12R1.267 Cc1ccccc1OCCS[13CH3] 62a_200025704644_100000184434 [0,2,0,0,0,0|1,0,0]=3 16843 B12R1.267 Cc1ccccc1SCCC#N 62a_100000210755_100011215226 [0,2,0,0,0,0|1,0,1]=4 16844 B12R1.267 Cc1ccccc1SCCC#N 62a_100011215226_100000210755 [0,2,0,0,0,0|1,0,1]=4 16845 B12R1.267 Cc1ccccc1SCCCF 62a_100000210755_100011934791 [0,2,0,0,0,0|1,0,0]=3 16846 B12R1.267 Cc1ccccc1SCCCF 62a_100011934791_100000210755 [0,2,0,0,0,0|1,0,0]=3 16847 B12R1.267 Cc1ccccc1SCCCO 62a_100000210755_100011215043 [0,2,0,0,0,0|1,0,0]=3 16848 B12R1.267 Cc1ccccc1SCCCO 62a_100011215043_100000210755 [0,2,0,0,0,0|1,0,0]=3 16849 B12R1.267 Cc1cccnc1CCOCF 34a_100011997706_100015361967 [0,2,0,0,0,0|2,0,0]=4 16850 B12R1.267 Cc1cccnc1CCOCF 7a_100011997706_100015361967 [0,2,0,0,0,0|2,0,0]=4 16851 B12R1.267 Cc1cccnc1CNCCF 34a_100000724931_100000696600 [0,2,0,0,0,0|2,0,0]=4 16852 B12R1.267 Cc1cccnc1CNCCF 34a_100011223789_100011217306 [0,2,0,0,0,0|2,0,0]=4 16853 B12R1.267 Cc1cccnc1CNCCO 207a_100000210304_100000698913 [0,2,0,0,0,0|2,0,0]=4 16854 B12R1.267 Cc1cccnc1CNCCO 2230a_100016997473_100000696600 [0,2,0,0,0,0|2,0,0]=4 16855 B12R1.267 Cc1cccnc1CNCCO 270004a_100000210304_100000698913 [0,2,0,0,0,0|2,0,0]=4 16856 B12R1.267 Cc1cccnc1CNCCO 34a_100011223789_100000211926 [0,2,0,0,0,0|2,0,0]=4 16857 B12R1.267 Cc1cccnc1CNCCO 34a_100016990907_100000696600 [0,2,0,0,0,0|2,0,0]=4 16858 B12R1.267 Cc1cccnc1COCCBr 34a_100000211926_100000696600 [0,2,0,0,0,0|2,0,0]=4 16859 B12R1.267 Cc1cccnc1COCCF 34a_100000698912_100011217306 [0,2,0,0,0,0|2,0,0]=4 16860 B12R1.267 Cc1cccnc1COCCN 34a_100000210304_100000696600 [0,2,0,0,0,0|2,0,0]=4 16861 B12R1.267 Cc1cccnc1COCCO 34a_100000698912_100000211926 [0,2,0,0,0,0|2,0,0]=4 16862 B12R1.267 Cc1cccnc1CSCCF 62a_100000696600_100011217306 [0,2,0,0,0,0|2,0,0]=4 16863 B12R1.267 Cc1cccnc1CSCCF 62a_100011217306_100000696600 [0,2,0,0,0,0|2,0,0]=4 16864 B12R1.267 Cc1cccnc1CSCCO 62a_100000211926_100000696600 [0,2,0,0,0,0|2,0,0]=4 16865 B12R1.267 Cc1cccnc1CSCCO 62a_100000696600_100000211926 [0,2,0,0,0,0|2,0,0]=4 16866 B12R1.267 Cc1cccnc1SCCCF 62a_100000751373_100011934791 [0,2,0,0,0,0|2,0,0]=4 16867 B12R1.267 Cc1cccnc1SCCCF 62a_100011934791_100000751373 [0,2,0,0,0,0|2,0,0]=4 16868 B12R1.267 Cc1cccnc1SCCCO 62a_100000751373_100011215043 [0,2,0,0,0,0|2,0,0]=4 16869 B12R1.267 Cc1cccnc1SCCCO 62a_100011215043_100000751373 [0,2,0,0,0,0|2,0,0]=4 16870 B12R1.267 Cc1ccncc1CNCCF 34a_100000724931_100000690890 [0,2,0,0,0,0|2,0,0]=4 16871 B12R1.267 Cc1ccncc1CNCCO 207a_100000210304_100000685662 [0,2,0,0,0,0|2,0,0]=4 16872 B12R1.267 Cc1ccncc1CNCCO 2230a_100016997473_100000690890 [0,2,0,0,0,0|2,0,0]=4 16873 B12R1.267 Cc1ccncc1CNCCO 270004a_100000210304_100000685662 [0,2,0,0,0,0|2,0,0]=4 16874 B12R1.267 Cc1ccncc1CNCCO 34a_100016990907_100000690890 [0,2,0,0,0,0|2,0,0]=4 16875 B12R1.267 Cc1ccncc1COCCBr 34a_100000211926_100000690890 [0,2,0,0,0,0|2,0,0]=4 16876 B12R1.267 Cc1ccncc1COCCF 34a_100011996381_100011217306 [0,2,0,0,0,0|2,0,0]=4 16877 B12R1.267 Cc1ccncc1COCCN 34a_100000210304_100000690890 [0,2,0,0,0,0|2,0,0]=4 16878 B12R1.267 Cc1ccncc1COCCO 34a_100011996381_100000211926 [0,2,0,0,0,0|2,0,0]=4 16879 B12R1.267 Cc1ccncc1CSCCF 62a_100000690890_100011217306 [0,2,0,0,0,0|2,0,0]=4 16880 B12R1.267 Cc1ccncc1CSCCF 62a_100011217306_100000690890 [0,2,0,0,0,0|2,0,0]=4 16881 B12R1.267 Cc1ccncc1CSCCO 62a_100000211926_100000690890 [0,2,0,0,0,0|2,0,0]=4 16882 B12R1.267 Cc1ccncc1CSCCO 62a_100000690890_100000211926 [0,2,0,0,0,0|2,0,0]=4 16883 B12R1.267 Cc1ccncc1OCCCF 34a_100011997053_100011934791 [0,2,0,0,0,0|2,0,0]=4 16884 B12R1.267 Cc1ccncc1OCCCF 7a_100011997053_100011934791 [0,2,0,0,0,0|2,0,0]=4 16885 B12R1.267 Cc1ccncc1OCCCO 34a_100011997053_100000230001 [0,2,0,0,0,0|2,0,0]=4 16886 B12R1.267 Cc1ccncc1OCCCO 7a_100011997053_100011215043 [0,2,0,0,0,0|2,0,0]=4 16887 B12R1.267 Cc1ccncc1SCCCF 62a_100000761580_100011934791 [0,2,0,0,0,0|2,0,0]=4 16888 B12R1.267 Cc1ccncc1SCCCF 62a_100011934791_100000761580 [0,2,0,0,0,0|2,0,0]=4 16889 B12R1.267 Cc1ccncc1SCCCO 62a_100000761580_100011215043 [0,2,0,0,0,0|2,0,0]=4 16890 B12R1.267 Cc1ccncc1SCCCO 62a_100011215043_100000761580 [0,2,0,0,0,0|2,0,0]=4 16891 B12R1.267 Cc1cnccc1CNCCF 34a_100000724931_100020672809 [0,2,0,0,0,0|2,0,0]=4 16892 B12R1.267 Cc1cnccc1CNCCO 2230a_100016997473_100020672808 [0,2,0,0,0,0|2,0,0]=4 16893 B12R1.267 Cc1cnccc1CNCCO 34a_100016990907_100020672809 [0,2,0,0,0,0|2,0,0]=4 16894 B12R1.267 Cc1cnccc1COCCBr 34a_100000211926_100020672809 [0,2,0,0,0,0|2,0,0]=4 16895 B12R1.267 Cc1cnccc1COCCF 34a_100011997032_100011217306 [0,2,0,0,0,0|2,0,0]=4 16896 B12R1.267 Cc1cnccc1COCCN 34a_100000210304_100020672809 [0,2,0,0,0,0|2,0,0]=4 16897 B12R1.267 Cc1cnccc1COCCO 34a_100011997032_100000211926 [0,2,0,0,0,0|2,0,0]=4 16898 B12R1.267 Cc1cnccc1CSCCF 62a_100011217306_100020672808 [0,2,0,0,0,0|2,0,0]=4 16899 B12R1.267 Cc1cnccc1CSCCF 62a_100020672808_100011217306 [0,2,0,0,0,0|2,0,0]=4 16900 B12R1.267 Cc1cnccc1CSCCO 62a_100000211926_100020672808 [0,2,0,0,0,0|2,0,0]=4 16901 B12R1.267 Cc1cnccc1CSCCO 62a_100020672808_100000211926 [0,2,0,0,0,0|2,0,0]=4 16902 B12R1.267 Cc1cnccc1NCCCF 27a_100015189416_100000765111 [0,2,0,0,0,0|2,0,0]=4 16903 B12R1.267 Cc1cnccc1NCCCO 27a_100000182051_100000765111 [0,2,0,0,0,0|2,0,0]=4 16904 B12R1.267 Cc1cnccc1OCCCF 34a_100000694293_100011934791 [0,2,0,0,0,0|2,0,0]=4 16905 B12R1.267 Cc1cnccc1OCCCO 34a_100000694293_100000230001 [0,2,0,0,0,0|2,0,0]=4 16906 B12R1.267 Cc1cnccc1SCCCF 62a_100000765111_100011934791 [0,2,0,0,0,0|2,0,0]=4 16907 B12R1.267 Cc1cnccc1SCCCF 62a_100011934791_100000765111 [0,2,0,0,0,0|2,0,0]=4 16908 B12R1.267 Cc1cnccc1SCCCO 62a_100000765111_100011215043 [0,2,0,0,0,0|2,0,0]=4 16909 B12R1.267 Cc1cnccc1SCCCO 62a_100011215043_100000765111 [0,2,0,0,0,0|2,0,0]=4 16910 B12R1.267 Cc1ncccc1CNCCF 34a_100000724931_100000732876 [0,2,0,0,0,0|2,0,0]=4 16911 B12R1.267 Cc1ncccc1CNCCO 207a_100000210304_100000751968 [0,2,0,0,0,0|2,0,0]=4 16912 B12R1.267 Cc1ncccc1CNCCO 2230a_100016997473_100000732876 [0,2,0,0,0,0|2,0,0]=4 16913 B12R1.267 Cc1ncccc1CNCCO 270004a_100000210304_100000751968 [0,2,0,0,0,0|2,0,0]=4 16914 B12R1.267 Cc1ncccc1CNCCO 34a_100016990907_100000732876 [0,2,0,0,0,0|2,0,0]=4 16915 B12R1.267 Cc1ncccc1COCCBr 34a_100000211926_100000732876 [0,2,0,0,0,0|2,0,0]=4 16916 B12R1.267 Cc1ncccc1COCCF 34a_100000729262_100011217306 [0,2,0,0,0,0|2,0,0]=4 16917 B12R1.267 Cc1ncccc1COCCF 7a_100000729262_100011217306 [0,2,0,0,0,0|2,0,0]=4 16918 B12R1.267 Cc1ncccc1COCCN 34a_100000210304_100000732876 [0,2,0,0,0,0|2,0,0]=4 16919 B12R1.267 Cc1ncccc1COCCO 34a_100000729262_100000211926 [0,2,0,0,0,0|2,0,0]=4 16920 B12R1.267 Cc1ncccc1COCCO 7a_100000729262_100000211926 [0,2,0,0,0,0|2,0,0]=4 16921 B12R1.267 Cc1ncccc1CSCCF 62a_100000732876_100011217306 [0,2,0,0,0,0|2,0,0]=4 16922 B12R1.267 Cc1ncccc1CSCCF 62a_100011217306_100000732876 [0,2,0,0,0,0|2,0,0]=4 16923 B12R1.267 Cc1ncccc1CSCCO 62a_100000211926_100000732876 [0,2,0,0,0,0|2,0,0]=4 16924 B12R1.267 Cc1ncccc1CSCCO 62a_100000732876_100000211926 [0,2,0,0,0,0|2,0,0]=4 16925 B12R1.267 Cc1ncccc1OCCCF 34a_100000745507_100011934791 [0,2,0,0,0,0|2,0,0]=4 16926 B12R1.267 Cc1ncccc1OCCCF 7a_100000745507_100011934791 [0,2,0,0,0,0|2,0,0]=4 16927 B12R1.267 Cc1ncccc1OCCCO 34a_100000745507_100000230001 [0,2,0,0,0,0|2,0,0]=4 16928 B12R1.267 Cc1ncccc1OCCCO 7a_100000745507_100011215043 [0,2,0,0,0,0|2,0,0]=4 16929 B12R1.267 Cc1ncccc1SCCCF 62a_100000751574_100011934791 [0,2,0,0,0,0|2,0,0]=4 16930 B12R1.267 Cc1ncccc1SCCCF 62a_100011934791_100000751574 [0,2,0,0,0,0|2,0,0]=4 16931 B12R1.267 Cc1ncccc1SCCCO 62a_100000751574_100011215043 [0,2,0,0,0,0|2,0,0]=4 16932 B12R1.267 Cc1ncccc1SCCCO 62a_100011215043_100000751574 [0,2,0,0,0,0|2,0,0]=4 16933 B12R1.267 Clc1ccccc1COCCBr 34a_100000211926_100000187162 [0,2,0,0,0,0|1,0,0]=3 16934 B12R1.267 Clc1ncccc1COCCBr 34a_100000211926_100000045678 [0,2,0,0,0,0|2,0,0]=4 16935 B12R1.267 FCCCNc1ccccc1Br 34a_100000210017_100011934791 [0,2,0,0,0,0|1,0,0]=3 16936 B12R1.267 FCCCNc1ccccc1Cl 34a_100000185783_100011934791 [0,2,0,0,0,0|1,0,0]=3 16937 B12R1.267 FCCCNc1ccccc1F 34a_100000210422_100011934791 [0,2,0,0,0,0|1,0,0]=3 16938 B12R1.267 FCCCNc1ccccc1I 34a_100000210053_100011934791 [0,2,0,0,0,0|1,0,0]=3 16939 B12R1.267 FCCCNc1ccncc1Br 27a_100015189416_100000726257 [0,2,0,0,0,0|2,0,0]=4 16940 B12R1.267 FCCCNc1ccncc1F 27a_100015189416_100000035921 [0,2,0,0,0,0|2,0,0]=4 16941 B12R1.267 FCCCNc1ncccc1Br 27a_100015189416_100000696092 [0,2,0,0,0,0|2,0,0]=4 16942 B12R1.267 FCCCOc1ccccc1Br 34a_100000181306_100011934791 [0,2,0,0,0,0|1,0,0]=3 16943 B12R1.267 FCCCOc1ccccc1Br 7a_100000181306_100011934791 [0,2,0,0,0,0|1,0,0]=3 16944 B12R1.267 FCCCOc1ccccc1Cl 34a_100000210172_100011934791 [0,2,0,0,0,0|1,0,0]=3 16945 B12R1.267 FCCCOc1ccccc1Cl 7a_100000210172_100011934791 [0,2,0,0,0,0|1,0,0]=3 16946 B12R1.267 FCCCOc1ccccc1F 34a_100000210171_100011934791 [0,2,0,0,0,0|1,0,0]=3 16947 B12R1.267 FCCCOc1ccccc1F 7a_100000210171_100011934791 [0,2,0,0,0,0|1,0,0]=3 16948 B12R1.267 FCCCOc1ccccc1I 34a_100000739446_100011934791 [0,2,0,0,0,0|1,0,0]=3 16949 B12R1.267 FCCCOc1ccccc1I 7a_100000739446_100011934791 [0,2,0,0,0,0|1,0,0]=3 16950 B12R1.267 FCCCOc1cccnc1Br 34a_100000744436_100011934791 [0,2,0,0,0,0|2,0,0]=4 16951 B12R1.267 FCCCOc1cccnc1Br 7a_100000744436_100011934791 [0,2,0,0,0,0|2,0,0]=4 16952 B12R1.267 FCCCOc1cccnc1Cl 34a_100000757616_100011934791 [0,2,0,0,0,0|2,0,0]=4 16953 B12R1.267 FCCCOc1cccnc1Cl 7a_100000757616_100011934791 [0,2,0,0,0,0|2,0,0]=4 16954 B12R1.267 FCCCOc1cccnc1F 34a_100000061740_100011934791 [0,2,0,0,0,0|2,0,0]=4 16955 B12R1.267 FCCCOc1cccnc1F 7a_100000061740_100011934791 [0,2,0,0,0,0|2,0,0]=4 16956 B12R1.267 FCCCOc1cccnc1I 34a_100000034122_100011934791 [0,2,0,0,0,0|2,0,0]=4 16957 B12R1.267 FCCCOc1cccnc1I 7a_100000034122_100011934791 [0,2,0,0,0,0|2,0,0]=4 16958 B12R1.267 FCCCOc1ccncc1Br 34a_100011996408_100011934791 [0,2,0,0,0,0|2,0,0]=4 16959 B12R1.267 FCCCOc1ccncc1Cl 34a_100011997054_100011934791 [0,2,0,0,0,0|2,0,0]=4 16960 B12R1.267 FCCCOc1ccncc1F 34a_200000081243_100011934791 [0,2,0,0,0,0|2,0,0]=4 16961 B12R1.267 FCCCOc1cnccc1Cl 34a_100011996695_100011934791 [0,2,0,0,0,0|2,0,0]=4 16962 B12R1.267 FCCCOc1cnccc1I 34a_100000050107_100011934791 [0,2,0,0,0,0|2,0,0]=4 16963 B12R1.267 FCCCOc1ncccc1Cl 34a_100011290957_100011934791 [0,2,0,0,0,0|2,0,0]=4 16964 B12R1.267 FCCCOc1ncccc1F 34a_100011219419_100011934791 [0,2,0,0,0,0|2,0,0]=4 16965 B12R1.267 FCCCSc1c[nH]ccc1=S 62a_100011934791_200012280681 [0,2,0,0,0,0|1,1,0]=4 16966 B12R1.267 FCCCSc1c[nH]ccc1=S 62a_200012280681_100011934791 [0,2,0,0,0,0|1,1,0]=4 16967 B12R1.267 FCCCSc1ccccc1Br 62a_100000695589_100011934791 [0,2,0,0,0,0|1,0,0]=3 16968 B12R1.267 FCCCSc1ccccc1Br 62a_100011934791_100000695589 [0,2,0,0,0,0|1,0,0]=3 16969 B12R1.267 FCCCSc1ccccc1Cl 62a_100000764095_100011934791 [0,2,0,0,0,0|1,0,0]=3 16970 B12R1.267 FCCCSc1ccccc1Cl 62a_100011934791_100000764095 [0,2,0,0,0,0|1,0,0]=3 16971 B12R1.267 FCCCSc1ccccc1F 62a_100011215700_100011934791 [0,2,0,0,0,0|1,0,0]=3 16972 B12R1.267 FCCCSc1ccccc1F 62a_100011934791_100011215700 [0,2,0,0,0,0|1,0,0]=3 16973 B12R1.267 FCCCSc1cccnc1Br 62a_100010202626_100011934791 [0,2,0,0,0,0|2,0,0]=4 16974 B12R1.267 FCCCSc1cccnc1Br 62a_100011934791_100010202626 [0,2,0,0,0,0|2,0,0]=4 16975 B12R1.267 FCCCSc1cccnc1Cl 62a_100000036424_100011934791 [0,2,0,0,0,0|2,0,0]=4 16976 B12R1.267 FCCCSc1cccnc1Cl 62a_100011934791_100000036424 [0,2,0,0,0,0|2,0,0]=4 16977 B12R1.267 FCCCSc1cccnc1F 62a_100009816115_100011934791 [0,2,0,0,0,0|2,0,0]=4 16978 B12R1.267 FCCCSc1cccnc1F 62a_100011934791_100009816115 [0,2,0,0,0,0|2,0,0]=4 16979 B12R1.267 FCCCSc1ccncc1Br 62a_100000726257_100011934791 [0,2,0,0,0,0|2,0,0]=4 16980 B12R1.267 FCCCSc1ccncc1Br 62a_100011934791_100000726257 [0,2,0,0,0,0|2,0,0]=4 16981 B12R1.267 FCCCSc1ccncc1Cl 62a_100000708259_100011934791 [0,2,0,0,0,0|2,0,0]=4 16982 B12R1.267 FCCCSc1ccncc1Cl 62a_100011934791_100000708259 [0,2,0,0,0,0|2,0,0]=4 16983 B12R1.267 FCCCSc1ccncc1F 62a_100000047030_100011934791 [0,2,0,0,0,0|2,0,0]=4 16984 B12R1.267 FCCCSc1ccncc1F 62a_100011934791_100000047030 [0,2,0,0,0,0|2,0,0]=4 16985 B12R1.267 FCCCSc1cnccc1Br 62a_100010138639_100011934791 [0,2,0,0,0,0|2,0,0]=4 16986 B12R1.267 FCCCSc1cnccc1Br 62a_100011934791_100010138639 [0,2,0,0,0,0|2,0,0]=4 16987 B12R1.267 FCCCSc1cnccc1Cl 62a_100009995489_100011934791 [0,2,0,0,0,0|2,0,0]=4 16988 B12R1.267 FCCCSc1cnccc1Cl 62a_100011934791_100009995489 [0,2,0,0,0,0|2,0,0]=4 16989 B12R1.267 FCCCSc1cnccc1F 62a_100009820683_100011934791 [0,2,0,0,0,0|2,0,0]=4 16990 B12R1.267 FCCCSc1cnccc1F 62a_100011934791_100009820683 [0,2,0,0,0,0|2,0,0]=4 16991 B12R1.267 FCCCSc1ncccc1Br 62a_100000696092_100011934791 [0,2,0,0,0,0|2,0,0]=4 16992 B12R1.267 FCCCSc1ncccc1Br 62a_100011934791_100000696092 [0,2,0,0,0,0|2,0,0]=4 16993 B12R1.267 FCCCSc1ncccc1Cl 62a_100011356963_100011934791 [0,2,0,0,0,0|2,0,0]=4 16994 B12R1.267 FCCCSc1ncccc1Cl 62a_100011934791_100011356963 [0,2,0,0,0,0|2,0,0]=4 16995 B12R1.267 FCCCSc1ncccc1F 62a_100000685392_100011934791 [0,2,0,0,0,0|2,0,0]=4 16996 B12R1.267 FCCCSc1ncccc1F 62a_100011934791_100000685392 [0,2,0,0,0,0|2,0,0]=4 16997 B12R1.267 FCCNCc1ccccc1Br 2230a_100000689332_100011217306 [0,2,0,0,0,0|1,0,0]=3 16998 B12R1.267 FCCNCc1ccccc1Br 34a_100000689332_100011217306 [0,2,0,0,0,0|1,0,0]=3 16999 B12R1.267 FCCNCc1ccccc1Br 34a_100000724931_100000184730 [0,2,0,0,0,0|1,0,0]=3 17000 B12R1.267 FCCNCc1ccccc1Cl 2230a_100000174879_100011217306 [0,2,0,0,0,0|1,0,0]=3 17001 B12R1.267 FCCNCc1ccccc1Cl 34a_100000174879_100011217306 [0,2,0,0,0,0|1,0,0]=3 17002 B12R1.267 FCCNCc1ccccc1Cl 34a_100000724931_100000187162 [0,2,0,0,0,0|1,0,0]=3 17003 B12R1.267 FCCNCc1ccccc1F 34a_100000174869_100011217306 [0,2,0,0,0,0|1,0,0]=3 17004 B12R1.267 FCCNCc1ccccc1F 34a_100000724931_100000211605 [0,2,0,0,0,0|1,0,0]=3 17005 B12R1.267 FCCNCc1ccccc1I 34a_100000724931_100011215278 [0,2,0,0,0,0|1,0,0]=3 17006 B12R1.267 FCCNCc1cccnc1Br 2230a_100009818023_100011217306 [0,2,0,0,0,0|2,0,0]=4 17007 B12R1.267 FCCNCc1cccnc1Br 34a_100000724931_100010140945 [0,2,0,0,0,0|2,0,0]=4 17008 B12R1.267 FCCNCc1cccnc1Br 34a_100009818023_100011217306 [0,2,0,0,0,0|2,0,0]=4 17009 B12R1.267 FCCNCc1cccnc1Cl 2230a_100015189234_100011217306 [0,2,0,0,0,0|2,0,0]=4 17010 B12R1.267 FCCNCc1cccnc1Cl 34a_100000724931_100000045678 [0,2,0,0,0,0|2,0,0]=4 17011 B12R1.267 FCCNCc1cccnc1Cl 34a_100015189234_100011217306 [0,2,0,0,0,0|2,0,0]=4 17012 B12R1.267 FCCNCc1cccnc1F 34a_100000724633_100011217306 [0,2,0,0,0,0|2,0,0]=4 17013 B12R1.267 FCCNCc1cccnc1F 34a_100000724931_100000099810 [0,2,0,0,0,0|2,0,0]=4 17014 B12R1.267 FCCNCc1ccncc1F 34a_100011935246_100011217306 [0,2,0,0,0,0|2,0,0]=4 17015 B12R1.267 FCCNCc1ncccc1Br 34a_100000724931_100025702911 [0,2,0,0,0,0|2,0,0]=4 17016 B12R1.267 FCCNCc1ncccc1Cl 2230a_100015189233_100011217306 [0,2,0,0,0,0|2,0,0]=4 17017 B12R1.267 FCCNCc1ncccc1F 34a_100000690088_100011217306 [0,2,0,0,0,0|2,0,0]=4 17018 B12R1.267 FCCNCc1ncccc1F 34a_100000724931_100000104219 [0,2,0,0,0,0|2,0,0]=4 17019 B12R1.267 FCCOCc1ccccc1Br 34a_100000756307_100011217306 [0,2,0,0,0,0|1,0,0]=3 17020 B12R1.267 FCCOCc1ccccc1Br 7a_100000756307_100011217306 [0,2,0,0,0,0|1,0,0]=3 17021 B12R1.267 FCCOCc1ccccc1Cl 34a_100000210847_100011217306 [0,2,0,0,0,0|1,0,0]=3 17022 B12R1.267 FCCOCc1ccccc1Cl 7a_100000210847_100011217306 [0,2,0,0,0,0|1,0,0]=3 17023 B12R1.267 FCCOCc1ccccc1F 34a_100000211962_100011217306 [0,2,0,0,0,0|1,0,0]=3 17024 B12R1.267 FCCOCc1ccccc1F 7a_100000211962_100011217306 [0,2,0,0,0,0|1,0,0]=3 17025 B12R1.267 FCCOCc1ccccc1I 34a_100000187465_100011217306 [0,2,0,0,0,0|1,0,0]=3 17026 B12R1.267 FCCOCc1ccccc1I 7a_100000187465_100011217306 [0,2,0,0,0,0|1,0,0]=3 17027 B12R1.267 FCCOCc1cccnc1Br 34a_100000719692_100011217306 [0,2,0,0,0,0|2,0,0]=4 17028 B12R1.267 FCCOCc1cccnc1Br 7a_100000719692_100011217306 [0,2,0,0,0,0|2,0,0]=4 17029 B12R1.267 FCCOCc1cccnc1Cl 34a_100000748726_100011217306 [0,2,0,0,0,0|2,0,0]=4 17030 B12R1.267 FCCOCc1cccnc1Cl 7a_100000748726_100011217306 [0,2,0,0,0,0|2,0,0]=4 17031 B12R1.267 FCCOCc1cccnc1F 34a_100000079888_100011217306 [0,2,0,0,0,0|2,0,0]=4 17032 B12R1.267 FCCOCc1cccnc1F 7a_100000079888_100011217306 [0,2,0,0,0,0|2,0,0]=4 17033 B12R1.267 FCCOCc1ccncc1F 34a_100012172863_100011217306 [0,2,0,0,0,0|2,0,0]=4 17034 B12R1.267 FCCOCc1cnccc1Cl 34a_100000117392_100011217306 [0,2,0,0,0,0|2,0,0]=4 17035 B12R1.267 FCCOCc1ncccc1Br 34a_100011996772_100011217306 [0,2,0,0,0,0|2,0,0]=4 17036 B12R1.267 FCCOCc1ncccc1Cl 34a_100012002383_100011217306 [0,2,0,0,0,0|2,0,0]=4 17037 B12R1.267 FCCOCc1ncccc1F 34a_100011934865_100011217306 [0,2,0,0,0,0|2,0,0]=4 17038 B12R1.267 FCCSCc1ccccc1Br 62a_100000184730_100011217306 [0,2,0,0,0,0|1,0,0]=3 17039 B12R1.267 FCCSCc1ccccc1Br 62a_100011217306_100000184730 [0,2,0,0,0,0|1,0,0]=3 17040 B12R1.267 FCCSCc1ccccc1Cl 62a_100000187162_100011217306 [0,2,0,0,0,0|1,0,0]=3 17041 B12R1.267 FCCSCc1ccccc1Cl 62a_100011217306_100000187162 [0,2,0,0,0,0|1,0,0]=3 17042 B12R1.267 FCCSCc1ccccc1F 62a_100000211605_100011217306 [0,2,0,0,0,0|1,0,0]=3 17043 B12R1.267 FCCSCc1ccccc1F 62a_100011217306_100000211605 [0,2,0,0,0,0|1,0,0]=3 17044 B12R1.267 FCCSCc1ccccc1I 62a_100011216222_100011217306 [0,2,0,0,0,0|1,0,0]=3 17045 B12R1.267 FCCSCc1ccccc1I 62a_100011217306_100011216222 [0,2,0,0,0,0|1,0,0]=3 17046 B12R1.267 FCCSCc1cccnc1Br 62a_100010140945_100011217306 [0,2,0,0,0,0|2,0,0]=4 17047 B12R1.267 FCCSCc1cccnc1Br 62a_100011217306_100010140945 [0,2,0,0,0,0|2,0,0]=4 17048 B12R1.267 FCCSCc1cccnc1Cl 62a_100000045678_100011217306 [0,2,0,0,0,0|2,0,0]=4 17049 B12R1.267 FCCSCc1cccnc1Cl 62a_100011217306_100000045678 [0,2,0,0,0,0|2,0,0]=4 17050 B12R1.267 FCCSCc1cccnc1F 62a_100000099810_100011217306 [0,2,0,0,0,0|2,0,0]=4 17051 B12R1.267 FCCSCc1cccnc1F 62a_100011217306_100000099810 [0,2,0,0,0,0|2,0,0]=4 17052 B12R1.267 FCCSCc1ccncc1Cl 62a_100000763264_100011217306 [0,2,0,0,0,0|2,0,0]=4 17053 B12R1.267 FCCSCc1ccncc1Cl 62a_100011217306_100000763264 [0,2,0,0,0,0|2,0,0]=4 17054 B12R1.267 FCCSCc1ncccc1Br 62a_100011217306_100025702911 [0,2,0,0,0,0|2,0,0]=4 17055 B12R1.267 FCCSCc1ncccc1Br 62a_100025702911_100011217306 [0,2,0,0,0,0|2,0,0]=4 17056 B12R1.267 FCCSCc1ncccc1Cl 62a_100000099807_100011217306 [0,2,0,0,0,0|2,0,0]=4 17057 B12R1.267 FCCSCc1ncccc1Cl 62a_100011217306_100000099807 [0,2,0,0,0,0|2,0,0]=4 17058 B12R1.267 FCCSCc1ncccc1F 62a_100000104219_100011217306 [0,2,0,0,0,0|2,0,0]=4 17059 B12R1.267 FCCSCc1ncccc1F 62a_100011217306_100000104219 [0,2,0,0,0,0|2,0,0]=4 17060 B12R1.267 FCNCCc1ccccc1Br 34a_100000747383_100015361967 [0,2,0,0,0,0|1,0,0]=3 17061 B12R1.267 FCNCCc1ccccc1Cl 34a_100011207228_100015361967 [0,2,0,0,0,0|1,0,0]=3 17062 B12R1.267 FCNCCc1ccccc1F 34a_100000185272_100015361967 [0,2,0,0,0,0|1,0,0]=3 17063 B12R1.267 FCOCCc1ccccc1Br 34a_100000731337_100015361967 [0,2,0,0,0,0|1,0,0]=3 17064 B12R1.267 FCOCCc1ccccc1Br 7a_100000731337_100015361967 [0,2,0,0,0,0|1,0,0]=3 17065 B12R1.267 FCOCCc1ccccc1Cl 34a_100011215284_100015361967 [0,2,0,0,0,0|1,0,0]=3 17066 B12R1.267 FCOCCc1ccccc1Cl 7a_100011215284_100015361967 [0,2,0,0,0,0|1,0,0]=3 17067 B12R1.267 FCOCCc1ccccc1F 34a_100000753711_100015361967 [0,2,0,0,0,0|1,0,0]=3 17068 B12R1.267 FCOCCc1ccccc1F 7a_100000753711_100015361967 [0,2,0,0,0,0|1,0,0]=3 17069 B12R1.267 FCOCCc1ccccc1I 34a_100010255290_100015361967 [0,2,0,0,0,0|1,0,0]=3 17070 B12R1.267 FCOCCc1ccccc1I 7a_100010255290_100015361967 [0,2,0,0,0,0|1,0,0]=3 17071 B12R1.267 FCSCCc1ccccc1Br 62a_100012161201_100015361967 [0,2,0,0,0,0|1,0,0]=3 17072 B12R1.267 FCSCCc1ccccc1Br 62a_100015361967_100012161201 [0,2,0,0,0,0|1,0,0]=3 17073 B12R1.267 FCSCCc1ccccc1Cl 62a_100011713703_100015361967 [0,2,0,0,0,0|1,0,0]=3 17074 B12R1.267 FCSCCc1ccccc1Cl 62a_100015361967_100011713703 [0,2,0,0,0,0|1,0,0]=3 17075 B12R1.267 FCSCCc1ccccc1F 62a_100011713696_100015361967 [0,2,0,0,0,0|1,0,0]=3 17076 B12R1.267 FCSCCc1ccccc1F 62a_100015361967_100011713696 [0,2,0,0,0,0|1,0,0]=3 17077 B12R1.267 Fc1ccccc1COCCBr 34a_100000211926_100000211605 [0,2,0,0,0,0|1,0,0]=3 17078 B12R1.267 Fc1cccnc1COCCBr 34a_100000211926_100000104219 [0,2,0,0,0,0|2,0,0]=4 17079 B12R1.267 Fc1ncccc1COCCBr 34a_100000211926_100000099810 [0,2,0,0,0,0|2,0,0]=4 17080 B12R1.267 N#CCCOc1ccccc1Br 7a_100000181306_100000184422 [0,2,0,0,0,0|1,0,1]=4 17081 B12R1.267 N#CCCOc1ccccc1Cl 7a_100000210172_100000184422 [0,2,0,0,0,0|1,0,1]=4 17082 B12R1.267 N#CCCOc1ccccc1F 7a_100000210171_100000184422 [0,2,0,0,0,0|1,0,1]=4 17083 B12R1.267 N#CCCOc1ccccc1I 7a_100000739446_100000184422 [0,2,0,0,0,0|1,0,1]=4 17084 B12R1.267 N#CCCOc1ccccc1N 7a_100000185747_100000184422 [0,2,0,0,0,0|1,0,1]=4 17085 B12R1.267 N#CCCSc1ccccc1Br 62a_100000695589_100011215226 [0,2,0,0,0,0|1,0,1]=4 17086 B12R1.267 N#CCCSc1ccccc1Br 62a_100011215226_100000695589 [0,2,0,0,0,0|1,0,1]=4 17087 B12R1.267 N#CCCSc1ccccc1Cl 62a_100000764095_100011215226 [0,2,0,0,0,0|1,0,1]=4 17088 B12R1.267 N#CCCSc1ccccc1Cl 62a_100011215226_100000764095 [0,2,0,0,0,0|1,0,1]=4 17089 B12R1.267 N#CCCSc1ccccc1F 62a_100011215226_100011215700 [0,2,0,0,0,0|1,0,1]=4 17090 B12R1.267 N#CCCSc1ccccc1F 62a_100011215700_100011215226 [0,2,0,0,0,0|1,0,1]=4 17091 B12R1.267 N#CCCSc1ccccc1N 62a_100000210017_100011215226 [0,2,0,0,0,0|1,0,1]=4 17092 B12R1.267 N#CCCSc1ccccc1N 62a_100011215226_100000210017 [0,2,0,0,0,0|1,0,1]=4 17093 B12R1.267 N#CCCSc1ccccc1O 62a_100000739446_100011215226 [0,2,0,0,0,0|0,0,1]=3 17094 B12R1.267 N#CCCSc1ccccc1O 62a_100011215226_100000739446 [0,2,0,0,0,0|0,0,1]=3 17095 B12R1.267 N#CCCSc1cccnc1O 62a_100000760158_100011215226 [0,2,0,0,0,0|1,0,1]=4 17096 B12R1.267 N#CCCSc1cccnc1O 62a_100011215226_100000760158 [0,2,0,0,0,0|1,0,1]=4 17097 B12R1.267 N#CCCSc1ccncc1O 62a_100009817591_100011215226 [0,2,0,0,0,0|1,0,1]=4 17098 B12R1.267 N#CCCSc1ccncc1O 62a_100011215226_100009817591 [0,2,0,0,0,0|1,0,1]=4 17099 B12R1.267 N#CCCSc1ncccc1O 62a_100000034122_100011215226 [0,2,0,0,0,0|1,0,1]=4 17100 B12R1.267 N#CCCSc1ncccc1O 62a_100011215226_100000034122 [0,2,0,0,0,0|1,0,1]=4 17101 B12R1.267 N#CCNCc1ccccc1Br 2230a_100000689332_100011215382 [0,2,0,0,0,0|1,0,1]=4 17102 B12R1.267 N#CCNCc1ccccc1Cl 2230a_100000174879_100011215382 [0,2,0,0,0,0|1,0,1]=4 17103 B12R1.267 N#CCOCc1ccccc1Br 7a_100000756307_100011215382 [0,2,0,0,0,0|1,0,1]=4 17104 B12R1.267 N#CCOCc1ccccc1Cl 7a_100000210847_100011215382 [0,2,0,0,0,0|1,0,1]=4 17105 B12R1.267 N#CCOCc1ccccc1F 7a_100000211962_100011215382 [0,2,0,0,0,0|1,0,1]=4 17106 B12R1.267 N#CCOCc1ccccc1I 7a_100000187465_100011215382 [0,2,0,0,0,0|1,0,1]=4 17107 B12R1.267 N#CCSCc1ccccc1Br 62a_100000184730_100011215382 [0,2,0,0,0,0|1,0,1]=4 17108 B12R1.267 N#CCSCc1ccccc1Br 62a_100011215382_100000184730 [0,2,0,0,0,0|1,0,1]=4 17109 B12R1.267 N#CCSCc1ccccc1Cl 62a_100000187162_100011215382 [0,2,0,0,0,0|1,0,1]=4 17110 B12R1.267 N#CCSCc1ccccc1Cl 62a_100011215382_100000187162 [0,2,0,0,0,0|1,0,1]=4 17111 B12R1.267 N#CCSCc1ccccc1F 62a_100000211605_100011215382 [0,2,0,0,0,0|1,0,1]=4 17112 B12R1.267 N#CCSCc1ccccc1F 62a_100011215382_100000211605 [0,2,0,0,0,0|1,0,1]=4 17113 B12R1.267 N#CCSCc1ccccc1I 62a_100011215382_100011216222 [0,2,0,0,0,0|1,0,1]=4 17114 B12R1.267 N#CCSCc1ccccc1I 62a_100011216222_100011215382 [0,2,0,0,0,0|1,0,1]=4 17115 B12R1.267 N#CCSCc1ncccc1O 62a_100011215382_200020655725 [0,2,0,0,0,0|1,0,1]=4 17116 B12R1.267 N#CCSCc1ncccc1O 62a_200020655725_100011215382 [0,2,0,0,0,0|1,0,1]=4 17117 B12R1.267 N#CSCSc1ccccc1O 62a_100000211825_100000739446 [0,2,0,0,0,0|1,0,1]=4 17118 B12R1.267 N#CSCSc1ccccc1O 62a_100000739446_100000211825 [0,2,0,0,0,0|1,0,1]=4 17119 B12R1.267 NCCOCc1ccccc1Br 34a_100000210304_100000184730 [0,2,0,0,0,0|1,0,0]=3 17120 B12R1.267 NCCOCc1ccccc1Cl 34a_100000210304_100000187162 [0,2,0,0,0,0|1,0,0]=3 17121 B12R1.267 NCCOCc1ccccc1F 34a_100000210304_100000211605 [0,2,0,0,0,0|1,0,0]=3 17122 B12R1.267 NCCOCc1ccccc1I 34a_100000210304_100011215278 [0,2,0,0,0,0|1,0,0]=3 17123 B12R1.267 NCCOCc1cccnc1Br 34a_100000210304_100010140945 [0,2,0,0,0,0|2,0,0]=4 17124 B12R1.267 NCCOCc1cccnc1Cl 34a_100000210304_100000045678 [0,2,0,0,0,0|2,0,0]=4 17125 B12R1.267 NCCOCc1cccnc1F 34a_100000210304_100000099810 [0,2,0,0,0,0|2,0,0]=4 17126 B12R1.267 NCCOCc1ncccc1Br 34a_100000210304_100025702911 [0,2,0,0,0,0|2,0,0]=4 17127 B12R1.267 NCCOCc1ncccc1F 34a_100000210304_100000104219 [0,2,0,0,0,0|2,0,0]=4 17128 B12R1.267 NCCOCc1ncccc1O 34a_100000210304_200020655725 [0,2,0,0,0,0|1,0,0]=3 17129 B12R1.267 Nc1ccccc1CCOCF 34a_100011215289_100015361967 [0,2,0,0,0,0|1,0,0]=3 17130 B12R1.267 Nc1ccccc1COCC=O 34a_100000212039_200009817547 [0,2,0,0,0,0|1,0,1]=4 17131 B12R1.267 Nc1ccccc1COCCF 34a_100000212039_100011217306 [0,2,0,0,0,0|1,0,0]=3 17132 B12R1.267 Nc1ccccc1COCCO 34a_100000212039_100000211926 [0,2,0,0,0,0|1,0,0]=3 17133 B12R1.267 Nc1ccccc1OCCCF 34a_100000185747_100011934791 [0,2,0,0,0,0|1,0,0]=3 17134 B12R1.267 Nc1ccccc1OCCCF 7a_100000185747_100011934791 [0,2,0,0,0,0|1,0,0]=3 17135 B12R1.267 Nc1ccccc1OCCCO 34a_100000185747_100000230001 [0,2,0,0,0,0|1,0,0]=3 17136 B12R1.267 Nc1ccccc1OCCCO 7a_100000185747_100011215043 [0,2,0,0,0,0|1,0,0]=3 17137 B12R1.267 Nc1ccccc1SCCCF 62a_100000210017_100011934791 [0,2,0,0,0,0|1,0,0]=3 17138 B12R1.267 Nc1ccccc1SCCCF 62a_100011934791_100000210017 [0,2,0,0,0,0|1,0,0]=3 17139 B12R1.267 Nc1ccccc1SCCCO 62a_100000210017_100011215043 [0,2,0,0,0,0|1,0,0]=3 17140 B12R1.267 Nc1ccccc1SCCCO 62a_100011215043_100000210017 [0,2,0,0,0,0|1,0,0]=3 17141 B12R1.267 Nc1cccnc1COCCF 34a_114873767017_100011217306 [0,2,0,0,0,0|2,0,0]=4 17142 B12R1.267 Nc1cccnc1COCCO 34a_114873767017_100000211926 [0,2,0,0,0,0|2,0,0]=4 17143 B12R1.267 Nc1cccnc1OCCCF 34a_100000746358_100011934791 [0,2,0,0,0,0|2,0,0]=4 17144 B12R1.267 Nc1cccnc1OCCCO 34a_100000746358_100000230001 [0,2,0,0,0,0|2,0,0]=4 17145 B12R1.267 Nc1cccnc1SCCCF 62a_100000688686_100011934791 [0,2,0,0,0,0|2,0,0]=4 17146 B12R1.267 Nc1cccnc1SCCCF 62a_100011934791_100000688686 [0,2,0,0,0,0|2,0,0]=4 17147 B12R1.267 Nc1cccnc1SCCCO 62a_100000688686_100011215043 [0,2,0,0,0,0|2,0,0]=4 17148 B12R1.267 Nc1cccnc1SCCCO 62a_100011215043_100000688686 [0,2,0,0,0,0|2,0,0]=4 17149 B12R1.267 Nc1ccncc1OCCCF 34a_100000753702_100011934791 [0,2,0,0,0,0|2,0,0]=4 17150 B12R1.267 Nc1ccncc1OCCCO 34a_100000753702_100000230001 [0,2,0,0,0,0|2,0,0]=4 17151 B12R1.267 Nc1ccncc1SCCCF 62a_100000047001_100011934791 [0,2,0,0,0,0|2,0,0]=4 17152 B12R1.267 Nc1ccncc1SCCCF 62a_100011934791_100000047001 [0,2,0,0,0,0|2,0,0]=4 17153 B12R1.267 Nc1ccncc1SCCCO 62a_100000047001_100011215043 [0,2,0,0,0,0|2,0,0]=4 17154 B12R1.267 Nc1ccncc1SCCCO 62a_100011215043_100000047001 [0,2,0,0,0,0|2,0,0]=4 17155 B12R1.267 Nc1cnccc1SCCCF 62a_100000756074_100011934791 [0,2,0,0,0,0|2,0,0]=4 17156 B12R1.267 Nc1cnccc1SCCCF 62a_100011934791_100000756074 [0,2,0,0,0,0|2,0,0]=4 17157 B12R1.267 Nc1cnccc1SCCCO 62a_100000756074_100011215043 [0,2,0,0,0,0|2,0,0]=4 17158 B12R1.267 Nc1cnccc1SCCCO 62a_100011215043_100000756074 [0,2,0,0,0,0|2,0,0]=4 17159 B12R1.267 Nc1ncccc1OCCCF 34a_100000211975_100011934791 [0,2,0,0,0,0|2,0,0]=4 17160 B12R1.267 Nc1ncccc1OCCCF 7a_100000211975_100011934791 [0,2,0,0,0,0|2,0,0]=4 17161 B12R1.267 Nc1ncccc1OCCCO 34a_100000211975_100000230001 [0,2,0,0,0,0|2,0,0]=4 17162 B12R1.267 Nc1ncccc1OCCCO 7a_100000211975_100011215043 [0,2,0,0,0,0|2,0,0]=4 17163 B12R1.267 Nc1ncccc1SCCCF 62a_100000045569_100011934791 [0,2,0,0,0,0|2,0,0]=4 17164 B12R1.267 Nc1ncccc1SCCCF 62a_100011934791_100000045569 [0,2,0,0,0,0|2,0,0]=4 17165 B12R1.267 Nc1ncccc1SCCCO 62a_100000045569_100011215043 [0,2,0,0,0,0|2,0,0]=4 17166 B12R1.267 Nc1ncccc1SCCCO 62a_100011215043_100000045569 [0,2,0,0,0,0|2,0,0]=4 17167 B12R1.267 O=CCNCc1ccccc1Br 2230a_100000689332_200015260668 [0,2,0,0,0,0|1,0,1]=4 17168 B12R1.267 O=CCNCc1ccccc1Br 34a_100000689332_200009817547 [0,2,0,0,0,0|1,0,1]=4 17169 B12R1.267 O=CCNCc1ccccc1Cl 2230a_100000174879_200015260668 [0,2,0,0,0,0|1,0,1]=4 17170 B12R1.267 O=CCNCc1ccccc1Cl 34a_100000174879_200009817547 [0,2,0,0,0,0|1,0,1]=4 17171 B12R1.267 O=CCNCc1ccccc1F 34a_100000174869_200009817547 [0,2,0,0,0,0|1,0,1]=4 17172 B12R1.267 O=CCNCc1ccccc1O 34a_100000185550_200009817547 [0,2,0,0,0,0|0,0,1]=3 17173 B12R1.267 O=CCOCc1ccccc1Br 34a_100000756307_200009817547 [0,2,0,0,0,0|1,0,1]=4 17174 B12R1.267 O=CCOCc1ccccc1Br 7a_100000756307_200015260668 [0,2,0,0,0,0|1,0,1]=4 17175 B12R1.267 O=CCOCc1ccccc1Cl 34a_100000210847_200009817547 [0,2,0,0,0,0|1,0,1]=4 17176 B12R1.267 O=CCOCc1ccccc1Cl 7a_100000210847_200015260668 [0,2,0,0,0,0|1,0,1]=4 17177 B12R1.267 O=CCOCc1ccccc1F 34a_100000211962_200009817547 [0,2,0,0,0,0|1,0,1]=4 17178 B12R1.267 O=CCOCc1ccccc1F 7a_100000211962_200015260668 [0,2,0,0,0,0|1,0,1]=4 17179 B12R1.267 O=CCOCc1ccccc1I 34a_100000187465_200009817547 [0,2,0,0,0,0|1,0,1]=4 17180 B12R1.267 O=CCOCc1ccccc1I 7a_100000187465_200015260668 [0,2,0,0,0,0|1,0,1]=4 17181 B12R1.267 O=CCSCc1ccccc1Br 62a_100000184730_200015260668 [0,2,0,0,0,0|1,0,1]=4 17182 B12R1.267 O=CCSCc1ccccc1Br 62a_200015260668_100000184730 [0,2,0,0,0,0|1,0,1]=4 17183 B12R1.267 O=CCSCc1ccccc1Cl 62a_100000187162_200015260668 [0,2,0,0,0,0|1,0,1]=4 17184 B12R1.267 O=CCSCc1ccccc1Cl 62a_200015260668_100000187162 [0,2,0,0,0,0|1,0,1]=4 17185 B12R1.267 O=CCSCc1ccccc1F 62a_100000211605_200015260668 [0,2,0,0,0,0|1,0,1]=4 17186 B12R1.267 O=CCSCc1ccccc1F 62a_200015260668_100000211605 [0,2,0,0,0,0|1,0,1]=4 17187 B12R1.267 O=CCSCc1ccccc1I 62a_100011216222_200015260668 [0,2,0,0,0,0|1,0,1]=4 17188 B12R1.267 O=CCSCc1ccccc1I 62a_200015260668_100011216222 [0,2,0,0,0,0|1,0,1]=4 17189 B12R1.267 O=CCSCc1ncccc1O 62a_200015260668_200020655725 [0,2,0,0,0,0|1,0,1]=4 17190 B12R1.267 O=CCSCc1ncccc1O 62a_200020655725_200015260668 [0,2,0,0,0,0|1,0,1]=4 17191 B12R1.267 O=c1cc[nH]cc1SCCCF 62a_100009998708_100011934791 [0,2,0,0,0,0|1,0,1]=4 17192 B12R1.267 O=c1cc[nH]cc1SCCCF 62a_100011934791_100009998708 [0,2,0,0,0,0|1,0,1]=4 17193 B12R1.267 O=c1cc[nH]cc1SCCCO 62a_100009998708_100011215043 [0,2,0,0,0,0|1,0,1]=4 17194 B12R1.267 O=c1cc[nH]cc1SCCCO 62a_100011215043_100009998708 [0,2,0,0,0,0|1,0,1]=4 17195 B12R1.267 O=c1ccocc1OCCCF 34a_100000060831_100011934791 [0,2,0,0,0,0|1,0,1]=4 17196 B12R1.267 O=c1ccocc1OCCCO 34a_100000060831_100000230001 [0,2,0,0,0,0|1,0,1]=4 17197 B12R1.267 O=c1occcc1OCCCF 34a_100000077404_100011934791 [0,2,0,0,0,0|1,0,1]=4 17198 B12R1.267 O=c1occcc1OCCCF 7a_100000077404_100011934791 [0,2,0,0,0,0|1,0,1]=4 17199 B12R1.267 O=c1occcc1OCCCO 34a_100000077404_100000230001 [0,2,0,0,0,0|1,0,1]=4 17200 B12R1.267 O=c1occcc1OCCCO 7a_100000077404_100011215043 [0,2,0,0,0,0|1,0,1]=4 17201 B12R1.267 OCCCCc1ccccc1O 271570a_203496583355_100012092669 [0,2,0,0,0,0|0,0,0]=2 17202 B12R1.267 OCCCNc1ccccc1Br 34a_100000210017_100000230001 [0,2,0,0,0,0|1,0,0]=3 17203 B12R1.267 OCCCNc1ccccc1Cl 34a_100000185783_100000230001 [0,2,0,0,0,0|1,0,0]=3 17204 B12R1.267 OCCCNc1ccccc1F 34a_100000210422_100000230001 [0,2,0,0,0,0|1,0,0]=3 17205 B12R1.267 OCCCNc1ccccc1I 34a_100000210053_100000230001 [0,2,0,0,0,0|1,0,0]=3 17206 B12R1.267 OCCCNc1ccccc1O 34a_100000185747_100000230001 [0,2,0,0,0,0|0,0,0]=2 17207 B12R1.267 OCCCNc1ccncc1Br 27a_100000182051_100000726257 [0,2,0,0,0,0|2,0,0]=4 17208 B12R1.267 OCCCNc1ccncc1F 27a_100000182051_100000035921 [0,2,0,0,0,0|2,0,0]=4 17209 B12R1.267 OCCCNc1ncccc1Br 27a_100000182051_100000696092 [0,2,0,0,0,0|2,0,0]=4 17210 B12R1.267 OCCCOc1ccccc1Br 34a_100000181306_100000230001 [0,2,0,0,0,0|1,0,0]=3 17211 B12R1.267 OCCCOc1ccccc1Br 7a_100000181306_100011215043 [0,2,0,0,0,0|1,0,0]=3 17212 B12R1.267 OCCCOc1ccccc1Cl 34a_100000210172_100000230001 [0,2,0,0,0,0|1,0,0]=3 17213 B12R1.267 OCCCOc1ccccc1Cl 7a_100000210172_100011215043 [0,2,0,0,0,0|1,0,0]=3 17214 B12R1.267 OCCCOc1ccccc1F 34a_100000210171_100000230001 [0,2,0,0,0,0|1,0,0]=3 17215 B12R1.267 OCCCOc1ccccc1F 7a_100000210171_100011215043 [0,2,0,0,0,0|1,0,0]=3 17216 B12R1.267 OCCCOc1ccccc1I 34a_100000739446_100000230001 [0,2,0,0,0,0|1,0,0]=3 17217 B12R1.267 OCCCOc1ccccc1I 7a_100000739446_100011215043 [0,2,0,0,0,0|1,0,0]=3 17218 B12R1.267 OCCCOc1cccnc1Br 34a_100000744436_100000230001 [0,2,0,0,0,0|2,0,0]=4 17219 B12R1.267 OCCCOc1cccnc1Br 7a_100000744436_100011215043 [0,2,0,0,0,0|2,0,0]=4 17220 B12R1.267 OCCCOc1cccnc1Cl 34a_100000757616_100000230001 [0,2,0,0,0,0|2,0,0]=4 17221 B12R1.267 OCCCOc1cccnc1Cl 7a_100000757616_100011215043 [0,2,0,0,0,0|2,0,0]=4 17222 B12R1.267 OCCCOc1cccnc1F 34a_100000061740_100000230001 [0,2,0,0,0,0|2,0,0]=4 17223 B12R1.267 OCCCOc1cccnc1F 7a_100000061740_100011215043 [0,2,0,0,0,0|2,0,0]=4 17224 B12R1.267 OCCCOc1cccnc1I 34a_100000034122_100000230001 [0,2,0,0,0,0|2,0,0]=4 17225 B12R1.267 OCCCOc1cccnc1I 7a_100000034122_100011215043 [0,2,0,0,0,0|2,0,0]=4 17226 B12R1.267 OCCCOc1ccncc1Br 34a_100011996408_100000230001 [0,2,0,0,0,0|2,0,0]=4 17227 B12R1.267 OCCCOc1ccncc1Cl 34a_100011997054_100000230001 [0,2,0,0,0,0|2,0,0]=4 17228 B12R1.267 OCCCOc1ccncc1F 34a_200000081243_100000230001 [0,2,0,0,0,0|2,0,0]=4 17229 B12R1.267 OCCCOc1cnccc1Cl 34a_100011996695_100000230001 [0,2,0,0,0,0|2,0,0]=4 17230 B12R1.267 OCCCOc1cnccc1I 34a_100000050107_100000230001 [0,2,0,0,0,0|2,0,0]=4 17231 B12R1.267 OCCCOc1ncccc1Cl 34a_100011290957_100000230001 [0,2,0,0,0,0|2,0,0]=4 17232 B12R1.267 OCCCOc1ncccc1F 34a_100011219419_100000230001 [0,2,0,0,0,0|2,0,0]=4 17233 B12R1.267 OCCCSc1c[nH]ccc1=S 62a_100011215043_200012280681 [0,2,0,0,0,0|1,1,0]=4 17234 B12R1.267 OCCCSc1c[nH]ccc1=S 62a_200012280681_100011215043 [0,2,0,0,0,0|1,1,0]=4 17235 B12R1.267 OCCCSc1ccccc1Br 62a_100000695589_100011215043 [0,2,0,0,0,0|1,0,0]=3 17236 B12R1.267 OCCCSc1ccccc1Br 62a_100011215043_100000695589 [0,2,0,0,0,0|1,0,0]=3 17237 B12R1.267 OCCCSc1ccccc1Cl 62a_100000764095_100011215043 [0,2,0,0,0,0|1,0,0]=3 17238 B12R1.267 OCCCSc1ccccc1Cl 62a_100011215043_100000764095 [0,2,0,0,0,0|1,0,0]=3 17239 B12R1.267 OCCCSc1ccccc1F 62a_100011215043_100011215700 [0,2,0,0,0,0|1,0,0]=3 17240 B12R1.267 OCCCSc1ccccc1F 62a_100011215700_100011215043 [0,2,0,0,0,0|1,0,0]=3 17241 B12R1.267 OCCCSc1ccccc1O 62a_100000739446_100011215043 [0,2,0,0,0,0|0,0,0]=2 17242 B12R1.267 OCCCSc1ccccc1O 62a_100011215043_100000739446 [0,2,0,0,0,0|0,0,0]=2 17243 B12R1.267 OCCCSc1cccnc1Br 62a_100010202626_100011215043 [0,2,0,0,0,0|2,0,0]=4 17244 B12R1.267 OCCCSc1cccnc1Br 62a_100011215043_100010202626 [0,2,0,0,0,0|2,0,0]=4 17245 B12R1.267 OCCCSc1cccnc1Cl 62a_100000036424_100011215043 [0,2,0,0,0,0|2,0,0]=4 17246 B12R1.267 OCCCSc1cccnc1Cl 62a_100011215043_100000036424 [0,2,0,0,0,0|2,0,0]=4 17247 B12R1.267 OCCCSc1cccnc1F 62a_100009816115_100011215043 [0,2,0,0,0,0|2,0,0]=4 17248 B12R1.267 OCCCSc1cccnc1F 62a_100011215043_100009816115 [0,2,0,0,0,0|2,0,0]=4 17249 B12R1.267 OCCCSc1cccnc1O 62a_100000760158_100011215043 [0,2,0,0,0,0|1,0,0]=3 17250 B12R1.267 OCCCSc1cccnc1O 62a_100011215043_100000760158 [0,2,0,0,0,0|1,0,0]=3 17251 B12R1.267 OCCCSc1ccncc1Br 62a_100000726257_100011215043 [0,2,0,0,0,0|2,0,0]=4 17252 B12R1.267 OCCCSc1ccncc1Br 62a_100011215043_100000726257 [0,2,0,0,0,0|2,0,0]=4 17253 B12R1.267 OCCCSc1ccncc1Cl 62a_100000708259_100011215043 [0,2,0,0,0,0|2,0,0]=4 17254 B12R1.267 OCCCSc1ccncc1Cl 62a_100011215043_100000708259 [0,2,0,0,0,0|2,0,0]=4 17255 B12R1.267 OCCCSc1ccncc1F 62a_100000047030_100011215043 [0,2,0,0,0,0|2,0,0]=4 17256 B12R1.267 OCCCSc1ccncc1F 62a_100011215043_100000047030 [0,2,0,0,0,0|2,0,0]=4 17257 B12R1.267 OCCCSc1ccncc1O 62a_100009817591_100011215043 [0,2,0,0,0,0|1,0,0]=3 17258 B12R1.267 OCCCSc1ccncc1O 62a_100011215043_100009817591 [0,2,0,0,0,0|1,0,0]=3 17259 B12R1.267 OCCCSc1cnccc1Br 62a_100010138639_100011215043 [0,2,0,0,0,0|2,0,0]=4 17260 B12R1.267 OCCCSc1cnccc1Br 62a_100011215043_100010138639 [0,2,0,0,0,0|2,0,0]=4 17261 B12R1.267 OCCCSc1cnccc1Cl 62a_100009995489_100011215043 [0,2,0,0,0,0|2,0,0]=4 17262 B12R1.267 OCCCSc1cnccc1Cl 62a_100011215043_100009995489 [0,2,0,0,0,0|2,0,0]=4 17263 B12R1.267 OCCCSc1cnccc1F 62a_100009820683_100011215043 [0,2,0,0,0,0|2,0,0]=4 17264 B12R1.267 OCCCSc1cnccc1F 62a_100011215043_100009820683 [0,2,0,0,0,0|2,0,0]=4 17265 B12R1.267 OCCCSc1cncnc1O 62a_100000751107_100011215043 [0,2,0,0,0,0|2,0,0]=4 17266 B12R1.267 OCCCSc1cncnc1O 62a_100011215043_100000751107 [0,2,0,0,0,0|2,0,0]=4 17267 B12R1.267 OCCCSc1ncccc1Br 62a_100000696092_100011215043 [0,2,0,0,0,0|2,0,0]=4 17268 B12R1.267 OCCCSc1ncccc1Br 62a_100011215043_100000696092 [0,2,0,0,0,0|2,0,0]=4 17269 B12R1.267 OCCCSc1ncccc1Cl 62a_100011215043_100011356963 [0,2,0,0,0,0|2,0,0]=4 17270 B12R1.267 OCCCSc1ncccc1Cl 62a_100011356963_100011215043 [0,2,0,0,0,0|2,0,0]=4 17271 B12R1.267 OCCCSc1ncccc1F 62a_100000685392_100011215043 [0,2,0,0,0,0|2,0,0]=4 17272 B12R1.267 OCCCSc1ncccc1F 62a_100011215043_100000685392 [0,2,0,0,0,0|2,0,0]=4 17273 B12R1.267 OCCCSc1ncccc1O 62a_100000034122_100011215043 [0,2,0,0,0,0|1,0,0]=3 17274 B12R1.267 OCCCSc1ncccc1O 62a_100011215043_100000034122 [0,2,0,0,0,0|1,0,0]=3 17275 B12R1.267 OCCNCc1ccccc1Br 207a_100000210304_100000211189 [0,2,0,0,0,0|1,0,0]=3 17276 B12R1.267 OCCNCc1ccccc1Br 2230a_100000689332_100000211926 [0,2,0,0,0,0|1,0,0]=3 17277 B12R1.267 OCCNCc1ccccc1Br 2230a_100016997473_100000184730 [0,2,0,0,0,0|1,0,0]=3 17278 B12R1.267 OCCNCc1ccccc1Br 270004a_100000210304_100000211189 [0,2,0,0,0,0|1,0,0]=3 17279 B12R1.267 OCCNCc1ccccc1Br 34a_100000689332_100000211926 [0,2,0,0,0,0|1,0,0]=3 17280 B12R1.267 OCCNCc1ccccc1Br 34a_100016990907_100000184730 [0,2,0,0,0,0|1,0,0]=3 17281 B12R1.267 OCCNCc1ccccc1Cl 207a_100000210304_100000210073 [0,2,0,0,0,0|1,0,0]=3 17282 B12R1.267 OCCNCc1ccccc1Cl 2230a_100000174879_100000211926 [0,2,0,0,0,0|1,0,0]=3 17283 B12R1.267 OCCNCc1ccccc1Cl 2230a_100016997473_100000187162 [0,2,0,0,0,0|1,0,0]=3 17284 B12R1.267 OCCNCc1ccccc1Cl 270004a_100000210304_100000210073 [0,2,0,0,0,0|1,0,0]=3 17285 B12R1.267 OCCNCc1ccccc1Cl 34a_100000174879_100000211926 [0,2,0,0,0,0|1,0,0]=3 17286 B12R1.267 OCCNCc1ccccc1Cl 34a_100016990907_100000187162 [0,2,0,0,0,0|1,0,0]=3 17287 B12R1.267 OCCNCc1ccccc1F 207a_100000210304_100000210811 [0,2,0,0,0,0|1,0,0]=3 17288 B12R1.267 OCCNCc1ccccc1F 2230a_100016997473_100000211605 [0,2,0,0,0,0|1,0,0]=3 17289 B12R1.267 OCCNCc1ccccc1F 270004a_100000210304_100000210811 [0,2,0,0,0,0|1,0,0]=3 17290 B12R1.267 OCCNCc1ccccc1F 34a_100000174869_100000211926 [0,2,0,0,0,0|1,0,0]=3 17291 B12R1.267 OCCNCc1ccccc1F 34a_100016990907_100000211605 [0,2,0,0,0,0|1,0,0]=3 17292 B12R1.267 OCCNCc1ccccc1I 207a_100000210304_100000010305 [0,2,0,0,0,0|1,0,0]=3 17293 B12R1.267 OCCNCc1ccccc1I 2230a_100016997473_100011215278 [0,2,0,0,0,0|1,0,0]=3 17294 B12R1.267 OCCNCc1ccccc1I 270004a_100000210304_100000010305 [0,2,0,0,0,0|1,0,0]=3 17295 B12R1.267 OCCNCc1ccccc1I 34a_100016990907_100011215278 [0,2,0,0,0,0|1,0,0]=3 17296 B12R1.267 OCCNCc1ccccc1O 271570a_203496583355_106744479749 [0,2,0,0,0,0|0,0,0]=2 17297 B12R1.267 OCCNCc1ccccc1O 34a_100000185550_100000211926 [0,2,0,0,0,0|0,0,0]=2 17298 B12R1.267 OCCNCc1cccnc1Br 2230a_100009818023_100000211926 [0,2,0,0,0,0|2,0,0]=4 17299 B12R1.267 OCCNCc1cccnc1Br 2230a_100016997473_100010140945 [0,2,0,0,0,0|2,0,0]=4 17300 B12R1.267 OCCNCc1cccnc1Br 34a_100009818023_100000211926 [0,2,0,0,0,0|2,0,0]=4 17301 B12R1.267 OCCNCc1cccnc1Br 34a_100016990907_100010140945 [0,2,0,0,0,0|2,0,0]=4 17302 B12R1.267 OCCNCc1cccnc1Cl 2230a_100015189234_100000211926 [0,2,0,0,0,0|2,0,0]=4 17303 B12R1.267 OCCNCc1cccnc1Cl 2230a_100016997473_100000045678 [0,2,0,0,0,0|2,0,0]=4 17304 B12R1.267 OCCNCc1cccnc1Cl 34a_100015189234_100000211926 [0,2,0,0,0,0|2,0,0]=4 17305 B12R1.267 OCCNCc1cccnc1Cl 34a_100016990907_100000045678 [0,2,0,0,0,0|2,0,0]=4 17306 B12R1.267 OCCNCc1cccnc1F 2230a_100016997473_100000099810 [0,2,0,0,0,0|2,0,0]=4 17307 B12R1.267 OCCNCc1cccnc1F 34a_100000724633_100000211926 [0,2,0,0,0,0|2,0,0]=4 17308 B12R1.267 OCCNCc1cccnc1F 34a_100016990907_100000099810 [0,2,0,0,0,0|2,0,0]=4 17309 B12R1.267 OCCNCc1cccnc1O 207a_100000210304_100011998315 [0,2,0,0,0,0|1,0,0]=3 17310 B12R1.267 OCCNCc1cccnc1O 270004a_100000210304_100011998315 [0,2,0,0,0,0|1,0,0]=3 17311 B12R1.267 OCCNCc1ccncc1Br 270004a_100000210304_100000755692 [0,2,0,0,0,0|2,0,0]=4 17312 B12R1.267 OCCNCc1ccncc1Cl 207a_100000210304_100011934409 [0,2,0,0,0,0|2,0,0]=4 17313 B12R1.267 OCCNCc1ccncc1Cl 2230a_100016997473_100000763264 [0,2,0,0,0,0|2,0,0]=4 17314 B12R1.267 OCCNCc1ccncc1Cl 270004a_100000210304_100011934409 [0,2,0,0,0,0|2,0,0]=4 17315 B12R1.267 OCCNCc1ccncc1F 34a_100011935246_100000211926 [0,2,0,0,0,0|2,0,0]=4 17316 B12R1.267 OCCNCc1cnccc1Br 270004a_100000210304_100009816821 [0,2,0,0,0,0|2,0,0]=4 17317 B12R1.267 OCCNCc1cnccc1Cl 270004a_100000210304_100000050567 [0,2,0,0,0,0|2,0,0]=4 17318 B12R1.267 OCCNCc1ncccc1Br 207a_100000210304_100011934733 [0,2,0,0,0,0|2,0,0]=4 17319 B12R1.267 OCCNCc1ncccc1Br 2230a_100016997473_100025702911 [0,2,0,0,0,0|2,0,0]=4 17320 B12R1.267 OCCNCc1ncccc1Br 270004a_100000210304_100011934733 [0,2,0,0,0,0|2,0,0]=4 17321 B12R1.267 OCCNCc1ncccc1Br 34a_100016990907_100025702911 [0,2,0,0,0,0|2,0,0]=4 17322 B12R1.267 OCCNCc1ncccc1Cl 207a_100000210304_100012001307 [0,2,0,0,0,0|2,0,0]=4 17323 B12R1.267 OCCNCc1ncccc1Cl 2230a_100015189233_100000211926 [0,2,0,0,0,0|2,0,0]=4 17324 B12R1.267 OCCNCc1ncccc1Cl 2230a_100016997473_100000099807 [0,2,0,0,0,0|2,0,0]=4 17325 B12R1.267 OCCNCc1ncccc1Cl 270004a_100000210304_100012001307 [0,2,0,0,0,0|2,0,0]=4 17326 B12R1.267 OCCNCc1ncccc1F 207a_100000210304_100011934734 [0,2,0,0,0,0|2,0,0]=4 17327 B12R1.267 OCCNCc1ncccc1F 2230a_100016997473_100000104219 [0,2,0,0,0,0|2,0,0]=4 17328 B12R1.267 OCCNCc1ncccc1F 270004a_100000210304_100011934734 [0,2,0,0,0,0|2,0,0]=4 17329 B12R1.267 OCCNCc1ncccc1F 34a_100000690088_100000211926 [0,2,0,0,0,0|2,0,0]=4 17330 B12R1.267 OCCNCc1ncccc1F 34a_100016990907_100000104219 [0,2,0,0,0,0|2,0,0]=4 17331 B12R1.267 OCCNCc1ncccc1O 34a_100016990907_200020655725 [0,2,0,0,0,0|1,0,0]=3 17332 B12R1.267 OCCOCc1ccccc1Br 34a_100000756307_100000211926 [0,2,0,0,0,0|1,0,0]=3 17333 B12R1.267 OCCOCc1ccccc1Br 7a_100000756307_100000211926 [0,2,0,0,0,0|1,0,0]=3 17334 B12R1.267 OCCOCc1ccccc1Cl 34a_100000210847_100000211926 [0,2,0,0,0,0|1,0,0]=3 17335 B12R1.267 OCCOCc1ccccc1Cl 7a_100000210847_100000211926 [0,2,0,0,0,0|1,0,0]=3 17336 B12R1.267 OCCOCc1ccccc1F 34a_100000211962_100000211926 [0,2,0,0,0,0|1,0,0]=3 17337 B12R1.267 OCCOCc1ccccc1F 7a_100000211962_100000211926 [0,2,0,0,0,0|1,0,0]=3 17338 B12R1.267 OCCOCc1ccccc1I 34a_100000187465_100000211926 [0,2,0,0,0,0|1,0,0]=3 17339 B12R1.267 OCCOCc1ccccc1I 7a_100000187465_100000211926 [0,2,0,0,0,0|1,0,0]=3 17340 B12R1.267 OCCOCc1cccnc1Br 34a_100000719692_100000211926 [0,2,0,0,0,0|2,0,0]=4 17341 B12R1.267 OCCOCc1cccnc1Br 7a_100000719692_100000211926 [0,2,0,0,0,0|2,0,0]=4 17342 B12R1.267 OCCOCc1cccnc1Cl 34a_100000748726_100000211926 [0,2,0,0,0,0|2,0,0]=4 17343 B12R1.267 OCCOCc1cccnc1Cl 7a_100000748726_100000211926 [0,2,0,0,0,0|2,0,0]=4 17344 B12R1.267 OCCOCc1cccnc1F 34a_100000079888_100000211926 [0,2,0,0,0,0|2,0,0]=4 17345 B12R1.267 OCCOCc1cccnc1F 7a_100000079888_100000211926 [0,2,0,0,0,0|2,0,0]=4 17346 B12R1.267 OCCOCc1ccncc1F 34a_100012172863_100000211926 [0,2,0,0,0,0|2,0,0]=4 17347 B12R1.267 OCCOCc1cnccc1Cl 34a_100000117392_100000211926 [0,2,0,0,0,0|2,0,0]=4 17348 B12R1.267 OCCOCc1ncccc1Br 34a_100011996772_100000211926 [0,2,0,0,0,0|2,0,0]=4 17349 B12R1.267 OCCOCc1ncccc1Cl 34a_100012002383_100000211926 [0,2,0,0,0,0|2,0,0]=4 17350 B12R1.267 OCCOCc1ncccc1F 34a_100011934865_100000211926 [0,2,0,0,0,0|2,0,0]=4 17351 B12R1.267 OCCSCc1ccccc1Br 62a_100000184730_100000211926 [0,2,0,0,0,0|1,0,0]=3 17352 B12R1.267 OCCSCc1ccccc1Br 62a_100000211926_100000184730 [0,2,0,0,0,0|1,0,0]=3 17353 B12R1.267 OCCSCc1ccccc1Cl 62a_100000187162_100000211926 [0,2,0,0,0,0|1,0,0]=3 17354 B12R1.267 OCCSCc1ccccc1Cl 62a_100000211926_100000187162 [0,2,0,0,0,0|1,0,0]=3 17355 B12R1.267 OCCSCc1ccccc1F 62a_100000211605_100000211926 [0,2,0,0,0,0|1,0,0]=3 17356 B12R1.267 OCCSCc1ccccc1F 62a_100000211926_100000211605 [0,2,0,0,0,0|1,0,0]=3 17357 B12R1.267 OCCSCc1ccccc1I 62a_100000211926_100011216222 [0,2,0,0,0,0|1,0,0]=3 17358 B12R1.267 OCCSCc1ccccc1I 62a_100011216222_100000211926 [0,2,0,0,0,0|1,0,0]=3 17359 B12R1.267 OCCSCc1cccnc1Br 62a_100000211926_100010140945 [0,2,0,0,0,0|2,0,0]=4 17360 B12R1.267 OCCSCc1cccnc1Br 62a_100010140945_100000211926 [0,2,0,0,0,0|2,0,0]=4 17361 B12R1.267 OCCSCc1cccnc1Cl 62a_100000045678_100000211926 [0,2,0,0,0,0|2,0,0]=4 17362 B12R1.267 OCCSCc1cccnc1Cl 62a_100000211926_100000045678 [0,2,0,0,0,0|2,0,0]=4 17363 B12R1.267 OCCSCc1cccnc1F 62a_100000099810_100000211926 [0,2,0,0,0,0|2,0,0]=4 17364 B12R1.267 OCCSCc1cccnc1F 62a_100000211926_100000099810 [0,2,0,0,0,0|2,0,0]=4 17365 B12R1.267 OCCSCc1ccncc1Cl 62a_100000211926_100000763264 [0,2,0,0,0,0|2,0,0]=4 17366 B12R1.267 OCCSCc1ccncc1Cl 62a_100000763264_100000211926 [0,2,0,0,0,0|2,0,0]=4 17367 B12R1.267 OCCSCc1ncccc1Br 62a_100000211926_100025702911 [0,2,0,0,0,0|2,0,0]=4 17368 B12R1.267 OCCSCc1ncccc1Br 62a_100025702911_100000211926 [0,2,0,0,0,0|2,0,0]=4 17369 B12R1.267 OCCSCc1ncccc1Cl 62a_100000099807_100000211926 [0,2,0,0,0,0|2,0,0]=4 17370 B12R1.267 OCCSCc1ncccc1Cl 62a_100000211926_100000099807 [0,2,0,0,0,0|2,0,0]=4 17371 B12R1.267 OCCSCc1ncccc1F 62a_100000104219_100000211926 [0,2,0,0,0,0|2,0,0]=4 17372 B12R1.267 OCCSCc1ncccc1F 62a_100000211926_100000104219 [0,2,0,0,0,0|2,0,0]=4 17373 B12R1.267 OCCSCc1ncccc1O 62a_100000211926_200020655725 [0,2,0,0,0,0|1,0,0]=3 17374 B12R1.267 OCCSCc1ncccc1O 62a_200020655725_100000211926 [0,2,0,0,0,0|1,0,0]=3 17375 B12R1.267 Oc1ccccc1CCNCF 34a_100011207237_100015361967 [0,2,0,0,0,0|0,0,0]=2 17376 B12R1.267 Oc1ccccc1CCSCF 62a_100000722297_100015361967 [0,2,0,0,0,0|0,0,0]=2 17377 B12R1.267 Oc1ccccc1CCSCF 62a_100015361967_100000722297 [0,2,0,0,0,0|0,0,0]=2 17378 B12R1.267 Oc1ccccc1CNCCF 34a_100000185550_100011217306 [0,2,0,0,0,0|0,0,0]=2 17379 B12R1.267 Oc1ccccc1NCCCF 34a_100000185747_100011934791 [0,2,0,0,0,0|0,0,0]=2 17380 B12R1.267 Oc1ccccc1SCCCF 62a_100000739446_100011934791 [0,2,0,0,0,0|0,0,0]=2 17381 B12R1.267 Oc1ccccc1SCCCF 62a_100011934791_100000739446 [0,2,0,0,0,0|0,0,0]=2 17382 B12R1.267 Oc1cccnc1CNCCF 34a_100000724931_200020655725 [0,2,0,0,0,0|1,0,0]=3 17383 B12R1.267 Oc1cccnc1COCCBr 34a_100000211926_200020655725 [0,2,0,0,0,0|1,0,0]=3 17384 B12R1.267 Oc1cccnc1CSCCF 62a_100011217306_200020655725 [0,2,0,0,0,0|1,0,0]=3 17385 B12R1.267 Oc1cccnc1CSCCF 62a_200020655725_100011217306 [0,2,0,0,0,0|1,0,0]=3 17386 B12R1.267 Oc1cccnc1SCCCF 62a_100000034122_100011934791 [0,2,0,0,0,0|1,0,0]=3 17387 B12R1.267 Oc1cccnc1SCCCF 62a_100011934791_100000034122 [0,2,0,0,0,0|1,0,0]=3 17388 B12R1.267 Oc1cnccc1SCCCF 62a_100009817591_100011934791 [0,2,0,0,0,0|1,0,0]=3 17389 B12R1.267 Oc1cnccc1SCCCF 62a_100011934791_100009817591 [0,2,0,0,0,0|1,0,0]=3 17390 B12R1.267 Oc1ncccc1SCCCF 62a_100000760158_100011934791 [0,2,0,0,0,0|1,0,0]=3 17391 B12R1.267 Oc1ncccc1SCCCF 62a_100011934791_100000760158 [0,2,0,0,0,0|1,0,0]=3 17392 B12R1.267 Oc1ncncc1SCCCF 62a_100000751107_100011934791 [0,2,0,0,0,0|2,0,0]=4 17393 B12R1.267 Oc1ncncc1SCCCF 62a_100011934791_100000751107 [0,2,0,0,0,0|2,0,0]=4 17394 B12R1.267 [13CH3]NCCCc1ccccc1F 2230a_100000724733_200025704644 [0,2,0,0,0,0|1,0,0]=3 17395 B12R1.267 [13CH3]NCCCc1ccccc1F 34a_100000724733_200025704644 [0,2,0,0,0,0|1,0,0]=3 17396 B12R1.267 [13CH3]NCCOc1ccccc1Br 2230a_100000744007_200025704644 [0,2,0,0,0,0|1,0,0]=3 17397 B12R1.267 [13CH3]NCCOc1ccccc1Br 34a_100000744007_200025704644 [0,2,0,0,0,0|1,0,0]=3 17398 B12R1.267 [13CH3]NCCOc1ccccc1Cl 2230a_100000174932_200025704644 [0,2,0,0,0,0|1,0,0]=3 17399 B12R1.267 [13CH3]NCCOc1ccccc1Cl 34a_100000174932_200025704644 [0,2,0,0,0,0|1,0,0]=3 17400 B12R1.267 [13CH3]NCCOc1ccccc1F 2230a_100000683764_200025704644 [0,2,0,0,0,0|1,0,0]=3 17401 B12R1.267 [13CH3]NCCOc1ccccc1F 34a_100000683764_200025704644 [0,2,0,0,0,0|1,0,0]=3 17402 B12R1.267 [13CH3]OCC#Cc1ccccc1Br 34a_100009814404_200025704644 [0,2,0,0,0,0|1,0,1]=4 17403 B12R1.267 [13CH3]OCC#Cc1ccccc1Br 7a_100009814404_200025704644 [0,2,0,0,0,0|1,0,1]=4 17404 B12R1.267 [13CH3]OCC#Cc1ccccc1Cl 34a_100011219350_200025704644 [0,2,0,0,0,0|1,0,1]=4 17405 B12R1.267 [13CH3]OCC#Cc1ccccc1Cl 7a_100011219350_200025704644 [0,2,0,0,0,0|1,0,1]=4 17406 B12R1.267 [13CH3]OCC#Cc1ccccc1F 34a_100011219114_200025704644 [0,2,0,0,0,0|1,0,1]=4 17407 B12R1.267 [13CH3]OCC#Cc1ccccc1F 7a_100011219114_200025704644 [0,2,0,0,0,0|1,0,1]=4 17408 B12R1.267 [13CH3]OCCCc1ccccc1Br 34a_100000699526_200025704644 [0,2,0,0,0,0|1,0,0]=3 17409 B12R1.267 [13CH3]OCCCc1ccccc1Br 7a_100000699526_200025704644 [0,2,0,0,0,0|1,0,0]=3 17410 B12R1.267 [13CH3]OCCCc1ccccc1Cl 34a_100011709251_200025704644 [0,2,0,0,0,0|1,0,0]=3 17411 B12R1.267 [13CH3]OCCCc1ccccc1Cl 7a_100011709251_200025704644 [0,2,0,0,0,0|1,0,0]=3 17412 B12R1.267 [13CH3]OCCCc1ccccc1F 34a_100011709249_200025704644 [0,2,0,0,0,0|1,0,0]=3 17413 B12R1.267 [13CH3]OCCCc1ccccc1F 7a_100011709249_200025704644 [0,2,0,0,0,0|1,0,0]=3 17414 B12R1.267 [13CH3]OCCNc1ccccc1N 34a_100000683943_200025704644 [0,2,0,0,0,0|1,0,0]=3 17415 B12R1.267 [13CH3]OCCOc1ccccc1Br 34a_100000230753_200025704644 [0,2,0,0,0,0|1,0,0]=3 17416 B12R1.267 [13CH3]OCCOc1ccccc1Br 7a_100000230753_200025704644 [0,2,0,0,0,0|1,0,0]=3 17417 B12R1.267 [13CH3]OCCOc1ccccc1Cl 34a_200000230518_200025704644 [0,2,0,0,0,0|1,0,0]=3 17418 B12R1.267 [13CH3]OCCOc1ccccc1Cl 7a_200000230518_200025704644 [0,2,0,0,0,0|1,0,0]=3 17419 B12R1.267 [13CH3]OCCOc1ccccc1F 34a_100000756447_200025704644 [0,2,0,0,0,0|1,0,0]=3 17420 B12R1.267 [13CH3]OCCOc1ccccc1F 7a_100000756447_200025704644 [0,2,0,0,0,0|1,0,0]=3 17421 B12R1.267 [13CH3]OCCOc1ccccc1N 34a_100132302172_200025704644 [0,2,0,0,0,0|1,0,0]=3 17422 B12R1.267 [13CH3]OCCSc1ccccc1Br 34a_200000230852_200025704644 [0,2,0,0,0,0|1,0,0]=3 17423 B12R1.267 [13CH3]OCCSc1ccccc1Br 7a_200000230852_200025704644 [0,2,0,0,0,0|1,0,0]=3 17424 B12R1.267 [13CH3]OCCSc1ccccc1Cl 34a_200000230572_200025704644 [0,2,0,0,0,0|1,0,0]=3 17425 B12R1.267 [13CH3]OCCSc1ccccc1Cl 7a_200000230572_200025704644 [0,2,0,0,0,0|1,0,0]=3 17426 B12R1.267 [13CH3]OCCSc1ccccc1F 34a_200000230732_200025704644 [0,2,0,0,0,0|1,0,0]=3 17427 B12R1.267 [13CH3]OCCSc1ccccc1F 7a_200000230732_200025704644 [0,2,0,0,0,0|1,0,0]=3 17428 B12R1.267 [13CH3]SCC#Cc1ccccc1Br 62a_100010706765_200025704644 [0,2,0,0,0,0|1,0,1]=4 17429 B12R1.267 [13CH3]SCC#Cc1ccccc1Br 62a_200025704644_100010706765 [0,2,0,0,0,0|1,0,1]=4 17430 B12R1.267 [13CH3]SCC#Cc1ccccc1F 62a_100010404167_200025704644 [0,2,0,0,0,0|1,0,1]=4 17431 B12R1.267 [13CH3]SCC#Cc1ccccc1F 62a_200025704644_100010404167 [0,2,0,0,0,0|1,0,1]=4 17432 B12R1.267 [13CH3]SCCCc1ccccc1Br 62a_200011713681_200025704644 [0,2,0,0,0,0|1,0,0]=3 17433 B12R1.267 [13CH3]SCCCc1ccccc1Br 62a_200025704644_200011713681 [0,2,0,0,0,0|1,0,0]=3 17434 B12R1.267 [13CH3]SCCOc1ccccc1Br 62a_100000695877_200025704644 [0,2,0,0,0,0|1,0,0]=3 17435 B12R1.267 [13CH3]SCCOc1ccccc1Br 62a_200025704644_100000695877 [0,2,0,0,0,0|1,0,0]=3 17436 B12R1.267 [13CH3]SCCOc1ccccc1F 62a_100000183290_200025704644 [0,2,0,0,0,0|1,0,0]=3 17437 B12R1.267 [13CH3]SCCOc1ccccc1F 62a_200025704644_100000183290 [0,2,0,0,0,0|1,0,0]=3 17438 B12R1.267 [O-][n+]1ccccc1OCCCF 7a_100000211761_100011934791 [0,2,0,0,0,0|1,0,1]=4 17439 B12R1.267 [O-][n+]1ccccc1OCCCO 7a_100000211761_100011215043 [0,2,0,0,0,0|1,0,1]=4 17440 B12R1.267 [O-][n+]1ccccc1SCCCF 62a_100011934791_200000042595 [0,2,0,0,0,0|1,0,1]=4 17441 B12R1.267 [O-][n+]1ccccc1SCCCO 62a_100011215043_200000042595 [0,2,0,0,0,0|1,0,1]=4 17442 B12R1.308 C#CCC(=O)c1ccccc1O 1458a_100015234032_100000184674 [0,2,0,0,0,0|0,0,2]=4 17443 B12R1.308 C=CCC(=O)c1ccccc1O 1458a_100015234032_100000210623 [0,2,0,0,0,0|0,0,2]=4 17444 B12R1.308 C=CCN(C)c1ccccc1O 269982a_100000033821_100000210623 [0,2,0,0,0,0|0,0,2]=4 17445 B12R1.308 CC(NCF)c1ccccc1Cl 34a_100000174978_100015361967 [0,2,0,0,0,0|2,0,0]=4 17446 B12R1.308 CC(NCF)c1ccccc1F 34a_100000181408_100015361967 [0,2,0,0,0,0|2,0,0]=4 17447 B12R1.308 CC(OCF)c1ccccc1Br 34a_100000702211_100015361967 [0,2,0,0,0,0|2,0,0]=4 17448 B12R1.308 CC(OCF)c1ccccc1Br 7a_100000702211_100015361967 [0,2,0,0,0,0|2,0,0]=4 17449 B12R1.308 CC(OCF)c1ccccc1Cl 34a_100000740796_100015361967 [0,2,0,0,0,0|2,0,0]=4 17450 B12R1.308 CC(OCF)c1ccccc1Cl 7a_100000740796_100015361967 [0,2,0,0,0,0|2,0,0]=4 17451 B12R1.308 CC(OCF)c1ccccc1F 34a_100000697922_100015361967 [0,2,0,0,0,0|2,0,0]=4 17452 B12R1.308 CC(OCF)c1ccccc1F 7a_100000697922_100015361967 [0,2,0,0,0,0|2,0,0]=4 17453 B12R1.308 CC(OCF)c1ccccc1N 7a_100011405641_100015361967 [0,2,0,0,0,0|2,0,0]=4 17454 B12R1.308 CC(SCF)c1ccccc1Cl 62a_100000181259_100015361967 [0,2,0,0,0,0|2,0,0]=4 17455 B12R1.308 CC(SCF)c1ccccc1Cl 62a_100015361967_100000181259 [0,2,0,0,0,0|2,0,0]=4 17456 B12R1.308 CC(SCF)c1ccccc1F 62a_100015361967_200000741388 [0,2,0,0,0,0|2,0,0]=4 17457 B12R1.308 CC(SCF)c1ccccc1F 62a_200000741388_100015361967 [0,2,0,0,0,0|2,0,0]=4 17458 B12R1.308 CCCC(=O)c1ccccc1Br 1458a_100000188424_100000210303 [0,2,0,0,0,0|1,0,0]=3 17459 B12R1.308 CCCC(=O)c1ccccc1C 1458a_100000212026_100000210303 [0,2,0,0,0,0|1,0,0]=3 17460 B12R1.308 CCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210303 [0,2,0,0,0,0|1,0,0]=3 17461 B12R1.308 CCCC(=O)c1ccccc1F 1458a_100000188656_100000210303 [0,2,0,0,0,0|1,0,0]=3 17462 B12R1.308 CCCC(=O)c1ccccc1I 1458a_100000187884_100000210303 [0,2,0,0,0,0|1,0,0]=3 17463 B12R1.308 CCCC(=O)c1ccccc1O 1458a_100015234032_100000210303 [0,2,0,0,0,0|0,0,0]=2 17464 B12R1.308 CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210303 [0,2,0,0,0,0|0,0,1]=3 17465 B12R1.308 CCCN(C)c1ccccc1Br 2230a_100020606079_100000210303 [0,2,0,0,0,0|1,0,0]=3 17466 B12R1.308 CCCN(C)c1ccccc1Br 269982a_100020606079_100000210303 [0,2,0,0,0,0|1,0,0]=3 17467 B12R1.308 CCCN(C)c1ccccc1Br 34a_100020606079_100000210303 [0,2,0,0,0,0|1,0,0]=3 17468 B12R1.308 CCCN(C)c1ccccc1C 2230a_100000219699_100000210303 [0,2,0,0,0,0|1,0,0]=3 17469 B12R1.308 CCCN(C)c1ccccc1C 269982a_100000219699_100000210303 [0,2,0,0,0,0|1,0,0]=3 17470 B12R1.308 CCCN(C)c1ccccc1C 34a_100000219699_100000210303 [0,2,0,0,0,0|1,0,0]=3 17471 B12R1.308 CCCN(C)c1ccccc1Cl 2230a_100000219374_100000210303 [0,2,0,0,0,0|1,0,0]=3 17472 B12R1.308 CCCN(C)c1ccccc1Cl 269982a_100000219374_100000210303 [0,2,0,0,0,0|1,0,0]=3 17473 B12R1.308 CCCN(C)c1ccccc1Cl 34a_100000219374_100000210303 [0,2,0,0,0,0|1,0,0]=3 17474 B12R1.308 CCCN(C)c1ccccc1F 2230a_100000220357_100000210303 [0,2,0,0,0,0|1,0,0]=3 17475 B12R1.308 CCCN(C)c1ccccc1F 2230a_100011231789_200000210301 [0,2,0,0,0,0|1,0,0]=3 17476 B12R1.308 CCCN(C)c1ccccc1F 269982a_100000220357_100000210303 [0,2,0,0,0,0|1,0,0]=3 17477 B12R1.308 CCCN(C)c1ccccc1F 269982a_100011231789_200000210301 [0,2,0,0,0,0|1,0,0]=3 17478 B12R1.308 CCCN(C)c1ccccc1F 34a_100000220357_100000210303 [0,2,0,0,0,0|1,0,0]=3 17479 B12R1.308 CCCN(C)c1ccccc1F 34a_100011231789_200000210301 [0,2,0,0,0,0|1,0,0]=3 17480 B12R1.308 CCCN(C)c1ccccc1F 38a_100000220357_100000210303 [0,2,0,0,0,0|1,0,0]=3 17481 B12R1.308 CCCN(C)c1ccccc1O 269982a_100000033821_100000210303 [0,2,0,0,0,0|0,0,0]=2 17482 B12R1.308 CCCN(C)c1ccncc1Br 27a_100000747261_100000726257 [0,2,0,0,0,0|2,0,0]=4 17483 B12R1.308 CCCN(C)c1ccncc1C 27a_100000747261_100000765111 [0,2,0,0,0,0|2,0,0]=4 17484 B12R1.308 CCCN(C)c1ccncc1F 27a_100000747261_100000035921 [0,2,0,0,0,0|2,0,0]=4 17485 B12R1.308 CCCN(C)c1ncccc1Br 27a_100000747261_100000696092 [0,2,0,0,0,0|2,0,0]=4 17486 B12R1.308 CCCN([13CH3])c1ccccc1F 2230a_100011231789_200025704644 [0,2,0,0,0,0|1,0,0]=3 17487 B12R1.308 CCCN([13CH3])c1ccccc1F 269982a_100011231789_200025704644 [0,2,0,0,0,0|1,0,0]=3 17488 B12R1.308 CCCN([13CH3])c1ccccc1F 34a_100011231789_200025704644 [0,2,0,0,0,0|1,0,0]=3 17489 B12R1.308 CCNC(=O)c1ccccc1Br 11a_100015525214_100000188424 [0,2,0,0,0,0|1,0,1]=4 17490 B12R1.308 CCNC(=O)c1ccccc1Br 240690a_100015525214_100000188424 [0,2,0,0,0,0|1,0,1]=4 17491 B12R1.308 CCNC(=O)c1ccccc1Br 527a_100015525214_100000188424 [0,2,0,0,0,0|1,0,1]=4 17492 B12R1.308 CCNC(=O)c1ccccc1C 11a_100015525214_100000212026 [0,2,0,0,0,0|1,0,1]=4 17493 B12R1.308 CCNC(=O)c1ccccc1C 240690a_100015525214_100000212026 [0,2,0,0,0,0|1,0,1]=4 17494 B12R1.308 CCNC(=O)c1ccccc1C 527a_100015525214_100000212026 [0,2,0,0,0,0|1,0,1]=4 17495 B12R1.308 CCNC(=O)c1ccccc1Cl 11a_100015525214_100000185844 [0,2,0,0,0,0|1,0,1]=4 17496 B12R1.308 CCNC(=O)c1ccccc1Cl 240690a_100015525214_100000185844 [0,2,0,0,0,0|1,0,1]=4 17497 B12R1.308 CCNC(=O)c1ccccc1Cl 527a_100015525214_100000185844 [0,2,0,0,0,0|1,0,1]=4 17498 B12R1.308 CCNC(=O)c1ccccc1F 11a_100015525214_100000188656 [0,2,0,0,0,0|1,0,1]=4 17499 B12R1.308 CCNC(=O)c1ccccc1F 240690a_100015525214_100000188656 [0,2,0,0,0,0|1,0,1]=4 17500 B12R1.308 CCNC(=O)c1ccccc1F 527a_100015525214_100000188656 [0,2,0,0,0,0|1,0,1]=4 17501 B12R1.308 CCNC(=O)c1ccccc1I 11a_100015525214_100000187884 [0,2,0,0,0,0|1,0,1]=4 17502 B12R1.308 CCNC(=O)c1ccccc1I 240690a_100015525214_100000187884 [0,2,0,0,0,0|1,0,1]=4 17503 B12R1.308 CCNC(=O)c1ccccc1I 527a_100015525214_100000187884 [0,2,0,0,0,0|1,0,1]=4 17504 B12R1.308 CCNC(=O)c1ccccc1O 240690a_100015525214_100015234032 [0,2,0,0,0,0|0,0,1]=3 17505 B12R1.308 CCNC(=O)c1ccccc1O 271570a_203496583355_200000155173 [0,2,0,0,0,0|0,0,1]=3 17506 B12R1.308 CCNC(=O)c1ccccc1[O-] 240690a_100015525214_100009911694 [0,2,0,0,0,0|0,0,2]=4 17507 B12R1.308 CCNC(=O)c1ccccc1[O-] 527a_100015525214_100009911694 [0,2,0,0,0,0|0,0,2]=4 17508 B12R1.308 CCNC(=O)c1cccnc1O 271570a_203496583355_100000160120 [0,2,0,0,0,0|1,0,1]=4 17509 B12R1.308 CCNC(C)c1ccccc1Br 2230a_100000181357_100000210202 [0,2,0,0,0,0|1,0,0]=3 17510 B12R1.308 CCNC(C)c1ccccc1Br 269862a_100015525214_100000187085 [0,2,0,0,0,0|1,0,0]=3 17511 B12R1.308 CCNC(C)c1ccccc1C 2230a_100000181355_100000210202 [0,2,0,0,0,0|1,0,0]=3 17512 B12R1.308 CCNC(C)c1ccccc1C 269862a_100015525214_100000211656 [0,2,0,0,0,0|1,0,0]=3 17513 B12R1.308 CCNC(C)c1ccccc1C 34a_100000181355_100000210202 [0,2,0,0,0,0|1,0,0]=3 17514 B12R1.308 CCNC(C)c1ccccc1Cl 2230a_100000174978_100000210202 [0,2,0,0,0,0|1,0,0]=3 17515 B12R1.308 CCNC(C)c1ccccc1Cl 2230a_100015525214_100000181259 [0,2,0,0,0,0|1,0,0]=3 17516 B12R1.308 CCNC(C)c1ccccc1Cl 269862a_100015525214_100000210134 [0,2,0,0,0,0|1,0,0]=3 17517 B12R1.308 CCNC(C)c1ccccc1Cl 34a_100000174978_100000210202 [0,2,0,0,0,0|1,0,0]=3 17518 B12R1.308 CCNC(C)c1ccccc1F 2230a_100000181408_100000210202 [0,2,0,0,0,0|1,0,0]=3 17519 B12R1.308 CCNC(C)c1ccccc1F 2230a_100015525214_200000741388 [0,2,0,0,0,0|1,0,0]=3 17520 B12R1.308 CCNC(C)c1ccccc1F 269862a_100015525214_100000210632 [0,2,0,0,0,0|1,0,0]=3 17521 B12R1.308 CCNC(C)c1ccccc1F 34a_100000181408_100000210202 [0,2,0,0,0,0|1,0,0]=3 17522 B12R1.308 CCNC(C)c1ccccc1I 269862a_100015525214_100000751169 [0,2,0,0,0,0|1,0,0]=3 17523 B12R1.308 CCNC(C)c1cccnc1C 269862a_100015525214_100011995960 [0,2,0,0,0,0|2,0,0]=4 17524 B12R1.308 CCNC(C)c1cccnc1O 2230a_100159269580_100000210202 [0,2,0,0,0,0|1,0,0]=3 17525 B12R1.308 CCNC(C)c1ccncc1Br 269862a_100015525214_100009993184 [0,2,0,0,0,0|2,0,0]=4 17526 B12R1.308 CCNC(C)c1ccncc1Cl 269862a_100015525214_100012001414 [0,2,0,0,0,0|2,0,0]=4 17527 B12R1.308 CCNC(C)c1ccncc1F 269862a_100015525214_100000727669 [0,2,0,0,0,0|2,0,0]=4 17528 B12R1.308 CCNC(C)c1cnccc1C 269862a_100015525214_100000693228 [0,2,0,0,0,0|2,0,0]=4 17529 B12R1.308 CCNC(C)c1cnccc1Cl 269862a_100015525214_100160469449 [0,2,0,0,0,0|2,0,0]=4 17530 B12R1.308 CCNC(C)c1ncccc1Br 2230a_100159271932_100000210202 [0,2,0,0,0,0|2,0,0]=4 17531 B12R1.308 CCNC(C)c1ncccc1Br 269862a_100015525214_100012348690 [0,2,0,0,0,0|2,0,0]=4 17532 B12R1.308 CCNC(C)c1ncccc1C 2230a_100011536111_100000210202 [0,2,0,0,0,0|2,0,0]=4 17533 B12R1.308 CCNC(C)c1ncccc1C 269862a_100015525214_100011536074 [0,2,0,0,0,0|2,0,0]=4 17534 B12R1.308 CCNC(C)c1ncccc1Cl 269862a_100015525214_100015267551 [0,2,0,0,0,0|2,0,0]=4 17535 B12R1.308 CCNC(C)c1ncccc1F 269862a_100015525214_100011997767 [0,2,0,0,0,0|2,0,0]=4 17536 B12R1.308 CCNC(C)c1ncccc1I 269862a_100015525214_200015599370 [0,2,0,0,0,0|2,0,0]=4 17537 B12R1.308 CCN[C@H](C)c1ccccc1O 2230a_100025703389_100000210202 [0,2,0,0,0,0|0,0,0]=2 17538 B12R1.308 CCOC(=O)c1ccccc1O 271570a_203496583355_100000169879 [0,2,0,0,0,0|0,0,1]=3 17539 B12R1.308 CCOC(=O)c1cccnc1O 271570a_203496583355_100000170124 [0,2,0,0,0,0|1,0,1]=4 17540 B12R1.308 CCOC(=O)c1ccncc1O 271570a_203496583355_100010238393 [0,2,0,0,0,0|1,0,1]=4 17541 B12R1.308 CCOC(=O)c1cnccc1O 271570a_203496583355_100016987518 [0,2,0,0,0,0|1,0,1]=4 17542 B12R1.308 CCOC(=O)c1ncccc1O 271570a_203496583355_100012351660 [0,2,0,0,0,0|1,0,1]=4 17543 B12R1.308 CCOC(C)c1ccccc1Br 34a_100000702211_100000210202 [0,2,0,0,0,0|1,0,0]=3 17544 B12R1.308 CCOC(C)c1ccccc1Br 7a_100000702211_100000210202 [0,2,0,0,0,0|1,0,0]=3 17545 B12R1.308 CCOC(C)c1ccccc1C 34a_100000742021_100000210202 [0,2,0,0,0,0|1,0,0]=3 17546 B12R1.308 CCOC(C)c1ccccc1C 7a_100000742021_100000210202 [0,2,0,0,0,0|1,0,0]=3 17547 B12R1.308 CCOC(C)c1ccccc1Cl 34a_100000740796_100000210202 [0,2,0,0,0,0|1,0,0]=3 17548 B12R1.308 CCOC(C)c1ccccc1Cl 7a_100000740796_100000210202 [0,2,0,0,0,0|1,0,0]=3 17549 B12R1.308 CCOC(C)c1ccccc1F 34a_100000697922_100000210202 [0,2,0,0,0,0|1,0,0]=3 17550 B12R1.308 CCOC(C)c1ccccc1F 34a_100121572206_200000741388 [0,2,0,0,0,0|1,0,0]=3 17551 B12R1.308 CCOC(C)c1ccccc1F 7a_100000697922_100000210202 [0,2,0,0,0,0|1,0,0]=3 17552 B12R1.308 CCOC(C)c1ccccc1N 7a_100011405641_100000210202 [0,2,0,0,0,0|1,0,0]=3 17553 B12R1.308 CCOC(C)c1cccnc1Cl 34a_100009865335_100000210202 [0,2,0,0,0,0|2,0,0]=4 17554 B12R1.308 CCOC(C)c1cccnc1Cl 7a_100009865335_100000210202 [0,2,0,0,0,0|2,0,0]=4 17555 B12R1.308 CCOC(C)c1ccncc1F 34a_100012180158_100000210202 [0,2,0,0,0,0|2,0,0]=4 17556 B12R1.308 CCO[C@@H](C)c1ncccc1Br 7a_100013325542_100000210202 [0,2,0,0,0,0|2,0,0]=4 17557 B12R1.308 CCSC(C)c1ccccc1Cl 62a_100000181259_100000210202 [0,2,0,0,0,0|1,0,0]=3 17558 B12R1.308 CCSC(C)c1ccccc1Cl 62a_100000210202_100000181259 [0,2,0,0,0,0|1,0,0]=3 17559 B12R1.308 CCSC(C)c1ccccc1F 62a_100000210202_200000741388 [0,2,0,0,0,0|1,0,0]=3 17560 B12R1.308 CCSC(C)c1ccccc1F 62a_200000741388_100000210202 [0,2,0,0,0,0|1,0,0]=3 17561 B12R1.308 CN(CC#N)c1ccccc1O 269982a_100000033821_100011214920 [0,2,0,0,0,0|1,0,1]=4 17562 B12R1.308 CN(CC=O)c1ccccc1O 269982a_100000033821_200015260668 [0,2,0,0,0,0|1,0,1]=4 17563 B12R1.308 CN(CCF)c1ccccc1Br 2230a_100020606079_100011217306 [0,2,0,0,0,0|2,0,0]=4 17564 B12R1.308 CN(CCF)c1ccccc1Br 269982a_100020606079_100011217306 [0,2,0,0,0,0|2,0,0]=4 17565 B12R1.308 CN(CCF)c1ccccc1Br 34a_100020606079_100011217306 [0,2,0,0,0,0|2,0,0]=4 17566 B12R1.308 CN(CCF)c1ccccc1Cl 2230a_100000219374_100011217306 [0,2,0,0,0,0|2,0,0]=4 17567 B12R1.308 CN(CCF)c1ccccc1Cl 269982a_100000219374_100011217306 [0,2,0,0,0,0|2,0,0]=4 17568 B12R1.308 CN(CCF)c1ccccc1Cl 34a_100000219374_100011217306 [0,2,0,0,0,0|2,0,0]=4 17569 B12R1.308 CN(CCF)c1ccccc1F 2230a_100000220357_100011217306 [0,2,0,0,0,0|2,0,0]=4 17570 B12R1.308 CN(CCF)c1ccccc1F 269982a_100000220357_100011217306 [0,2,0,0,0,0|2,0,0]=4 17571 B12R1.308 CN(CCF)c1ccccc1F 34a_100000220357_100011217306 [0,2,0,0,0,0|2,0,0]=4 17572 B12R1.308 CN(CCF)c1ccccc1F 38a_100000220357_100011217306 [0,2,0,0,0,0|2,0,0]=4 17573 B12R1.308 CN(CCF)c1ccccc1O 269982a_100000033821_100011217306 [0,2,0,0,0,0|1,0,0]=3 17574 B12R1.308 CN(CCO)c1ccccc1Br 2230a_100020606079_100000211926 [0,2,0,0,0,0|2,0,0]=4 17575 B12R1.308 CN(CCO)c1ccccc1Br 269982a_100020606079_100000211926 [0,2,0,0,0,0|2,0,0]=4 17576 B12R1.308 CN(CCO)c1ccccc1Br 34a_100020606079_100000211926 [0,2,0,0,0,0|2,0,0]=4 17577 B12R1.308 CN(CCO)c1ccccc1Cl 2230a_100000219374_100000211926 [0,2,0,0,0,0|2,0,0]=4 17578 B12R1.308 CN(CCO)c1ccccc1Cl 269982a_100000219374_100000211926 [0,2,0,0,0,0|2,0,0]=4 17579 B12R1.308 CN(CCO)c1ccccc1Cl 34a_100000219374_100000211926 [0,2,0,0,0,0|2,0,0]=4 17580 B12R1.308 CN(CCO)c1ccccc1F 2230a_100000220357_100000211926 [0,2,0,0,0,0|2,0,0]=4 17581 B12R1.308 CN(CCO)c1ccccc1F 269982a_100000220357_100000211926 [0,2,0,0,0,0|2,0,0]=4 17582 B12R1.308 CN(CCO)c1ccccc1F 34a_100000220357_100000211926 [0,2,0,0,0,0|2,0,0]=4 17583 B12R1.308 CN(CCO)c1ccccc1F 38a_100000220357_100000211926 [0,2,0,0,0,0|2,0,0]=4 17584 B12R1.308 CN(CCO)c1ccccc1O 269982a_100000033821_100000211926 [0,2,0,0,0,0|1,0,0]=3 17585 B12R1.308 CNCC(=O)c1ccccc1Br 34a_100102657272_100000199116 [0,2,0,0,0,0|1,0,1]=4 17586 B12R1.308 CNCC(=O)c1ccccc1C 2230a_106832991635_100000741374 [0,2,0,0,0,0|1,0,1]=4 17587 B12R1.308 CNCC(=O)c1ccccc1C 34a_100102657272_100000741374 [0,2,0,0,0,0|1,0,1]=4 17588 B12R1.308 CNCC(=O)c1ccccc1C 7a_106832991635_100000741374 [0,2,0,0,0,0|1,0,1]=4 17589 B12R1.308 CNCC(=O)c1ccccc1Cl 34a_100102657272_100000211432 [0,2,0,0,0,0|1,0,1]=4 17590 B12R1.308 CNCC(=O)c1ccccc1F 34a_100102657272_100000204681 [0,2,0,0,0,0|1,0,1]=4 17591 B12R1.308 CNCC(=O)c1ccccc1F 7a_106832991635_100000204681 [0,2,0,0,0,0|1,0,1]=4 17592 B12R1.308 CNCC(=O)c1ccccc1O 7a_106832991635_100000188908 [0,2,0,0,0,0|0,0,1]=3 17593 B12R1.308 CNCC(O)c1ccccc1Br 2230a_100011236429_200000210301 [0,2,0,0,0,0|1,0,0]=3 17594 B12R1.308 CNCC(O)c1ccccc1Cl 2230a_200000759403_200000210301 [0,2,0,0,0,0|1,0,0]=3 17595 B12R1.308 CNCC(O)c1ccccc1Cl 34a_200000759403_200000210301 [0,2,0,0,0,0|1,0,0]=3 17596 B12R1.308 CNNC(=O)c1ccccc1O 22a_100016993582_100015234032 [0,2,0,0,0,0|1,0,1]=4 17597 B12R1.308 COCC(=O)c1ccccc1Br 34a_100138415774_100000199116 [0,2,0,0,0,0|1,0,1]=4 17598 B12R1.308 COCC(=O)c1ccccc1C 34a_100138415774_100000741374 [0,2,0,0,0,0|1,0,1]=4 17599 B12R1.308 COCC(=O)c1ccccc1Cl 34a_100138415774_100000211432 [0,2,0,0,0,0|1,0,1]=4 17600 B12R1.308 COCC(=O)c1ccccc1F 34a_100138415774_100000204681 [0,2,0,0,0,0|1,0,1]=4 17601 B12R1.308 COCC(N)c1ccccc1Cl 34a_100138412506_200000210301 [0,2,0,0,0,0|1,0,0]=3 17602 B12R1.308 COCC(N)c1ccncc1Cl 34a_200020642286_200000210301 [0,2,0,0,0,0|2,0,0]=4 17603 B12R1.308 COCN(C)c1ccccc1Br 2230a_100020606079_100000766300 [0,2,0,0,0,0|2,0,0]=4 17604 B12R1.308 COCN(C)c1ccccc1Br 269982a_100020606079_100000766300 [0,2,0,0,0,0|2,0,0]=4 17605 B12R1.308 COCN(C)c1ccccc1C 2230a_100000219699_100000766300 [0,2,0,0,0,0|2,0,0]=4 17606 B12R1.308 COCN(C)c1ccccc1C 269982a_100000219699_100000766300 [0,2,0,0,0,0|2,0,0]=4 17607 B12R1.308 COCN(C)c1ccccc1Cl 2230a_100000219374_100000766300 [0,2,0,0,0,0|2,0,0]=4 17608 B12R1.308 COCN(C)c1ccccc1Cl 269982a_100000219374_100000766300 [0,2,0,0,0,0|2,0,0]=4 17609 B12R1.308 COCN(C)c1ccccc1F 2230a_100000220357_100000766300 [0,2,0,0,0,0|2,0,0]=4 17610 B12R1.308 COCN(C)c1ccccc1F 269982a_100000220357_100000766300 [0,2,0,0,0,0|2,0,0]=4 17611 B12R1.308 COCN(C)c1ccccc1O 269982a_100000033821_100000766300 [0,2,0,0,0,0|1,0,0]=3 17612 B12R1.308 COC[C@@H](N)c1ccccc1Br 34a_100161155918_200000210301 [0,2,0,0,0,0|1,0,0]=3 17613 B12R1.308 COC[C@H](N)c1ccccc1F 34a_100009818778_200000210301 [0,2,0,0,0,0|1,0,0]=3 17614 B12R1.308 CSCC(=O)c1ccccc1Br 62a_100000199116_200000210301 [0,2,0,0,0,0|1,0,1]=4 17615 B12R1.308 CSCC(=O)c1ccccc1C 62a_100000741374_200000210301 [0,2,0,0,0,0|1,0,1]=4 17616 B12R1.308 CSCC(=O)c1ccccc1C 62a_200000210301_100000741374 [0,2,0,0,0,0|1,0,1]=4 17617 B12R1.308 CSCC(=O)c1ccccc1Cl 62a_100000211432_200000210301 [0,2,0,0,0,0|1,0,1]=4 17618 B12R1.308 CSCC(=O)c1ccccc1Cl 62a_200000210301_100000211432 [0,2,0,0,0,0|1,0,1]=4 17619 B12R1.308 CSCC(=O)c1ccccc1F 62a_100000204681_200000210301 [0,2,0,0,0,0|1,0,1]=4 17620 B12R1.308 CSCC(=O)c1ccccc1F 62a_200000210301_100000204681 [0,2,0,0,0,0|1,0,1]=4 17621 B12R1.308 CSCC(=O)c1ccccc1O 62a_100000188908_200000210301 [0,2,0,0,0,0|0,0,1]=3 17622 B12R1.308 CSCC(=O)c1ccccc1O 62a_200000210301_100000188908 [0,2,0,0,0,0|0,0,1]=3 17623 B12R1.308 CSCN(C)c1ccccc1Br 2230a_100020606079_100011218213 [0,2,0,0,0,0|2,0,0]=4 17624 B12R1.308 CSCN(C)c1ccccc1Br 269982a_100020606079_100011218213 [0,2,0,0,0,0|2,0,0]=4 17625 B12R1.308 CSCN(C)c1ccccc1Br 34a_100020606079_100011218213 [0,2,0,0,0,0|2,0,0]=4 17626 B12R1.308 CSCN(C)c1ccccc1C 2230a_100000219699_100011218213 [0,2,0,0,0,0|2,0,0]=4 17627 B12R1.308 CSCN(C)c1ccccc1C 269982a_100000219699_100011218213 [0,2,0,0,0,0|2,0,0]=4 17628 B12R1.308 CSCN(C)c1ccccc1C 34a_100000219699_100011218213 [0,2,0,0,0,0|2,0,0]=4 17629 B12R1.308 CSCN(C)c1ccccc1Cl 2230a_100000219374_100011218213 [0,2,0,0,0,0|2,0,0]=4 17630 B12R1.308 CSCN(C)c1ccccc1Cl 269982a_100000219374_100011218213 [0,2,0,0,0,0|2,0,0]=4 17631 B12R1.308 CSCN(C)c1ccccc1Cl 34a_100000219374_100011218213 [0,2,0,0,0,0|2,0,0]=4 17632 B12R1.308 CSCN(C)c1ccccc1F 2230a_100000220357_100011218213 [0,2,0,0,0,0|2,0,0]=4 17633 B12R1.308 CSCN(C)c1ccccc1F 269982a_100000220357_100011218213 [0,2,0,0,0,0|2,0,0]=4 17634 B12R1.308 CSCN(C)c1ccccc1F 34a_100000220357_100011218213 [0,2,0,0,0,0|2,0,0]=4 17635 B12R1.308 CSCN(C)c1ccccc1O 269982a_100000033821_100011218213 [0,2,0,0,0,0|1,0,0]=3 17636 B12R1.308 Cc1ccccc1C(=O)CCF 1458a_100000212026_100011217306 [0,2,0,0,0,0|1,0,1]=4 17637 B12R1.308 Cc1ccccc1C(=O)CCO 1458a_100000212026_100000211926 [0,2,0,0,0,0|1,0,1]=4 17638 B12R1.308 Cc1ccccc1C(=O)CS[13CH3] 62a_100000741374_200025704644 [0,2,0,0,0,0|1,0,1]=4 17639 B12R1.308 Cc1ccccc1C(=O)CS[13CH3] 62a_200025704644_100000741374 [0,2,0,0,0,0|1,0,1]=4 17640 B12R1.308 Cc1ccccc1C(C)NCF 34a_100000181355_100015361967 [0,2,0,0,0,0|2,0,0]=4 17641 B12R1.308 Cc1ccccc1C(C)OCF 34a_100000742021_100015361967 [0,2,0,0,0,0|2,0,0]=4 17642 B12R1.308 Cc1ccccc1C(C)OCF 7a_100000742021_100015361967 [0,2,0,0,0,0|2,0,0]=4 17643 B12R1.308 Cc1ccccc1N(C)CCF 2230a_100000219699_100011217306 [0,2,0,0,0,0|2,0,0]=4 17644 B12R1.308 Cc1ccccc1N(C)CCF 269982a_100000219699_100011217306 [0,2,0,0,0,0|2,0,0]=4 17645 B12R1.308 Cc1ccccc1N(C)CCF 34a_100000219699_100011217306 [0,2,0,0,0,0|2,0,0]=4 17646 B12R1.308 Cc1ccccc1N(C)CCO 2230a_100000219699_100000211926 [0,2,0,0,0,0|2,0,0]=4 17647 B12R1.308 Cc1ccccc1N(C)CCO 269982a_100000219699_100000211926 [0,2,0,0,0,0|2,0,0]=4 17648 B12R1.308 Cc1ccccc1N(C)CCO 269982a_100011233185_200000210301 [0,2,0,0,0,0|2,0,0]=4 17649 B12R1.308 Cc1ccccc1N(C)CCO 34a_100000219699_100000211926 [0,2,0,0,0,0|2,0,0]=4 17650 B12R1.308 Cc1ccccc1N(C)CCO 34a_100011233185_200000210301 [0,2,0,0,0,0|2,0,0]=4 17651 B12R1.308 Cc1ccccc1N([13CH3])CCO 269982a_100011233185_200025704644 [0,2,0,0,0,0|2,0,0]=4 17652 B12R1.308 Cc1ccccc1N([13CH3])CCO 34a_100011233185_200025704644 [0,2,0,0,0,0|2,0,0]=4 17653 B12R1.308 N#CCC(=O)c1ccccc1O 1458a_100015234032_100011214920 [0,2,0,0,0,0|0,0,2]=4 17654 B12R1.308 N#CCC(=O)c1ccccc1O 271570a_203496583355_100011225204 [0,2,0,0,0,0|0,0,2]=4 17655 B12R1.308 O=C(CCF)c1ccccc1Br 1458a_100000188424_100011217306 [0,2,0,0,0,0|1,0,1]=4 17656 B12R1.308 O=C(CCF)c1ccccc1Cl 1458a_100000185844_100011217306 [0,2,0,0,0,0|1,0,1]=4 17657 B12R1.308 O=C(CCF)c1ccccc1F 1458a_100000188656_100011217306 [0,2,0,0,0,0|1,0,1]=4 17658 B12R1.308 O=C(CCF)c1ccccc1I 1458a_100000187884_100011217306 [0,2,0,0,0,0|1,0,1]=4 17659 B12R1.308 O=C(CCF)c1ccccc1O 1458a_100015234032_100011217306 [0,2,0,0,0,0|0,0,1]=3 17660 B12R1.308 O=C(CCF)c1ccccc1[O-] 1458a_100009911694_100011217306 [0,2,0,0,0,0|0,0,2]=4 17661 B12R1.308 O=C(CCO)c1ccccc1Br 1458a_100000188424_100000211926 [0,2,0,0,0,0|1,0,1]=4 17662 B12R1.308 O=C(CCO)c1ccccc1Cl 1458a_100000185844_100000211926 [0,2,0,0,0,0|1,0,1]=4 17663 B12R1.308 O=C(CCO)c1ccccc1F 1458a_100000188656_100000211926 [0,2,0,0,0,0|1,0,1]=4 17664 B12R1.308 O=C(CCO)c1ccccc1I 1458a_100000187884_100000211926 [0,2,0,0,0,0|1,0,1]=4 17665 B12R1.308 O=C(CCO)c1ccccc1O 1458a_100015234032_100000211926 [0,2,0,0,0,0|0,0,1]=3 17666 B12R1.308 O=C(CCO)c1ccccc1[O-] 1458a_100009911694_100000211926 [0,2,0,0,0,0|0,0,2]=4 17667 B12R1.308 [13CH3]NCC(O)c1ccccc1Br 2230a_100011236429_200025704644 [0,2,0,0,0,0|1,0,0]=3 17668 B12R1.308 [13CH3]NCC(O)c1ccccc1Cl 2230a_200000759403_200025704644 [0,2,0,0,0,0|1,0,0]=3 17669 B12R1.308 [13CH3]NCC(O)c1ccccc1Cl 34a_200000759403_200025704644 [0,2,0,0,0,0|1,0,0]=3 17670 B12R1.308 [13CH3]OCC(N)c1ccccc1Cl 34a_100138412506_200025704644 [0,2,0,0,0,0|1,0,0]=3 17671 B12R1.308 [13CH3]OCC(N)c1ccncc1Cl 34a_200020642286_200025704644 [0,2,0,0,0,0|2,0,0]=4 17672 B12R1.308 [13CH3]OC[C@@H](N)c1ccccc1Br 34a_100161155918_200025704644 [0,2,0,0,0,0|1,0,0]=3 17673 B12R1.308 [13CH3]OC[C@H](N)c1ccccc1F 34a_100009818778_200025704644 [0,2,0,0,0,0|1,0,0]=3 17674 B12R1.308 [13CH3]SCC(=O)c1ccccc1Br 62a_100000199116_200025704644 [0,2,0,0,0,0|1,0,1]=4 17675 B12R1.308 [13CH3]SCC(=O)c1ccccc1Cl 62a_100000211432_200025704644 [0,2,0,0,0,0|1,0,1]=4 17676 B12R1.308 [13CH3]SCC(=O)c1ccccc1Cl 62a_200025704644_100000211432 [0,2,0,0,0,0|1,0,1]=4 17677 B12R1.308 [13CH3]SCC(=O)c1ccccc1F 62a_100000204681_200025704644 [0,2,0,0,0,0|1,0,1]=4 17678 B12R1.308 [13CH3]SCC(=O)c1ccccc1F 62a_200025704644_100000204681 [0,2,0,0,0,0|1,0,1]=4 17679 B12R1.308 [13CH3]SCC(=O)c1ccccc1O 62a_100000188908_200025704644 [0,2,0,0,0,0|0,0,1]=3 17680 B12R1.308 [13CH3]SCC(=O)c1ccccc1O 62a_200025704644_100000188908 [0,2,0,0,0,0|0,0,1]=3 17681 B12R1.371 C#CC(C)Nc1ccccc1Br 34a_100000210017_200000035995 [0,2,0,0,0,0|2,0,0]=4 17682 B12R1.371 C#CC(C)Nc1ccccc1C 34a_100015192222_200000035995 [0,2,0,0,0,0|2,0,0]=4 17683 B12R1.371 C#CC(C)Nc1ccccc1Cl 34a_100000185783_200000035995 [0,2,0,0,0,0|2,0,0]=4 17684 B12R1.371 C#CC(C)Nc1ccccc1F 34a_100000210422_200000035995 [0,2,0,0,0,0|2,0,0]=4 17685 B12R1.371 C#CC(C)Nc1ccccc1I 34a_100000210053_200000035995 [0,2,0,0,0,0|2,0,0]=4 17686 B12R1.371 C#CC(C)Nc1ccccc1O 34a_100000185747_200000035995 [0,2,0,0,0,0|1,0,0]=3 17687 B12R1.371 C#CC(C)Oc1ccccc1Br 34a_100000181306_200000035995 [0,2,0,0,0,0|2,0,0]=4 17688 B12R1.371 C#CC(C)Oc1ccccc1C 34a_100000210338_200000035995 [0,2,0,0,0,0|2,0,0]=4 17689 B12R1.371 C#CC(C)Oc1ccccc1Cl 34a_100000210172_200000035995 [0,2,0,0,0,0|2,0,0]=4 17690 B12R1.371 C#CC(C)Oc1ccccc1F 34a_100000210171_200000035995 [0,2,0,0,0,0|2,0,0]=4 17691 B12R1.371 C#CC(C)Oc1ccccc1I 34a_100000739446_200000035995 [0,2,0,0,0,0|2,0,0]=4 17692 B12R1.371 C#CC(C)Oc1ccccc1N 34a_100000185747_200000035995 [0,2,0,0,0,0|2,0,0]=4 17693 B12R1.371 C#CC(C)Sc1ccccc1Br 62a_200000035995_100000695589 [0,2,0,0,0,0|2,0,0]=4 17694 B12R1.371 C#CC(C)Sc1ccccc1C 62a_200000035995_100000210755 [0,2,0,0,0,0|2,0,0]=4 17695 B12R1.371 C#CC(C)Sc1ccccc1Cl 62a_200000035995_100000764095 [0,2,0,0,0,0|2,0,0]=4 17696 B12R1.371 C#CC(C)Sc1ccccc1F 62a_200000035995_100011215700 [0,2,0,0,0,0|2,0,0]=4 17697 B12R1.371 C#CC(C)Sc1ccccc1N 62a_200000035995_100000210017 [0,2,0,0,0,0|2,0,0]=4 17698 B12R1.371 C#CC(C)Sc1ccccc1O 62a_200000035995_100000739446 [0,2,0,0,0,0|1,0,0]=3 17699 B12R1.371 C#CC(C)Sc1cccnc1O 62a_200000035995_100000760158 [0,2,0,0,0,0|2,0,0]=4 17700 B12R1.371 C#CC(C)Sc1ccncc1O 62a_200000035995_100009817591 [0,2,0,0,0,0|2,0,0]=4 17701 B12R1.371 C#CC(C)Sc1ncccc1O 62a_200000035995_100000034122 [0,2,0,0,0,0|2,0,0]=4 17702 B12R1.371 C=CC(C)Sc1ccccc1Br 62a_100011215867_100000695589 [0,2,0,0,0,0|2,0,0]=4 17703 B12R1.371 C=CC(C)Sc1ccccc1C 62a_100011215867_100000210755 [0,2,0,0,0,0|2,0,0]=4 17704 B12R1.371 C=CC(C)Sc1ccccc1Cl 62a_100011215867_100000764095 [0,2,0,0,0,0|2,0,0]=4 17705 B12R1.371 C=CC(C)Sc1ccccc1F 62a_100011215867_100011215700 [0,2,0,0,0,0|2,0,0]=4 17706 B12R1.371 C=CC(C)Sc1ccccc1N 62a_100011215867_100000210017 [0,2,0,0,0,0|2,0,0]=4 17707 B12R1.371 C=CC(C)Sc1ccccc1O 62a_100011215867_100000739446 [0,2,0,0,0,0|1,0,0]=3 17708 B12R1.371 C=CC(C)Sc1cccnc1O 62a_100011215867_100000760158 [0,2,0,0,0,0|2,0,0]=4 17709 B12R1.371 C=CC(C)Sc1ccncc1O 62a_100011215867_100009817591 [0,2,0,0,0,0|2,0,0]=4 17710 B12R1.371 C=CC(C)Sc1ncccc1O 62a_100011215867_100000034122 [0,2,0,0,0,0|2,0,0]=4 17711 B12R1.371 CC(C#N)Oc1ccccc1Br 7a_100000181306_100000703298 [0,2,0,0,0,0|2,0,0]=4 17712 B12R1.371 CC(C#N)Oc1ccccc1Cl 7a_100000210172_100000703298 [0,2,0,0,0,0|2,0,0]=4 17713 B12R1.371 CC(C#N)Oc1ccccc1F 7a_100000210171_100000703298 [0,2,0,0,0,0|2,0,0]=4 17714 B12R1.371 CC(C#N)Oc1ccccc1I 7a_100000739446_100000703298 [0,2,0,0,0,0|2,0,0]=4 17715 B12R1.371 CC(C#N)Oc1ccccc1N 7a_100000185747_100000703298 [0,2,0,0,0,0|2,0,0]=4 17716 B12R1.371 CC(C#N)Sc1ccccc1Br 62a_100000695589_100000703298 [0,2,0,0,0,0|2,0,0]=4 17717 B12R1.371 CC(C#N)Sc1ccccc1Br 62a_100000703298_100000695589 [0,2,0,0,0,0|2,0,0]=4 17718 B12R1.371 CC(C#N)Sc1ccccc1Cl 62a_100000703298_100000764095 [0,2,0,0,0,0|2,0,0]=4 17719 B12R1.371 CC(C#N)Sc1ccccc1Cl 62a_100000764095_100000703298 [0,2,0,0,0,0|2,0,0]=4 17720 B12R1.371 CC(C#N)Sc1ccccc1F 62a_100000703298_100011215700 [0,2,0,0,0,0|2,0,0]=4 17721 B12R1.371 CC(C#N)Sc1ccccc1F 62a_100011215700_100000703298 [0,2,0,0,0,0|2,0,0]=4 17722 B12R1.371 CC(C#N)Sc1ccccc1N 62a_100000210017_100000703298 [0,2,0,0,0,0|2,0,0]=4 17723 B12R1.371 CC(C#N)Sc1ccccc1N 62a_100000703298_100000210017 [0,2,0,0,0,0|2,0,0]=4 17724 B12R1.371 CC(C#N)Sc1ccccc1O 62a_100000703298_100000739446 [0,2,0,0,0,0|1,0,0]=3 17725 B12R1.371 CC(C#N)Sc1ccccc1O 62a_100000739446_100000703298 [0,2,0,0,0,0|1,0,0]=3 17726 B12R1.371 CC(C#N)Sc1cccnc1O 62a_100000703298_100000760158 [0,2,0,0,0,0|2,0,0]=4 17727 B12R1.371 CC(C#N)Sc1cccnc1O 62a_100000760158_100000703298 [0,2,0,0,0,0|2,0,0]=4 17728 B12R1.371 CC(C#N)Sc1ccncc1O 62a_100000703298_100009817591 [0,2,0,0,0,0|2,0,0]=4 17729 B12R1.371 CC(C#N)Sc1ccncc1O 62a_100009817591_100000703298 [0,2,0,0,0,0|2,0,0]=4 17730 B12R1.371 CC(C#N)Sc1ncccc1O 62a_100000034122_100000703298 [0,2,0,0,0,0|2,0,0]=4 17731 B12R1.371 CC(C#N)Sc1ncccc1O 62a_100000703298_100000034122 [0,2,0,0,0,0|2,0,0]=4 17732 B12R1.371 CC(CO)Nc1ccccc1Br 34a_100000210017_100012180447 [0,2,0,0,0,0|2,0,0]=4 17733 B12R1.371 CC(CO)Nc1ccccc1Cl 34a_100000185783_100012180447 [0,2,0,0,0,0|2,0,0]=4 17734 B12R1.371 CC(CO)Nc1ccccc1F 34a_100000210422_100012180447 [0,2,0,0,0,0|2,0,0]=4 17735 B12R1.371 CC(CO)Nc1ccccc1I 34a_100000210053_100012180447 [0,2,0,0,0,0|2,0,0]=4 17736 B12R1.371 CC(CO)Nc1ccccc1O 34a_100000185747_100012180447 [0,2,0,0,0,0|1,0,0]=3 17737 B12R1.371 CC(CO)Oc1ccccc1Br 34a_100000181306_100012180447 [0,2,0,0,0,0|2,0,0]=4 17738 B12R1.371 CC(CO)Oc1ccccc1Br 7a_100000181306_100012180447 [0,2,0,0,0,0|2,0,0]=4 17739 B12R1.371 CC(CO)Oc1ccccc1Cl 34a_100000210172_100012180447 [0,2,0,0,0,0|2,0,0]=4 17740 B12R1.371 CC(CO)Oc1ccccc1Cl 7a_100000210172_100012180447 [0,2,0,0,0,0|2,0,0]=4 17741 B12R1.371 CC(CO)Oc1ccccc1F 34a_100000210171_100012180447 [0,2,0,0,0,0|2,0,0]=4 17742 B12R1.371 CC(CO)Oc1ccccc1F 7a_100000210171_100012180447 [0,2,0,0,0,0|2,0,0]=4 17743 B12R1.371 CC(CO)Oc1ccccc1I 34a_100000739446_100012180447 [0,2,0,0,0,0|2,0,0]=4 17744 B12R1.371 CC(CO)Oc1ccccc1I 7a_100000739446_100012180447 [0,2,0,0,0,0|2,0,0]=4 17745 B12R1.371 CC(CO)Oc1ccccc1N 34a_100000185747_100012180447 [0,2,0,0,0,0|2,0,0]=4 17746 B12R1.371 CC(CO)Oc1ccccc1N 7a_100000185747_100012180447 [0,2,0,0,0,0|2,0,0]=4 17747 B12R1.371 CC(CO)Sc1ccccc1Br 62a_100012180447_100000695589 [0,2,0,0,0,0|2,0,0]=4 17748 B12R1.371 CC(CO)Sc1ccccc1Cl 62a_100012180447_100000764095 [0,2,0,0,0,0|2,0,0]=4 17749 B12R1.371 CC(CO)Sc1ccccc1F 62a_100012180447_100011215700 [0,2,0,0,0,0|2,0,0]=4 17750 B12R1.371 CC(CO)Sc1ccccc1N 62a_100012180447_100000210017 [0,2,0,0,0,0|2,0,0]=4 17751 B12R1.371 CC(CO)Sc1ccccc1O 62a_100012180447_100000739446 [0,2,0,0,0,0|1,0,0]=3 17752 B12R1.371 CC(CO)Sc1cccnc1O 62a_100012180447_100000760158 [0,2,0,0,0,0|2,0,0]=4 17753 B12R1.371 CC(CO)Sc1ccncc1O 62a_100012180447_100009817591 [0,2,0,0,0,0|2,0,0]=4 17754 B12R1.371 CC(CO)Sc1ncccc1O 62a_100012180447_100000034122 [0,2,0,0,0,0|2,0,0]=4 17755 B12R1.371 CCC(=O)Cc1ccccc1Br 1458a_100000210414_100000184730 [0,2,0,0,0,0|1,0,0]=3 17756 B12R1.371 CCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210202 [0,2,0,0,0,0|1,0,0]=3 17757 B12R1.371 CCC(=O)Cc1ccccc1C 1458a_100000210414_100000211839 [0,2,0,0,0,0|1,0,0]=3 17758 B12R1.371 CCC(=O)Cc1ccccc1C 1458a_100000212180_100000210202 [0,2,0,0,0,0|1,0,0]=3 17759 B12R1.371 CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210202 [0,2,0,0,0,0|1,0,0]=3 17760 B12R1.371 CCC(=O)Cc1ccccc1Cl 1458a_100000210414_100000187162 [0,2,0,0,0,0|1,0,0]=3 17761 B12R1.371 CCC(=O)Cc1ccccc1F 1458a_100000210414_100000187165 [0,2,0,0,0,0|1,0,0]=3 17762 B12R1.371 CCC(=O)Cc1ccccc1F 1458a_100000212012_100000210202 [0,2,0,0,0,0|1,0,0]=3 17763 B12R1.371 CCC(=O)Cc1ccccc1I 1458a_100000036491_100000210202 [0,2,0,0,0,0|1,0,0]=3 17764 B12R1.371 CCC(=O)Cc1ccccc1I 1458a_100000210414_100011216222 [0,2,0,0,0,0|1,0,0]=3 17765 B12R1.371 CCC(=O)Cc1ccccc1O 1458a_100000743006_100000210202 [0,2,0,0,0,0|0,0,0]=2 17766 B12R1.371 CCC(=O)Cc1cccnc1Br 1458a_100000210414_100010140945 [0,2,0,0,0,0|2,0,0]=4 17767 B12R1.371 CCC(=O)Cc1cccnc1C 1458a_100000210414_100000732876 [0,2,0,0,0,0|2,0,0]=4 17768 B12R1.371 CCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000210202 [0,2,0,0,0,0|2,0,0]=4 17769 B12R1.371 CCC(=O)Cc1cccnc1Cl 1458a_100000210414_100000045678 [0,2,0,0,0,0|2,0,0]=4 17770 B12R1.371 CCC(=O)Cc1cccnc1F 1458a_100000210414_100000099810 [0,2,0,0,0,0|2,0,0]=4 17771 B12R1.371 CCC(=O)Cc1ccncc1C 1458a_100000210414_100020672808 [0,2,0,0,0,0|2,0,0]=4 17772 B12R1.371 CCC(=O)Cc1ccncc1Cl 1458a_100000210414_100000763264 [0,2,0,0,0,0|2,0,0]=4 17773 B12R1.371 CCC(=O)Cc1cnccc1C 1458a_100000210414_100000690890 [0,2,0,0,0,0|2,0,0]=4 17774 B12R1.371 CCC(=O)Cc1ncccc1Br 1458a_100000210414_100025702911 [0,2,0,0,0,0|2,0,0]=4 17775 B12R1.371 CCC(=O)Cc1ncccc1Br 1458a_200012357574_100000210202 [0,2,0,0,0,0|2,0,0]=4 17776 B12R1.371 CCC(=O)Cc1ncccc1C 1458a_100000210414_100000696600 [0,2,0,0,0,0|2,0,0]=4 17777 B12R1.371 CCC(=O)Cc1ncccc1C 1458a_200000722269_100000210202 [0,2,0,0,0,0|2,0,0]=4 17778 B12R1.371 CCC(=O)Cc1ncccc1Cl 1458a_100000210414_100000099807 [0,2,0,0,0,0|2,0,0]=4 17779 B12R1.371 CCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000210202 [0,2,0,0,0,0|2,0,0]=4 17780 B12R1.371 CCC(=O)Cc1ncccc1F 1458a_100000210414_100000104219 [0,2,0,0,0,0|2,0,0]=4 17781 B12R1.371 CCC(=O)Cc1ncccc1O 1458a_100000210414_200020655725 [0,2,0,0,0,0|1,0,0]=3 17782 B12R1.371 CCC(=O)Cn1ccccc1=O 1458a_100000189665_100000210202 [0,2,0,0,0,0|1,0,1]=4 17783 B12R1.371 CCC(=O)Nc1ccccc1Br 11a_100000210017_100000210414 [0,2,0,0,0,0|1,0,1]=4 17784 B12R1.371 CCC(=O)Nc1ccccc1Br 1626a_100000210017_100000210414 [0,2,0,0,0,0|1,0,1]=4 17785 B12R1.371 CCC(=O)Nc1ccccc1C 11a_100015192222_100000210414 [0,2,0,0,0,0|1,0,1]=4 17786 B12R1.371 CCC(=O)Nc1ccccc1C 1626a_100015192222_100000210414 [0,2,0,0,0,0|1,0,1]=4 17787 B12R1.371 CCC(=O)Nc1ccccc1C 22a_100015192222_100000210414 [0,2,0,0,0,0|1,0,1]=4 17788 B12R1.371 CCC(=O)Nc1ccccc1C 527a_100015192222_100000210414 [0,2,0,0,0,0|1,0,1]=4 17789 B12R1.371 CCC(=O)Nc1ccccc1Cl 11a_100000185783_100000210414 [0,2,0,0,0,0|1,0,1]=4 17790 B12R1.371 CCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000210414 [0,2,0,0,0,0|1,0,1]=4 17791 B12R1.371 CCC(=O)Nc1ccccc1Cl 22a_100000185783_100000210414 [0,2,0,0,0,0|1,0,1]=4 17792 B12R1.371 CCC(=O)Nc1ccccc1Cl 527a_100000185783_100000210414 [0,2,0,0,0,0|1,0,1]=4 17793 B12R1.371 CCC(=O)Nc1ccccc1F 11a_100000210422_100000210414 [0,2,0,0,0,0|1,0,1]=4 17794 B12R1.371 CCC(=O)Nc1ccccc1F 1626a_100000210422_100000210414 [0,2,0,0,0,0|1,0,1]=4 17795 B12R1.371 CCC(=O)Nc1ccccc1F 22a_100000210422_100000210414 [0,2,0,0,0,0|1,0,1]=4 17796 B12R1.371 CCC(=O)Nc1ccccc1F 527a_100000210422_100000210414 [0,2,0,0,0,0|1,0,1]=4 17797 B12R1.371 CCC(=O)Nc1ccccc1I 11a_100000210053_100000210414 [0,2,0,0,0,0|1,0,1]=4 17798 B12R1.371 CCC(=O)Nc1ccccc1I 1626a_100000210053_100000210414 [0,2,0,0,0,0|1,0,1]=4 17799 B12R1.371 CCC(=O)Nc1ccccc1O 22a_100000185747_100000210414 [0,2,0,0,0,0|0,0,1]=3 17800 B12R1.371 CCC(=O)Nc1ccccc1O 271570a_203496583355_100000153536 [0,2,0,0,0,0|0,0,1]=3 17801 B12R1.371 CCC(=O)Nc1ccccc1O 527a_100000185747_100000210414 [0,2,0,0,0,0|0,0,1]=3 17802 B12R1.371 CCC(C)Nc1ccccc1Br 34a_100000210017_100011215416 [0,2,0,0,0,0|1,0,0]=3 17803 B12R1.371 CCC(C)Nc1ccccc1C 34a_100015192222_100011215416 [0,2,0,0,0,0|1,0,0]=3 17804 B12R1.371 CCC(C)Nc1ccccc1Cl 34a_100000185783_100011215416 [0,2,0,0,0,0|1,0,0]=3 17805 B12R1.371 CCC(C)Nc1ccccc1F 34a_100000210422_100011215416 [0,2,0,0,0,0|1,0,0]=3 17806 B12R1.371 CCC(C)Nc1ccccc1I 34a_100000210053_100011215416 [0,2,0,0,0,0|1,0,0]=3 17807 B12R1.371 CCC(C)Nc1ccccc1O 34a_100000185747_100011215416 [0,2,0,0,0,0|0,0,0]=2 17808 B12R1.371 CCC(C)Oc1cccc[n+]1[O-] 7a_100000211761_100000758301 [0,2,0,0,0,0|1,0,1]=4 17809 B12R1.371 CCC(C)Oc1ccccc1Br 34a_100000181306_100011215416 [0,2,0,0,0,0|1,0,0]=3 17810 B12R1.371 CCC(C)Oc1ccccc1Br 7a_100000181306_100000758301 [0,2,0,0,0,0|1,0,0]=3 17811 B12R1.371 CCC(C)Oc1ccccc1C 34a_100000210338_100011215416 [0,2,0,0,0,0|1,0,0]=3 17812 B12R1.371 CCC(C)Oc1ccccc1C 7a_100000210338_100000758301 [0,2,0,0,0,0|1,0,0]=3 17813 B12R1.371 CCC(C)Oc1ccccc1Cl 34a_100000210172_100011215416 [0,2,0,0,0,0|1,0,0]=3 17814 B12R1.371 CCC(C)Oc1ccccc1Cl 7a_100000210172_100000758301 [0,2,0,0,0,0|1,0,0]=3 17815 B12R1.371 CCC(C)Oc1ccccc1F 34a_100000210171_100011215416 [0,2,0,0,0,0|1,0,0]=3 17816 B12R1.371 CCC(C)Oc1ccccc1F 7a_100000210171_100000758301 [0,2,0,0,0,0|1,0,0]=3 17817 B12R1.371 CCC(C)Oc1ccccc1I 34a_100000739446_100011215416 [0,2,0,0,0,0|1,0,0]=3 17818 B12R1.371 CCC(C)Oc1ccccc1I 7a_100000739446_100000758301 [0,2,0,0,0,0|1,0,0]=3 17819 B12R1.371 CCC(C)Oc1ccccc1N 34a_100000185747_100011215416 [0,2,0,0,0,0|1,0,0]=3 17820 B12R1.371 CCC(C)Oc1ccccc1N 7a_100000185747_100000758301 [0,2,0,0,0,0|1,0,0]=3 17821 B12R1.371 CCC(C)Oc1cccnc1Br 34a_100000744436_100011215416 [0,2,0,0,0,0|2,0,0]=4 17822 B12R1.371 CCC(C)Oc1cccnc1Br 7a_100000744436_100000758301 [0,2,0,0,0,0|2,0,0]=4 17823 B12R1.371 CCC(C)Oc1cccnc1C 34a_100000745507_100011215416 [0,2,0,0,0,0|2,0,0]=4 17824 B12R1.371 CCC(C)Oc1cccnc1C 7a_100000745507_100000758301 [0,2,0,0,0,0|2,0,0]=4 17825 B12R1.371 CCC(C)Oc1cccnc1Cl 34a_100000757616_100011215416 [0,2,0,0,0,0|2,0,0]=4 17826 B12R1.371 CCC(C)Oc1cccnc1Cl 7a_100000757616_100000758301 [0,2,0,0,0,0|2,0,0]=4 17827 B12R1.371 CCC(C)Oc1cccnc1F 34a_100000061740_100011215416 [0,2,0,0,0,0|2,0,0]=4 17828 B12R1.371 CCC(C)Oc1cccnc1F 7a_100000061740_100000758301 [0,2,0,0,0,0|2,0,0]=4 17829 B12R1.371 CCC(C)Oc1cccnc1I 34a_100000034122_100011215416 [0,2,0,0,0,0|2,0,0]=4 17830 B12R1.371 CCC(C)Oc1cccnc1I 7a_100000034122_100000758301 [0,2,0,0,0,0|2,0,0]=4 17831 B12R1.371 CCC(C)Oc1cccnc1N 34a_100000211975_100011215416 [0,2,0,0,0,0|2,0,0]=4 17832 B12R1.371 CCC(C)Oc1cccnc1N 7a_100000211975_100000758301 [0,2,0,0,0,0|2,0,0]=4 17833 B12R1.371 CCC(C)Oc1cccoc1=O 34a_100000077404_100011215416 [0,2,0,0,0,0|1,0,1]=4 17834 B12R1.371 CCC(C)Oc1cccoc1=O 7a_100000077404_100000758301 [0,2,0,0,0,0|1,0,1]=4 17835 B12R1.371 CCC(C)Oc1ccncc1Br 34a_100011996408_100011215416 [0,2,0,0,0,0|2,0,0]=4 17836 B12R1.371 CCC(C)Oc1ccncc1C 34a_100000694293_100011215416 [0,2,0,0,0,0|2,0,0]=4 17837 B12R1.371 CCC(C)Oc1ccncc1Cl 34a_100011997054_100011215416 [0,2,0,0,0,0|2,0,0]=4 17838 B12R1.371 CCC(C)Oc1ccncc1F 34a_200000081243_100011215416 [0,2,0,0,0,0|2,0,0]=4 17839 B12R1.371 CCC(C)Oc1cnccc1C 34a_100011997053_100011215416 [0,2,0,0,0,0|2,0,0]=4 17840 B12R1.371 CCC(C)Oc1cnccc1C 7a_100011997053_100000758301 [0,2,0,0,0,0|2,0,0]=4 17841 B12R1.371 CCC(C)Oc1cnccc1Cl 34a_100011996695_100011215416 [0,2,0,0,0,0|2,0,0]=4 17842 B12R1.371 CCC(C)Oc1cnccc1I 34a_100000050107_100011215416 [0,2,0,0,0,0|2,0,0]=4 17843 B12R1.371 CCC(C)Oc1cnccc1N 34a_100000753702_100011215416 [0,2,0,0,0,0|2,0,0]=4 17844 B12R1.371 CCC(C)Oc1coccc1=O 34a_100000060831_100011215416 [0,2,0,0,0,0|1,0,1]=4 17845 B12R1.371 CCC(C)Oc1ncccc1Cl 34a_100011290957_100011215416 [0,2,0,0,0,0|2,0,0]=4 17846 B12R1.371 CCC(C)Oc1ncccc1F 34a_100011219419_100011215416 [0,2,0,0,0,0|2,0,0]=4 17847 B12R1.371 CCC(C)Oc1ncccc1N 34a_100000746358_100011215416 [0,2,0,0,0,0|2,0,0]=4 17848 B12R1.371 CCC(C)Sc1c[nH]ccc1=O 62a_100000758301_100009998708 [0,2,0,0,0,0|1,0,1]=4 17849 B12R1.371 CCC(C)Sc1c[nH]ccc1=O 62a_100009998708_100000758301 [0,2,0,0,0,0|1,0,1]=4 17850 B12R1.371 CCC(C)Sc1c[nH]ccc1=S 62a_100000758301_200012280681 [0,2,0,0,0,0|1,1,0]=4 17851 B12R1.371 CCC(C)Sc1c[nH]ccc1=S 62a_200012280681_100000758301 [0,2,0,0,0,0|1,1,0]=4 17852 B12R1.371 CCC(C)Sc1cccc[n+]1C 62a_100000758301_100000212160 [0,2,0,0,0,0|2,0,0]=4 17853 B12R1.371 CCC(C)Sc1cccc[n+]1[O-] 62a_100000758301_200000042595 [0,2,0,0,0,0|1,0,1]=4 17854 B12R1.371 CCC(C)Sc1ccccc1Br 62a_100000695589_100000758301 [0,2,0,0,0,0|1,0,0]=3 17855 B12R1.371 CCC(C)Sc1ccccc1Br 62a_100000758301_100000695589 [0,2,0,0,0,0|1,0,0]=3 17856 B12R1.371 CCC(C)Sc1ccccc1C 62a_100000210755_100000758301 [0,2,0,0,0,0|1,0,0]=3 17857 B12R1.371 CCC(C)Sc1ccccc1C 62a_100000758301_100000210755 [0,2,0,0,0,0|1,0,0]=3 17858 B12R1.371 CCC(C)Sc1ccccc1Cl 62a_100000758301_100000764095 [0,2,0,0,0,0|1,0,0]=3 17859 B12R1.371 CCC(C)Sc1ccccc1Cl 62a_100000764095_100000758301 [0,2,0,0,0,0|1,0,0]=3 17860 B12R1.371 CCC(C)Sc1ccccc1F 62a_100000758301_100011215700 [0,2,0,0,0,0|1,0,0]=3 17861 B12R1.371 CCC(C)Sc1ccccc1F 62a_100011215700_100000758301 [0,2,0,0,0,0|1,0,0]=3 17862 B12R1.371 CCC(C)Sc1ccccc1N 62a_100000210017_100000758301 [0,2,0,0,0,0|1,0,0]=3 17863 B12R1.371 CCC(C)Sc1ccccc1N 62a_100000758301_100000210017 [0,2,0,0,0,0|1,0,0]=3 17864 B12R1.371 CCC(C)Sc1ccccc1O 62a_100000739446_100000758301 [0,2,0,0,0,0|0,0,0]=2 17865 B12R1.371 CCC(C)Sc1ccccc1O 62a_100000758301_100000739446 [0,2,0,0,0,0|0,0,0]=2 17866 B12R1.371 CCC(C)Sc1cccnc1Br 62a_100000758301_100010202626 [0,2,0,0,0,0|2,0,0]=4 17867 B12R1.371 CCC(C)Sc1cccnc1Br 62a_100010202626_100000758301 [0,2,0,0,0,0|2,0,0]=4 17868 B12R1.371 CCC(C)Sc1cccnc1C 62a_100000751574_100000758301 [0,2,0,0,0,0|2,0,0]=4 17869 B12R1.371 CCC(C)Sc1cccnc1C 62a_100000758301_100000751574 [0,2,0,0,0,0|2,0,0]=4 17870 B12R1.371 CCC(C)Sc1cccnc1Cl 62a_100000036424_100000758301 [0,2,0,0,0,0|2,0,0]=4 17871 B12R1.371 CCC(C)Sc1cccnc1Cl 62a_100000758301_100000036424 [0,2,0,0,0,0|2,0,0]=4 17872 B12R1.371 CCC(C)Sc1cccnc1F 62a_100000758301_100009816115 [0,2,0,0,0,0|2,0,0]=4 17873 B12R1.371 CCC(C)Sc1cccnc1F 62a_100009816115_100000758301 [0,2,0,0,0,0|2,0,0]=4 17874 B12R1.371 CCC(C)Sc1cccnc1N 62a_100000045569_100000758301 [0,2,0,0,0,0|2,0,0]=4 17875 B12R1.371 CCC(C)Sc1cccnc1N 62a_100000758301_100000045569 [0,2,0,0,0,0|2,0,0]=4 17876 B12R1.371 CCC(C)Sc1cccnc1O 62a_100000758301_100000760158 [0,2,0,0,0,0|1,0,0]=3 17877 B12R1.371 CCC(C)Sc1cccnc1O 62a_100000760158_100000758301 [0,2,0,0,0,0|1,0,0]=3 17878 B12R1.371 CCC(C)Sc1ccncc1Br 62a_100000726257_100000758301 [0,2,0,0,0,0|2,0,0]=4 17879 B12R1.371 CCC(C)Sc1ccncc1Br 62a_100000758301_100000726257 [0,2,0,0,0,0|2,0,0]=4 17880 B12R1.371 CCC(C)Sc1ccncc1C 62a_100000758301_100000765111 [0,2,0,0,0,0|2,0,0]=4 17881 B12R1.371 CCC(C)Sc1ccncc1C 62a_100000765111_100000758301 [0,2,0,0,0,0|2,0,0]=4 17882 B12R1.371 CCC(C)Sc1ccncc1Cl 62a_100000708259_100000758301 [0,2,0,0,0,0|2,0,0]=4 17883 B12R1.371 CCC(C)Sc1ccncc1Cl 62a_100000758301_100000708259 [0,2,0,0,0,0|2,0,0]=4 17884 B12R1.371 CCC(C)Sc1ccncc1F 62a_100000047030_100000758301 [0,2,0,0,0,0|2,0,0]=4 17885 B12R1.371 CCC(C)Sc1ccncc1F 62a_100000758301_100000047030 [0,2,0,0,0,0|2,0,0]=4 17886 B12R1.371 CCC(C)Sc1ccncc1N 62a_100000756074_100000758301 [0,2,0,0,0,0|2,0,0]=4 17887 B12R1.371 CCC(C)Sc1ccncc1N 62a_100000758301_100000756074 [0,2,0,0,0,0|2,0,0]=4 17888 B12R1.371 CCC(C)Sc1ccncc1O 62a_100000758301_100009817591 [0,2,0,0,0,0|1,0,0]=3 17889 B12R1.371 CCC(C)Sc1ccncc1O 62a_100009817591_100000758301 [0,2,0,0,0,0|1,0,0]=3 17890 B12R1.371 CCC(C)Sc1cnccc1Br 62a_100000758301_100010138639 [0,2,0,0,0,0|2,0,0]=4 17891 B12R1.371 CCC(C)Sc1cnccc1Br 62a_100010138639_100000758301 [0,2,0,0,0,0|2,0,0]=4 17892 B12R1.371 CCC(C)Sc1cnccc1C 62a_100000758301_100000761580 [0,2,0,0,0,0|2,0,0]=4 17893 B12R1.371 CCC(C)Sc1cnccc1C 62a_100000761580_100000758301 [0,2,0,0,0,0|2,0,0]=4 17894 B12R1.371 CCC(C)Sc1cnccc1Cl 62a_100000758301_100009995489 [0,2,0,0,0,0|2,0,0]=4 17895 B12R1.371 CCC(C)Sc1cnccc1Cl 62a_100009995489_100000758301 [0,2,0,0,0,0|2,0,0]=4 17896 B12R1.371 CCC(C)Sc1cnccc1F 62a_100000758301_100009820683 [0,2,0,0,0,0|2,0,0]=4 17897 B12R1.371 CCC(C)Sc1cnccc1F 62a_100009820683_100000758301 [0,2,0,0,0,0|2,0,0]=4 17898 B12R1.371 CCC(C)Sc1cnccc1N 62a_100000047001_100000758301 [0,2,0,0,0,0|2,0,0]=4 17899 B12R1.371 CCC(C)Sc1cnccc1N 62a_100000758301_100000047001 [0,2,0,0,0,0|2,0,0]=4 17900 B12R1.371 CCC(C)Sc1cncnc1O 62a_100000751107_100000758301 [0,2,0,0,0,0|2,0,0]=4 17901 B12R1.371 CCC(C)Sc1cncnc1O 62a_100000758301_100000751107 [0,2,0,0,0,0|2,0,0]=4 17902 B12R1.371 CCC(C)Sc1ncccc1Br 62a_100000696092_100000758301 [0,2,0,0,0,0|2,0,0]=4 17903 B12R1.371 CCC(C)Sc1ncccc1Br 62a_100000758301_100000696092 [0,2,0,0,0,0|2,0,0]=4 17904 B12R1.371 CCC(C)Sc1ncccc1C 62a_100000751373_100000758301 [0,2,0,0,0,0|2,0,0]=4 17905 B12R1.371 CCC(C)Sc1ncccc1C 62a_100000758301_100000751373 [0,2,0,0,0,0|2,0,0]=4 17906 B12R1.371 CCC(C)Sc1ncccc1Cl 62a_100000758301_100011356963 [0,2,0,0,0,0|2,0,0]=4 17907 B12R1.371 CCC(C)Sc1ncccc1Cl 62a_100011356963_100000758301 [0,2,0,0,0,0|2,0,0]=4 17908 B12R1.371 CCC(C)Sc1ncccc1F 62a_100000685392_100000758301 [0,2,0,0,0,0|2,0,0]=4 17909 B12R1.371 CCC(C)Sc1ncccc1F 62a_100000758301_100000685392 [0,2,0,0,0,0|2,0,0]=4 17910 B12R1.371 CCC(C)Sc1ncccc1N 62a_100000688686_100000758301 [0,2,0,0,0,0|2,0,0]=4 17911 B12R1.371 CCC(C)Sc1ncccc1N 62a_100000758301_100000688686 [0,2,0,0,0,0|2,0,0]=4 17912 B12R1.371 CCC(C)Sc1ncccc1O 62a_100000034122_100000758301 [0,2,0,0,0,0|1,0,0]=3 17913 B12R1.371 CCC(C)Sc1ncccc1O 62a_100000758301_100000034122 [0,2,0,0,0,0|1,0,0]=3 17914 B12R1.371 CCN(C)Cc1ccccc1Br 2230a_100000184654_100000210202 [0,2,0,0,0,0|1,0,0]=3 17915 B12R1.371 CCN(C)Cc1ccccc1Br 2230a_100000225621_100000184730 [0,2,0,0,0,0|1,0,0]=3 17916 B12R1.371 CCN(C)Cc1ccccc1Br 269982a_100000184654_100000204670 [0,2,0,0,0,0|1,0,0]=3 17917 B12R1.371 CCN(C)Cc1ccccc1Br 269982a_100000225621_100000184730 [0,2,0,0,0,0|1,0,0]=3 17918 B12R1.371 CCN(C)Cc1ccccc1Br 26a_100000225621_100000181306 [0,2,0,0,0,0|1,0,0]=3 17919 B12R1.371 CCN(C)Cc1ccccc1C 2230a_100000184421_100000210202 [0,2,0,0,0,0|1,0,0]=3 17920 B12R1.371 CCN(C)Cc1ccccc1C 2230a_100000201206_200000210301 [0,2,0,0,0,0|1,0,0]=3 17921 B12R1.371 CCN(C)Cc1ccccc1C 2230a_100000225621_100000211839 [0,2,0,0,0,0|1,0,0]=3 17922 B12R1.371 CCN(C)Cc1ccccc1C 269982a_100000184421_100000204670 [0,2,0,0,0,0|1,0,0]=3 17923 B12R1.371 CCN(C)Cc1ccccc1C 269982a_100000201206_200000210301 [0,2,0,0,0,0|1,0,0]=3 17924 B12R1.371 CCN(C)Cc1ccccc1C 269982a_100000225621_100000211839 [0,2,0,0,0,0|1,0,0]=3 17925 B12R1.371 CCN(C)Cc1ccccc1Cl 2230a_100000184507_100000210202 [0,2,0,0,0,0|1,0,0]=3 17926 B12R1.371 CCN(C)Cc1ccccc1Cl 2230a_100000201176_200000210301 [0,2,0,0,0,0|1,0,0]=3 17927 B12R1.371 CCN(C)Cc1ccccc1Cl 2230a_100000225621_100000187162 [0,2,0,0,0,0|1,0,0]=3 17928 B12R1.371 CCN(C)Cc1ccccc1Cl 269982a_100000184507_100000204670 [0,2,0,0,0,0|1,0,0]=3 17929 B12R1.371 CCN(C)Cc1ccccc1Cl 269982a_100000201176_200000210301 [0,2,0,0,0,0|1,0,0]=3 17930 B12R1.371 CCN(C)Cc1ccccc1Cl 269982a_100000225621_100000187162 [0,2,0,0,0,0|1,0,0]=3 17931 B12R1.371 CCN(C)Cc1ccccc1Cl 26a_100000225621_100000210172 [0,2,0,0,0,0|1,0,0]=3 17932 B12R1.371 CCN(C)Cc1ccccc1F 2230a_100000225621_100000211605 [0,2,0,0,0,0|1,0,0]=3 17933 B12R1.371 CCN(C)Cc1ccccc1F 2230a_100000742528_100000210202 [0,2,0,0,0,0|1,0,0]=3 17934 B12R1.371 CCN(C)Cc1ccccc1F 2230a_100015186831_200000210301 [0,2,0,0,0,0|1,0,0]=3 17935 B12R1.371 CCN(C)Cc1ccccc1F 269982a_100000225621_100000211605 [0,2,0,0,0,0|1,0,0]=3 17936 B12R1.371 CCN(C)Cc1ccccc1F 269982a_100000742528_100000204670 [0,2,0,0,0,0|1,0,0]=3 17937 B12R1.371 CCN(C)Cc1ccccc1F 269982a_100015186831_200000210301 [0,2,0,0,0,0|1,0,0]=3 17938 B12R1.371 CCN(C)Cc1ccccc1F 34a_100000742528_100000210202 [0,2,0,0,0,0|1,0,0]=3 17939 B12R1.371 CCN(C)Cc1ccccc1F 34a_100015186831_200000210301 [0,2,0,0,0,0|1,0,0]=3 17940 B12R1.371 CCN(C)Cc1ccccc1I 2230a_100000225621_100011215278 [0,2,0,0,0,0|1,0,0]=3 17941 B12R1.371 CCN(C)Cc1ccccc1I 269982a_100000225621_100011215278 [0,2,0,0,0,0|1,0,0]=3 17942 B12R1.371 CCN(C)Cc1ccccc1O 2230a_100011223546_200000210301 [0,2,0,0,0,0|0,0,0]=2 17943 B12R1.371 CCN(C)Cc1ccccc1O 2230a_100015189988_100000210202 [0,2,0,0,0,0|0,0,0]=2 17944 B12R1.371 CCN(C)Cc1ccccc1O 269982a_100011223546_200000210301 [0,2,0,0,0,0|0,0,0]=2 17945 B12R1.371 CCN(C)Cc1ccccc1O 269982a_100015189988_100000204670 [0,2,0,0,0,0|0,0,0]=2 17946 B12R1.371 CCN(C)Cc1cccnc1Br 2230a_100000225621_100010140945 [0,2,0,0,0,0|2,0,0]=4 17947 B12R1.371 CCN(C)Cc1cccnc1Br 269982a_100000225621_100010140945 [0,2,0,0,0,0|2,0,0]=4 17948 B12R1.371 CCN(C)Cc1cccnc1C 2230a_100000225621_100000732876 [0,2,0,0,0,0|2,0,0]=4 17949 B12R1.371 CCN(C)Cc1cccnc1C 2230a_200011875998_100000210202 [0,2,0,0,0,0|2,0,0]=4 17950 B12R1.371 CCN(C)Cc1cccnc1C 269982a_100000225621_100000732876 [0,2,0,0,0,0|2,0,0]=4 17951 B12R1.371 CCN(C)Cc1cccnc1C 269982a_200011875998_100000204670 [0,2,0,0,0,0|2,0,0]=4 17952 B12R1.371 CCN(C)Cc1cccnc1Cl 2230a_100000225621_100000045678 [0,2,0,0,0,0|2,0,0]=4 17953 B12R1.371 CCN(C)Cc1cccnc1Cl 2230a_103496529121_100000210202 [0,2,0,0,0,0|2,0,0]=4 17954 B12R1.371 CCN(C)Cc1cccnc1Cl 269982a_100000225621_100000045678 [0,2,0,0,0,0|2,0,0]=4 17955 B12R1.371 CCN(C)Cc1cccnc1Cl 269982a_103496529121_100000204670 [0,2,0,0,0,0|2,0,0]=4 17956 B12R1.371 CCN(C)Cc1cccnc1F 2230a_100000225621_100000099810 [0,2,0,0,0,0|2,0,0]=4 17957 B12R1.371 CCN(C)Cc1cccnc1F 269982a_100000225621_100000099810 [0,2,0,0,0,0|2,0,0]=4 17958 B12R1.371 CCN(C)Cc1ccncc1C 2230a_100000225621_100020672808 [0,2,0,0,0,0|2,0,0]=4 17959 B12R1.371 CCN(C)Cc1ccncc1C 2230a_100015187836_100000210202 [0,2,0,0,0,0|2,0,0]=4 17960 B12R1.371 CCN(C)Cc1ccncc1C 269982a_100000225621_100020672808 [0,2,0,0,0,0|2,0,0]=4 17961 B12R1.371 CCN(C)Cc1ccncc1C 269982a_100015187836_100000204670 [0,2,0,0,0,0|2,0,0]=4 17962 B12R1.371 CCN(C)Cc1ccncc1Cl 2230a_100000225621_100000763264 [0,2,0,0,0,0|2,0,0]=4 17963 B12R1.371 CCN(C)Cc1ccncc1Cl 269982a_100000225621_100000763264 [0,2,0,0,0,0|2,0,0]=4 17964 B12R1.371 CCN(C)Cc1cnccc1C 2230a_100000225621_100000690890 [0,2,0,0,0,0|2,0,0]=4 17965 B12R1.371 CCN(C)Cc1cnccc1C 269982a_100000225621_100000690890 [0,2,0,0,0,0|2,0,0]=4 17966 B12R1.371 CCN(C)Cc1ncccc1Br 2230a_100000225621_100025702911 [0,2,0,0,0,0|2,0,0]=4 17967 B12R1.371 CCN(C)Cc1ncccc1C 2230a_100000225621_100000696600 [0,2,0,0,0,0|2,0,0]=4 17968 B12R1.371 CCN(C)Cc1ncccc1C 269982a_100000225621_100000696600 [0,2,0,0,0,0|2,0,0]=4 17969 B12R1.371 CCN(C)Cc1ncccc1Cl 2230a_100000225621_100000099807 [0,2,0,0,0,0|2,0,0]=4 17970 B12R1.371 CCN(C)Cc1ncccc1Cl 269982a_100000225621_100000099807 [0,2,0,0,0,0|2,0,0]=4 17971 B12R1.371 CCN(C)Cc1ncccc1F 2230a_100000225621_100000104219 [0,2,0,0,0,0|2,0,0]=4 17972 B12R1.371 CCN(C)Cc1ncccc1F 269982a_100000225621_100000104219 [0,2,0,0,0,0|2,0,0]=4 17973 B12R1.371 CCN([13CH3])Cc1ccccc1C 2230a_100000201206_200025704644 [0,2,0,0,0,0|1,0,0]=3 17974 B12R1.371 CCN([13CH3])Cc1ccccc1C 269982a_100000201206_200025704644 [0,2,0,0,0,0|1,0,0]=3 17975 B12R1.371 CCN([13CH3])Cc1ccccc1Cl 2230a_100000201176_200025704644 [0,2,0,0,0,0|1,0,0]=3 17976 B12R1.371 CCN([13CH3])Cc1ccccc1Cl 269982a_100000201176_200025704644 [0,2,0,0,0,0|1,0,0]=3 17977 B12R1.371 CCN([13CH3])Cc1ccccc1F 2230a_100015186831_200025704644 [0,2,0,0,0,0|1,0,0]=3 17978 B12R1.371 CCN([13CH3])Cc1ccccc1F 269982a_100015186831_200025704644 [0,2,0,0,0,0|1,0,0]=3 17979 B12R1.371 CCN([13CH3])Cc1ccccc1F 34a_100015186831_200025704644 [0,2,0,0,0,0|1,0,0]=3 17980 B12R1.371 CCN([13CH3])Cc1ccccc1O 2230a_100011223546_200025704644 [0,2,0,0,0,0|0,0,0]=2 17981 B12R1.371 CCN([13CH3])Cc1ccccc1O 269982a_100011223546_200025704644 [0,2,0,0,0,0|0,0,0]=2 17982 B12R1.371 CN(CF)Cc1ccccc1Br 269982a_100000184654_100015361967 [0,2,0,0,0,0|2,0,0]=4 17983 B12R1.371 CN(CF)Cc1ccccc1Cl 269982a_100000184507_100015361967 [0,2,0,0,0,0|2,0,0]=4 17984 B12R1.371 CN(CF)Cc1ccccc1F 269982a_100000742528_100015361967 [0,2,0,0,0,0|2,0,0]=4 17985 B12R1.371 CN(CF)Cc1ccccc1F 34a_100000742528_100015361967 [0,2,0,0,0,0|2,0,0]=4 17986 B12R1.371 CN(CF)Cc1ccccc1O 269982a_100015189988_100015361967 [0,2,0,0,0,0|1,0,0]=3 17987 B12R1.371 CNC(=O)Cc1ccccc1Br 11a_106832991635_100000751119 [0,2,0,0,0,0|1,0,1]=4 17988 B12R1.371 CNC(=O)Cc1ccccc1Br 240690a_100102657272_100000751119 [0,2,0,0,0,0|1,0,1]=4 17989 B12R1.371 CNC(=O)Cc1ccccc1Br 527a_100102657272_100000751119 [0,2,0,0,0,0|1,0,1]=4 17990 B12R1.371 CNC(=O)Cc1ccccc1C 11a_106832991635_100000212180 [0,2,0,0,0,0|1,0,1]=4 17991 B12R1.371 CNC(=O)Cc1ccccc1C 1626a_100102657272_100000212180 [0,2,0,0,0,0|1,0,1]=4 17992 B12R1.371 CNC(=O)Cc1ccccc1C 240690a_100102657272_100000212180 [0,2,0,0,0,0|1,0,1]=4 17993 B12R1.371 CNC(=O)Cc1ccccc1C 527a_100102657272_100000212180 [0,2,0,0,0,0|1,0,1]=4 17994 B12R1.371 CNC(=O)Cc1ccccc1Cl 11a_106832991635_100000183793 [0,2,0,0,0,0|1,0,1]=4 17995 B12R1.371 CNC(=O)Cc1ccccc1Cl 1626a_100102657272_100000183793 [0,2,0,0,0,0|1,0,1]=4 17996 B12R1.371 CNC(=O)Cc1ccccc1Cl 240690a_100102657272_100000183793 [0,2,0,0,0,0|1,0,1]=4 17997 B12R1.371 CNC(=O)Cc1ccccc1Cl 527a_100102657272_100000183793 [0,2,0,0,0,0|1,0,1]=4 17998 B12R1.371 CNC(=O)Cc1ccccc1F 11a_106832991635_100000212012 [0,2,0,0,0,0|1,0,1]=4 17999 B12R1.371 CNC(=O)Cc1ccccc1F 1626a_100102657272_100000212012 [0,2,0,0,0,0|1,0,1]=4 18000 B12R1.371 CNC(=O)Cc1ccccc1F 240690a_100102657272_100000212012 [0,2,0,0,0,0|1,0,1]=4 18001 B12R1.371 CNC(=O)Cc1ccccc1F 527a_100102657272_100000212012 [0,2,0,0,0,0|1,0,1]=4 18002 B12R1.371 CNC(=O)Cc1ccccc1I 11a_106832991635_100000036491 [0,2,0,0,0,0|1,0,1]=4 18003 B12R1.371 CNC(=O)Cc1ccccc1I 1626a_100102657272_100000036491 [0,2,0,0,0,0|1,0,1]=4 18004 B12R1.371 CNC(=O)Cc1ccccc1I 240690a_100102657272_100000036491 [0,2,0,0,0,0|1,0,1]=4 18005 B12R1.371 CNC(=O)Cc1ccccc1I 527a_100102657272_100000036491 [0,2,0,0,0,0|1,0,1]=4 18006 B12R1.371 CNC(=O)Cc1ccccc1O 240690a_100102657272_100000743006 [0,2,0,0,0,0|0,0,1]=3 18007 B12R1.371 CNC(=O)Cc1ccccc1O 271570a_203496583355_200009816160 [0,2,0,0,0,0|0,0,1]=3 18008 B12R1.371 CNC(=O)Cc1ccccc1O 527a_100102657272_100000743006 [0,2,0,0,0,0|0,0,1]=3 18009 B12R1.371 CNC(=O)Nc1ccccc1O 2430a_100000185747_100102657272 [0,2,0,0,0,0|1,0,1]=4 18010 B12R1.371 CNC(C)Cc1ccccc1Br 270004a_106832991635_100011350739 [0,2,0,0,0,0|1,0,0]=3 18011 B12R1.371 CNC(C)Cc1ccccc1C 270004a_106832991635_200000764500 [0,2,0,0,0,0|1,0,0]=3 18012 B12R1.371 CNC(C)Cc1ccccc1Cl 270004a_106832991635_100000758791 [0,2,0,0,0,0|1,0,0]=3 18013 B12R1.371 CNC(C)Cc1ccccc1F 270004a_106832991635_100000709178 [0,2,0,0,0,0|1,0,0]=3 18014 B12R1.371 CNC(C)Cc1ncccc1C 270004a_106832991635_100011823981 [0,2,0,0,0,0|2,0,0]=4 18015 B12R1.371 COC(=O)Cc1ccccc1O 271570a_203496583355_100000699816 [0,2,0,0,0,0|0,0,1]=3 18016 B12R1.371 COC(=O)Cc1cccnc1O 271570a_203496583355_100010293180 [0,2,0,0,0,0|1,0,1]=4 18017 B12R1.371 COC(=O)Cc1ncccc1O 271570a_203496583355_100012347948 [0,2,0,0,0,0|1,0,1]=4 18018 B12R1.371 COC(=O)Nc1ccccc1O 271570a_203496583355_100000216184 [0,2,0,0,0,0|1,0,1]=4 18019 B12R1.371 COC(C)Sc1ccccc1Br 62a_100000695589_100009879195 [0,2,0,0,0,0|2,0,0]=4 18020 B12R1.371 COC(C)Sc1ccccc1Br 62a_100009879195_100000695589 [0,2,0,0,0,0|2,0,0]=4 18021 B12R1.371 COC(C)Sc1ccccc1C 62a_100000210755_100009879195 [0,2,0,0,0,0|2,0,0]=4 18022 B12R1.371 COC(C)Sc1ccccc1C 62a_100009879195_100000210755 [0,2,0,0,0,0|2,0,0]=4 18023 B12R1.371 COC(C)Sc1ccccc1Cl 62a_100000764095_100009879195 [0,2,0,0,0,0|2,0,0]=4 18024 B12R1.371 COC(C)Sc1ccccc1Cl 62a_100009879195_100000764095 [0,2,0,0,0,0|2,0,0]=4 18025 B12R1.371 COC(C)Sc1ccccc1F 62a_100009879195_100011215700 [0,2,0,0,0,0|2,0,0]=4 18026 B12R1.371 COC(C)Sc1ccccc1F 62a_100011215700_100009879195 [0,2,0,0,0,0|2,0,0]=4 18027 B12R1.371 COC(C)Sc1ccccc1N 62a_100000210017_100009879195 [0,2,0,0,0,0|2,0,0]=4 18028 B12R1.371 COC(C)Sc1ccccc1N 62a_100009879195_100000210017 [0,2,0,0,0,0|2,0,0]=4 18029 B12R1.371 COC(C)Sc1ccccc1O 62a_100000739446_100009879195 [0,2,0,0,0,0|1,0,0]=3 18030 B12R1.371 COC(C)Sc1ccccc1O 62a_100009879195_100000739446 [0,2,0,0,0,0|1,0,0]=3 18031 B12R1.371 COC(C)Sc1cccnc1O 62a_100000760158_100009879195 [0,2,0,0,0,0|2,0,0]=4 18032 B12R1.371 COC(C)Sc1cccnc1O 62a_100009879195_100000760158 [0,2,0,0,0,0|2,0,0]=4 18033 B12R1.371 COC(C)Sc1ccncc1O 62a_100009817591_100009879195 [0,2,0,0,0,0|2,0,0]=4 18034 B12R1.371 COC(C)Sc1ccncc1O 62a_100009879195_100009817591 [0,2,0,0,0,0|2,0,0]=4 18035 B12R1.371 COC(C)Sc1ncccc1O 62a_100000034122_100009879195 [0,2,0,0,0,0|2,0,0]=4 18036 B12R1.371 COC(C)Sc1ncccc1O 62a_100009879195_100000034122 [0,2,0,0,0,0|2,0,0]=4 18037 B12R1.371 C[C@H](CO)Sc1ccccc1Br 62a_100000695589_100016084084 [0,2,0,0,0,0|2,0,0]=4 18038 B12R1.371 C[C@H](CO)Sc1ccccc1Br 62a_100016084084_100000695589 [0,2,0,0,0,0|2,0,0]=4 18039 B12R1.371 C[C@H](CO)Sc1ccccc1Cl 62a_100000764095_100016084084 [0,2,0,0,0,0|2,0,0]=4 18040 B12R1.371 C[C@H](CO)Sc1ccccc1Cl 62a_100016084084_100000764095 [0,2,0,0,0,0|2,0,0]=4 18041 B12R1.371 C[C@H](CO)Sc1ccccc1F 62a_100011215700_100016084084 [0,2,0,0,0,0|2,0,0]=4 18042 B12R1.371 C[C@H](CO)Sc1ccccc1F 62a_100016084084_100011215700 [0,2,0,0,0,0|2,0,0]=4 18043 B12R1.371 C[C@H](CO)Sc1ccccc1N 62a_100000210017_100016084084 [0,2,0,0,0,0|2,0,0]=4 18044 B12R1.371 C[C@H](CO)Sc1ccccc1N 62a_100016084084_100000210017 [0,2,0,0,0,0|2,0,0]=4 18045 B12R1.371 C[C@H](CO)Sc1ccccc1O 62a_100000739446_100016084084 [0,2,0,0,0,0|1,0,0]=3 18046 B12R1.371 C[C@H](CO)Sc1ccccc1O 62a_100016084084_100000739446 [0,2,0,0,0,0|1,0,0]=3 18047 B12R1.371 C[C@H](CO)Sc1cccnc1O 62a_100000760158_100016084084 [0,2,0,0,0,0|2,0,0]=4 18048 B12R1.371 C[C@H](CO)Sc1cccnc1O 62a_100016084084_100000760158 [0,2,0,0,0,0|2,0,0]=4 18049 B12R1.371 C[C@H](CO)Sc1ccncc1O 62a_100009817591_100016084084 [0,2,0,0,0,0|2,0,0]=4 18050 B12R1.371 C[C@H](CO)Sc1ccncc1O 62a_100016084084_100009817591 [0,2,0,0,0,0|2,0,0]=4 18051 B12R1.371 C[C@H](CO)Sc1ncccc1O 62a_100000034122_100016084084 [0,2,0,0,0,0|2,0,0]=4 18052 B12R1.371 C[C@H](CO)Sc1ncccc1O 62a_100016084084_100000034122 [0,2,0,0,0,0|2,0,0]=4 18053 B12R1.371 Cc1ccccc1CC(=O)CF 1458a_100000212180_100015361967 [0,2,0,0,0,0|1,0,1]=4 18054 B12R1.371 Cc1ccccc1CC(=O)CO 1458a_100000210174_100000211839 [0,2,0,0,0,0|1,0,1]=4 18055 B12R1.371 Cc1ccccc1CN(C)CF 269982a_100000184421_100015361967 [0,2,0,0,0,0|2,0,0]=4 18056 B12R1.371 Cc1ccccc1NC(C)CO 34a_100015192222_100012180447 [0,2,0,0,0,0|2,0,0]=4 18057 B12R1.371 Cc1ccccc1OC(C)C#N 7a_100000210338_100000703298 [0,2,0,0,0,0|2,0,0]=4 18058 B12R1.371 Cc1ccccc1OC(C)CO 34a_100000210338_100012180447 [0,2,0,0,0,0|2,0,0]=4 18059 B12R1.371 Cc1ccccc1OC(C)CO 7a_100000210338_100012180447 [0,2,0,0,0,0|2,0,0]=4 18060 B12R1.371 Cc1ccccc1SC(C)C#N 62a_100000210755_100000703298 [0,2,0,0,0,0|2,0,0]=4 18061 B12R1.371 Cc1ccccc1SC(C)C#N 62a_100000703298_100000210755 [0,2,0,0,0,0|2,0,0]=4 18062 B12R1.371 Cc1ccccc1SC(C)CO 62a_100012180447_100000210755 [0,2,0,0,0,0|2,0,0]=4 18063 B12R1.371 Cc1ccccc1S[C@H](C)CO 62a_100000210755_100016084084 [0,2,0,0,0,0|2,0,0]=4 18064 B12R1.371 Cc1ccccc1S[C@H](C)CO 62a_100016084084_100000210755 [0,2,0,0,0,0|2,0,0]=4 18065 B12R1.371 N#CC(F)Sc1ccccc1O 62a_100000739446_200000117898 [0,2,0,0,0,0|1,0,1]=4 18066 B12R1.371 N#CC(F)Sc1ccccc1O 62a_200000117898_100000739446 [0,2,0,0,0,0|1,0,1]=4 18067 B12R1.371 NNC(=O)Cc1ccccc1O 271570a_203496583355_200010210069 [0,2,0,0,0,0|1,0,1]=4 18068 B12R1.371 O=C(CF)Cc1ccccc1Br 1458a_100000751119_100015361967 [0,2,0,0,0,0|1,0,1]=4 18069 B12R1.371 O=C(CF)Cc1ccccc1Cl 1458a_100000183793_100015361967 [0,2,0,0,0,0|1,0,1]=4 18070 B12R1.371 O=C(CF)Cc1ccccc1F 1458a_100000212012_100015361967 [0,2,0,0,0,0|1,0,1]=4 18071 B12R1.371 O=C(CF)Cc1ccccc1I 1458a_100000036491_100015361967 [0,2,0,0,0,0|1,0,1]=4 18072 B12R1.371 O=C(CF)Cc1ccccc1O 1458a_100000743006_100015361967 [0,2,0,0,0,0|0,0,1]=3 18073 B12R1.371 O=C(CO)Cc1ccccc1Br 1458a_100000210174_100000184730 [0,2,0,0,0,0|1,0,1]=4 18074 B12R1.371 O=C(CO)Cc1ccccc1Cl 1458a_100000210174_100000187162 [0,2,0,0,0,0|1,0,1]=4 18075 B12R1.371 O=C(CO)Cc1ccccc1F 1458a_100000210174_100000187165 [0,2,0,0,0,0|1,0,1]=4 18076 B12R1.371 O=C(CO)Cc1ccccc1I 1458a_100000210174_100011216222 [0,2,0,0,0,0|1,0,1]=4 18077 B12R1.371 O=C(CO)Cc1ncccc1O 1458a_100000210174_200020655725 [0,2,0,0,0,0|1,0,1]=4 18078 B12R1.371 O=C(CO)Nc1ccccc1O 22a_100000185747_100000210174 [0,2,0,0,0,0|1,0,1]=4 18079 B12R1.371 O=C(CO)Nc1ccccc1O 527a_100000185747_100000210174 [0,2,0,0,0,0|1,0,1]=4 18080 B12R1.374 C#CCNc1cc(ccc1O)Br 34a_100000752626_100000184674 [0,2,0,0,0,0|0,0,2]=4 18081 B12R1.374 C#CCNc1cc(ccc1O)C 34a_100011215204_100000184674 [0,2,0,0,0,0|0,0,2]=4 18082 B12R1.374 C#CCNc1cc(ccc1O)Cl 34a_100000210500_100000184674 [0,2,0,0,0,0|0,0,2]=4 18083 B12R1.374 C#CCNc1cc(ccc1O)F 34a_100000759472_100000184674 [0,2,0,0,0,0|0,0,2]=4 18084 B12R1.374 C#CCSc1cc(ccc1O)Br 62a_100000038162_100012355227 [0,2,0,0,0,0|0,0,2]=4 18085 B12R1.374 C#CCSc1cc(ccc1O)C 62a_100000038162_100000765521 [0,2,0,0,0,0|0,0,2]=4 18086 B12R1.374 C#CCSc1cc(ccc1O)Cl 62a_100000038162_100011356953 [0,2,0,0,0,0|0,0,2]=4 18087 B12R1.374 C#CCSc1cc(ccc1O)F 62a_100000038162_100000211999 [0,2,0,0,0,0|0,0,2]=4 18088 B12R1.374 C#CCSc1cc(ccc1O)N 62a_100000038162_100011534360 [0,2,0,0,0,0|0,0,2]=4 18089 B12R1.374 C#CCSc1cc(ccc1O)O 62a_100000038162_100009813629 [0,2,0,0,0,0|0,0,2]=4 18090 B12R1.374 C=CCNc1cc(ccc1O)Br 34a_100000752626_100015514636 [0,2,0,0,0,0|0,0,2]=4 18091 B12R1.374 C=CCNc1cc(ccc1O)C 34a_100011215204_100015514636 [0,2,0,0,0,0|0,0,2]=4 18092 B12R1.374 C=CCNc1cc(ccc1O)Cl 34a_100000210500_100015514636 [0,2,0,0,0,0|0,0,2]=4 18093 B12R1.374 C=CCNc1cc(ccc1O)F 34a_100000759472_100015514636 [0,2,0,0,0,0|0,0,2]=4 18094 B12R1.374 C=CCSc1cc(ccc1O)Br 62a_100000210623_100012355227 [0,2,0,0,0,0|0,0,2]=4 18095 B12R1.374 C=CCSc1cc(ccc1O)Br 62a_100012355227_100000210623 [0,2,0,0,0,0|0,0,2]=4 18096 B12R1.374 C=CCSc1cc(ccc1O)C 62a_100000210623_100000765521 [0,2,0,0,0,0|0,0,2]=4 18097 B12R1.374 C=CCSc1cc(ccc1O)C 62a_100000765521_100000210623 [0,2,0,0,0,0|0,0,2]=4 18098 B12R1.374 C=CCSc1cc(ccc1O)Cl 62a_100000210623_100011356953 [0,2,0,0,0,0|0,0,2]=4 18099 B12R1.374 C=CCSc1cc(ccc1O)Cl 62a_100011356953_100000210623 [0,2,0,0,0,0|0,0,2]=4 18100 B12R1.374 C=CCSc1cc(ccc1O)F 62a_100000210623_100000211999 [0,2,0,0,0,0|0,0,2]=4 18101 B12R1.374 C=CCSc1cc(ccc1O)F 62a_100000211999_100000210623 [0,2,0,0,0,0|0,0,2]=4 18102 B12R1.374 C=CCSc1cc(ccc1O)N 62a_100000210623_100011534360 [0,2,0,0,0,0|0,0,2]=4 18103 B12R1.374 C=CCSc1cc(ccc1O)N 62a_100011534360_100000210623 [0,2,0,0,0,0|0,0,2]=4 18104 B12R1.374 C=CCSc1cc(ccc1O)O 62a_100000210623_100009813629 [0,2,0,0,0,0|0,0,2]=4 18105 B12R1.374 CCCCc1cc(=O)[nH]cc1F 271570a_100020621405_100009817642 [0,2,0,0,0,0|2,0,0]=4 18106 B12R1.374 CCCCc1cc(c[nH]c1=O)F 271570a_100020621405_100009817720 [0,2,0,0,0,0|1,0,1]=4 18107 B12R1.374 CCCCc1cc(ccc1Br)Br 271570a_100020621405_100011483371 [0,2,0,0,0,0|1,0,0]=3 18108 B12R1.374 CCCCc1cc(ccc1Br)C 271570a_100020621405_100012353751 [0,2,0,0,0,0|1,0,0]=3 18109 B12R1.374 CCCCc1cc(ccc1Br)Cl 271570a_100020621405_100012339723 [0,2,0,0,0,0|1,0,0]=3 18110 B12R1.374 CCCCc1cc(ccc1Br)F 271570a_100020621405_100011217576 [0,2,0,0,0,0|1,0,0]=3 18111 B12R1.374 CCCCc1cc(ccc1Br)N 271570a_100020621405_100000750459 [0,2,0,0,0,0|1,0,0]=3 18112 B12R1.374 CCCCc1cc(ccc1Br)O 271570a_100020621405_100012339312 [0,2,0,0,0,0|1,0,0]=3 18113 B12R1.374 CCCCc1cc(ccc1C)Br 271570a_100020621405_100011344865 [0,2,0,0,0,0|1,0,0]=3 18114 B12R1.374 CCCCc1cc(ccc1C)C 271570a_100020621405_100000210833 [0,2,0,0,0,0|1,0,0]=3 18115 B12R1.374 CCCCc1cc(ccc1C)Cl 271570a_100020621405_100011263213 [0,2,0,0,0,0|1,0,0]=3 18116 B12R1.374 CCCCc1cc(ccc1C)F 271570a_100020621405_100011218078 [0,2,0,0,0,0|1,0,0]=3 18117 B12R1.374 CCCCc1cc(ccc1C)N 271570a_100020621405_100000736455 [0,2,0,0,0,0|1,0,0]=3 18118 B12R1.374 CCCCc1cc(ccc1C)O 271570a_100020621405_100011380479 [0,2,0,0,0,0|1,0,0]=3 18119 B12R1.374 CCCCc1cc(ccc1Cl)Br 271570a_100020621405_100011772130 [0,2,0,0,0,0|1,0,0]=3 18120 B12R1.374 CCCCc1cc(ccc1Cl)C 271570a_100020621405_100012356289 [0,2,0,0,0,0|1,0,0]=3 18121 B12R1.374 CCCCc1cc(ccc1Cl)Cl 271570a_100020621405_100000707729 [0,2,0,0,0,0|1,0,0]=3 18122 B12R1.374 CCCCc1cc(ccc1Cl)F 271570a_100020621405_100011217299 [0,2,0,0,0,0|1,0,0]=3 18123 B12R1.374 CCCCc1cc(ccc1Cl)N 271570a_100020621405_100012360549 [0,2,0,0,0,0|1,0,0]=3 18124 B12R1.374 CCCCc1cc(ccc1Cl)O 271570a_100020621405_100000049588 [0,2,0,0,0,0|1,0,0]=3 18125 B12R1.374 CCCCc1cc(ccc1F)Br 271570a_100020621405_100011217312 [0,2,0,0,0,0|1,0,0]=3 18126 B12R1.374 CCCCc1cc(ccc1F)C 271570a_100020621405_100000736223 [0,2,0,0,0,0|1,0,0]=3 18127 B12R1.374 CCCCc1cc(ccc1F)Cl 271570a_100020621405_100011218116 [0,2,0,0,0,0|1,0,0]=3 18128 B12R1.374 CCCCc1cc(ccc1F)F 271570a_100020621405_100000750033 [0,2,0,0,0,0|1,0,0]=3 18129 B12R1.374 CCCCc1cc(ccc1F)N 271570a_100020621405_100000760356 [0,2,0,0,0,0|1,0,0]=3 18130 B12R1.374 CCCCc1cc(ccc1F)O 271570a_100020621405_100000693481 [0,2,0,0,0,0|1,0,0]=3 18131 B12R1.374 CCCCc1cc(ccc1N)Br 271570a_100020621405_100000187925 [0,2,0,0,0,0|1,0,0]=3 18132 B12R1.374 CCCCc1cc(ccc1N)C 271570a_100020621405_100000210942 [0,2,0,0,0,0|1,0,0]=3 18133 B12R1.374 CCCCc1cc(ccc1N)Cl 271570a_100020621405_100000761889 [0,2,0,0,0,0|1,0,0]=3 18134 B12R1.374 CCCCc1cc(ccc1N)F 271570a_100020621405_100000760547 [0,2,0,0,0,0|1,0,0]=3 18135 B12R1.374 CCCCc1cc(ccc1N)N 271570a_100020621405_100011534242 [0,2,0,0,0,0|1,0,0]=3 18136 B12R1.374 CCCCc1cc(ccc1N)O 271570a_100020621405_100012001276 [0,2,0,0,0,0|1,0,0]=3 18137 B12R1.374 CCCCc1cc(ccc1O)Br 271570a_100020621405_100012355227 [0,2,0,0,0,0|0,0,0]=2 18138 B12R1.374 CCCCc1cc(ccc1O)C 271570a_100020621405_100000765521 [0,2,0,0,0,0|0,0,0]=2 18139 B12R1.374 CCCCc1cc(ccc1O)Cl 271570a_100020621405_100011356953 [0,2,0,0,0,0|0,0,0]=2 18140 B12R1.374 CCCCc1cc(ccc1O)F 271570a_100020621405_100000211999 [0,2,0,0,0,0|0,0,0]=2 18141 B12R1.374 CCCCc1cc(ccc1O)N 271570a_100020621405_100011534360 [0,2,0,0,0,0|0,0,0]=2 18142 B12R1.374 CCCCc1cc(ccc1O)O 271570a_100020621405_100009813629 [0,2,0,0,0,0|0,0,0]=2 18143 B12R1.374 CCCCc1cc(cnc1Br)N 271570a_100020621405_100010201102 [0,2,0,0,0,0|2,0,0]=4 18144 B12R1.374 CCCCc1cc(cnc1C)Br 271570a_100020621405_200010090566 [0,2,0,0,0,0|2,0,0]=4 18145 B12R1.374 CCCCc1cc(cnc1C)C 271570a_100020621405_100009817436 [0,2,0,0,0,0|2,0,0]=4 18146 B12R1.374 CCCCc1cc(cnc1C)F 271570a_100020621405_100009860710 [0,2,0,0,0,0|2,0,0]=4 18147 B12R1.374 CCCCc1cc(cnc1C)N 271570a_100020621405_100011998591 [0,2,0,0,0,0|2,0,0]=4 18148 B12R1.374 CCCCc1cc(cnc1C)O 271570a_100020621405_100009819603 [0,2,0,0,0,0|2,0,0]=4 18149 B12R1.374 CCCCc1cc(cnc1Cl)Br 271570a_100020621405_100009814771 [0,2,0,0,0,0|2,0,0]=4 18150 B12R1.374 CCCCc1cc(cnc1Cl)C 271570a_100020621405_100010210167 [0,2,0,0,0,0|2,0,0]=4 18151 B12R1.374 CCCCc1cc(cnc1Cl)Cl 271570a_100020621405_200000062399 [0,2,0,0,0,0|2,0,0]=4 18152 B12R1.374 CCCCc1cc(cnc1Cl)N 271570a_100020621405_100010253917 [0,2,0,0,0,0|2,0,0]=4 18153 B12R1.374 CCCCc1cc(cnc1F)Br 271570a_100020621405_100010172738 [0,2,0,0,0,0|2,0,0]=4 18154 B12R1.374 CCCCc1cc(cnc1F)C 271570a_100020621405_100000049784 [0,2,0,0,0,0|2,0,0]=4 18155 B12R1.374 CCCCc1cc(cnc1F)Cl 271570a_100020621405_100010188783 [0,2,0,0,0,0|2,0,0]=4 18156 B12R1.374 CCCCc1cc(cnc1F)F 271570a_100020621405_100009820768 [0,2,0,0,0,0|2,0,0]=4 18157 B12R1.374 CCCCc1cc(cnc1F)N 271570a_100020621405_100009840397 [0,2,0,0,0,0|2,0,0]=4 18158 B12R1.374 CCCCc1cc(cnc1F)O 271570a_100020621405_100009817267 [0,2,0,0,0,0|2,0,0]=4 18159 B12R1.374 CCCCc1cc(cnc1N)Br 271570a_100020621405_100000760472 [0,2,0,0,0,0|2,0,0]=4 18160 B12R1.374 CCCCc1cc(cnc1N)C 271570a_100020621405_100000049664 [0,2,0,0,0,0|2,0,0]=4 18161 B12R1.374 CCCCc1cc(cnc1N)Cl 271570a_100020621405_100000050159 [0,2,0,0,0,0|2,0,0]=4 18162 B12R1.374 CCCCc1cc(cnc1N)F 271570a_100020621405_100009814671 [0,2,0,0,0,0|2,0,0]=4 18163 B12R1.374 CCCCc1cc(cnc1N)N 271570a_100020621405_200011934315 [0,2,0,0,0,0|2,0,0]=4 18164 B12R1.374 CCCCc1cc(cnc1O)Br 271570a_100020621405_100010197142 [0,2,0,0,0,0|1,0,0]=3 18165 B12R1.374 CCCCc1cc(cnc1O)C 271570a_100020621405_100000049931 [0,2,0,0,0,0|1,0,0]=3 18166 B12R1.374 CCCCc1cc(cnc1O)Cl 271570a_100020621405_100010188700 [0,2,0,0,0,0|1,0,0]=3 18167 B12R1.374 CCCCc1cc(ncc1Br)Br 271570a_100020621405_100010171693 [0,2,0,0,0,0|2,0,0]=4 18168 B12R1.374 CCCCc1cc(ncc1Br)Cl 271570a_100020621405_100009815598 [0,2,0,0,0,0|2,0,0]=4 18169 B12R1.374 CCCCc1cc(ncc1C)Br 271570a_100020621405_100010067628 [0,2,0,0,0,0|2,0,0]=4 18170 B12R1.374 CCCCc1cc(ncc1C)C 271570a_100020621405_100009862788 [0,2,0,0,0,0|2,0,0]=4 18171 B12R1.374 CCCCc1cc(ncc1C)Cl 271570a_100020621405_100010068021 [0,2,0,0,0,0|2,0,0]=4 18172 B12R1.374 CCCCc1cc(ncc1C)F 271570a_100020621405_100000049870 [0,2,0,0,0,0|2,0,0]=4 18173 B12R1.374 CCCCc1cc(ncc1C)N 271570a_100020621405_100009819938 [0,2,0,0,0,0|2,0,0]=4 18174 B12R1.374 CCCCc1cc(ncc1C)O 271570a_100020621405_100009831917 [0,2,0,0,0,0|2,0,0]=4 18175 B12R1.374 CCCCc1cc(ncc1Cl)Br 271570a_100020621405_100010223331 [0,2,0,0,0,0|2,0,0]=4 18176 B12R1.374 CCCCc1cc(ncc1Cl)Cl 271570a_100020621405_100010172835 [0,2,0,0,0,0|2,0,0]=4 18177 B12R1.374 CCCCc1cc(ncc1Cl)F 271570a_100020621405_100009892587 [0,2,0,0,0,0|2,0,0]=4 18178 B12R1.374 CCCCc1cc(ncc1Cl)N 271570a_100020621405_100010134119 [0,2,0,0,0,0|2,0,0]=4 18179 B12R1.374 CCCCc1cc(ncc1F)Br 271570a_100020621405_100010193852 [0,2,0,0,0,0|2,0,0]=4 18180 B12R1.374 CCCCc1cc(ncc1F)C 271570a_100020621405_100009867690 [0,2,0,0,0,0|2,0,0]=4 18181 B12R1.374 CCCCc1cc(ncc1F)Cl 271570a_100020621405_100000708277 [0,2,0,0,0,0|2,0,0]=4 18182 B12R1.374 CCCCc1cc(ncc1F)F 271570a_100020621405_100010233071 [0,2,0,0,0,0|2,0,0]=4 18183 B12R1.374 CCCCc1cc(ncc1F)N 271570a_100020621405_100015713587 [0,2,0,0,0,0|2,0,0]=4 18184 B12R1.374 CCCCc1cc(ncc1N)Cl 271570a_100020621405_100000050123 [0,2,0,0,0,0|2,0,0]=4 18185 B12R1.374 CCCCc1cc(ncc1O)C 271570a_100020621405_100009843476 [0,2,0,0,0,0|1,0,0]=3 18186 B12R1.374 CCCCc1cc(ncc1O)Cl 271570a_100020621405_100000698892 [0,2,0,0,0,0|1,0,0]=3 18187 B12R1.374 CCCCc1cc(nnc1O)O 271570a_100020621405_100000759565 [0,2,0,0,0,0|2,0,0]=4 18188 B12R1.374 CCCCc1cn(ccc1=O)C 271570a_100020621405_100010750718 [0,2,0,0,0,0|1,0,1]=4 18189 B12R1.374 CCCCc1nc(ccc1Br)N 271570a_100020621405_100010192275 [0,2,0,0,0,0|2,0,0]=4 18190 B12R1.374 CCCCc1nc(ccc1C)C 271570a_100020621405_100009854376 [0,2,0,0,0,0|2,0,0]=4 18191 B12R1.374 CCCCc1nc(ccc1C)N 271570a_100020621405_100000126722 [0,2,0,0,0,0|2,0,0]=4 18192 B12R1.374 CCCCc1nc(ccc1F)C 271570a_100020621405_100009817602 [0,2,0,0,0,0|2,0,0]=4 18193 B12R1.374 CCCCc1nc(ccc1F)Cl 271570a_100020621405_100010136221 [0,2,0,0,0,0|2,0,0]=4 18194 B12R1.374 CCCCc1nc(ccc1F)F 271570a_100020621405_100010997973 [0,2,0,0,0,0|2,0,0]=4 18195 B12R1.374 CCCCc1nc(ccc1F)N 271570a_100020621405_100010892222 [0,2,0,0,0,0|2,0,0]=4 18196 B12R1.374 CCCCc1nc(ccc1N)Br 271570a_100020621405_100010168765 [0,2,0,0,0,0|2,0,0]=4 18197 B12R1.374 CCCCc1nc(ccc1N)C 271570a_100020621405_100000685570 [0,2,0,0,0,0|2,0,0]=4 18198 B12R1.374 CCCCc1nc(ccc1N)Cl 271570a_100020621405_100010233647 [0,2,0,0,0,0|2,0,0]=4 18199 B12R1.374 CCCCc1nc(ccc1N)F 271570a_100020621405_100009879877 [0,2,0,0,0,0|2,0,0]=4 18200 B12R1.374 CCCCc1nc(ccc1N)N 271570a_100020621405_200009884323 [0,2,0,0,0,0|2,0,0]=4 18201 B12R1.374 CCCCc1nc(ccc1O)Br 271570a_100020621405_100010253912 [0,2,0,0,0,0|1,0,0]=3 18202 B12R1.374 CCCCc1nc(ccc1O)C 271570a_100020621405_100000702858 [0,2,0,0,0,0|1,0,0]=3 18203 B12R1.374 CCCCc1nc(ccc1O)Cl 271570a_100020621405_100000696390 [0,2,0,0,0,0|1,0,0]=3 18204 B12R1.374 CCCCc1nc(ccc1O)F 271570a_100020621405_100010382442 [0,2,0,0,0,0|1,0,0]=3 18205 B12R1.374 CCCNc1cc(ccc1Br)Br 34a_100000737762_100000210303 [0,2,0,0,0,0|1,0,0]=3 18206 B12R1.374 CCCNc1cc(ccc1Br)C 34a_100000745044_100000210303 [0,2,0,0,0,0|1,0,0]=3 18207 B12R1.374 CCCNc1cc(ccc1Br)Cl 34a_100000687073_100000210303 [0,2,0,0,0,0|1,0,0]=3 18208 B12R1.374 CCCNc1cc(ccc1Br)F 34a_100000687223_100000210303 [0,2,0,0,0,0|1,0,0]=3 18209 B12R1.374 CCCNc1cc(ccc1Br)O 34a_100011999798_100000210303 [0,2,0,0,0,0|1,0,0]=3 18210 B12R1.374 CCCNc1cc(ccc1C)Br 34a_100000741167_100000210303 [0,2,0,0,0,0|1,0,0]=3 18211 B12R1.374 CCCNc1cc(ccc1C)Br 7a_100000741167_100000210303 [0,2,0,0,0,0|1,0,0]=3 18212 B12R1.374 CCCNc1cc(ccc1C)C 2230a_100000185781_100000210303 [0,2,0,0,0,0|1,0,0]=3 18213 B12R1.374 CCCNc1cc(ccc1C)C 34a_100000185781_100000210303 [0,2,0,0,0,0|1,0,0]=3 18214 B12R1.374 CCCNc1cc(ccc1C)C 7a_100000185781_100000210303 [0,2,0,0,0,0|1,0,0]=3 18215 B12R1.374 CCCNc1cc(ccc1C)Cl 34a_100000211374_100000210303 [0,2,0,0,0,0|1,0,0]=3 18216 B12R1.374 CCCNc1cc(ccc1C)Cl 7a_100000211374_100000210303 [0,2,0,0,0,0|1,0,0]=3 18217 B12R1.374 CCCNc1cc(ccc1C)F 34a_100000211107_100000210303 [0,2,0,0,0,0|1,0,0]=3 18218 B12R1.374 CCCNc1cc(ccc1C)F 7a_100000211107_100000210303 [0,2,0,0,0,0|1,0,0]=3 18219 B12R1.374 CCCNc1cc(ccc1C)I 7a_100000761890_100000210303 [0,2,0,0,0,0|1,0,0]=3 18220 B12R1.374 CCCNc1cc(ccc1C)O 34a_100011216113_100000210303 [0,2,0,0,0,0|1,0,0]=3 18221 B12R1.374 CCCNc1cc(ccc1Cl)Br 34a_100000750497_100000210303 [0,2,0,0,0,0|1,0,0]=3 18222 B12R1.374 CCCNc1cc(ccc1Cl)C 34a_100011215360_100000210303 [0,2,0,0,0,0|1,0,0]=3 18223 B12R1.374 CCCNc1cc(ccc1Cl)Cl 34a_100000184485_100000210303 [0,2,0,0,0,0|1,0,0]=3 18224 B12R1.374 CCCNc1cc(ccc1Cl)F 34a_100000751338_100000210303 [0,2,0,0,0,0|1,0,0]=3 18225 B12R1.374 CCCNc1cc(ccc1Cl)I 34a_200000761891_100000210303 [0,2,0,0,0,0|1,0,0]=3 18226 B12R1.374 CCCNc1cc(ccc1Cl)O 34a_100011934297_100000210303 [0,2,0,0,0,0|1,0,0]=3 18227 B12R1.374 CCCNc1cc(ccc1F)Br 34a_100000740924_100000210303 [0,2,0,0,0,0|1,0,0]=3 18228 B12R1.374 CCCNc1cc(ccc1F)C 34a_100000211285_100000210303 [0,2,0,0,0,0|1,0,0]=3 18229 B12R1.374 CCCNc1cc(ccc1F)Cl 34a_100000212115_100000210303 [0,2,0,0,0,0|1,0,0]=3 18230 B12R1.374 CCCNc1cc(ccc1F)F 34a_100000210742_100000210303 [0,2,0,0,0,0|1,0,0]=3 18231 B12R1.374 CCCNc1cc(ccc1F)I 34a_100011464823_100000210303 [0,2,0,0,0,0|1,0,0]=3 18232 B12R1.374 CCCNc1cc(ccc1F)O 34a_100012017239_100000210303 [0,2,0,0,0,0|1,0,0]=3 18233 B12R1.374 CCCNc1cc(ccc1I)Br 34a_100000743836_100000210303 [0,2,0,0,0,0|1,0,0]=3 18234 B12R1.374 CCCNc1cc(ccc1I)C 34a_100011216686_100000210303 [0,2,0,0,0,0|1,0,0]=3 18235 B12R1.374 CCCNc1cc(ccc1I)Cl 34a_100000761886_100000210303 [0,2,0,0,0,0|1,0,0]=3 18236 B12R1.374 CCCNc1cc(ccc1I)F 34a_100011218093_100000210303 [0,2,0,0,0,0|1,0,0]=3 18237 B12R1.374 CCCNc1cc(ccc1O)Br 34a_100000752626_100000210303 [0,2,0,0,0,0|0,0,0]=2 18238 B12R1.374 CCCNc1cc(ccc1O)C 34a_100011215204_100000210303 [0,2,0,0,0,0|0,0,0]=2 18239 B12R1.374 CCCNc1cc(ccc1O)Cl 34a_100000210500_100000210303 [0,2,0,0,0,0|0,0,0]=2 18240 B12R1.374 CCCNc1cc(ccc1O)F 34a_100000759472_100000210303 [0,2,0,0,0,0|0,0,0]=2 18241 B12R1.374 CCCOc1cc(=O)[nH]cc1Cl 34a_100000069390_100000210303 [0,2,0,0,0,0|2,0,0]=4 18242 B12R1.374 CCCOc1cc(ccc1Br)Br 34a_100011220040_100000210303 [0,2,0,0,0,0|1,0,0]=3 18243 B12R1.374 CCCOc1cc(ccc1Br)Br 7a_100011220040_100000210303 [0,2,0,0,0,0|1,0,0]=3 18244 B12R1.374 CCCOc1cc(ccc1Br)C 34a_100012002257_100000210303 [0,2,0,0,0,0|1,0,0]=3 18245 B12R1.374 CCCOc1cc(ccc1Br)C 7a_100012002257_100000210303 [0,2,0,0,0,0|1,0,0]=3 18246 B12R1.374 CCCOc1cc(ccc1Br)Cl 34a_100012339455_100000210303 [0,2,0,0,0,0|1,0,0]=3 18247 B12R1.374 CCCOc1cc(ccc1Br)Cl 7a_100012339455_100000210303 [0,2,0,0,0,0|1,0,0]=3 18248 B12R1.374 CCCOc1cc(ccc1Br)F 34a_100000690578_100000210303 [0,2,0,0,0,0|1,0,0]=3 18249 B12R1.374 CCCOc1cc(ccc1Br)F 7a_100000690578_100000210303 [0,2,0,0,0,0|1,0,0]=3 18250 B12R1.374 CCCOc1cc(ccc1Br)I 34a_100012356990_100000210303 [0,2,0,0,0,0|1,0,0]=3 18251 B12R1.374 CCCOc1cc(ccc1Br)I 7a_100012356990_100000210303 [0,2,0,0,0,0|1,0,0]=3 18252 B12R1.374 CCCOc1cc(ccc1C)Br 34a_100000685420_100000210303 [0,2,0,0,0,0|1,0,0]=3 18253 B12R1.374 CCCOc1cc(ccc1C)Br 7a_100000685420_100000210303 [0,2,0,0,0,0|1,0,0]=3 18254 B12R1.374 CCCOc1cc(ccc1C)C 34a_100000210931_100000210303 [0,2,0,0,0,0|1,0,0]=3 18255 B12R1.374 CCCOc1cc(ccc1C)C 7a_100000210931_100000210303 [0,2,0,0,0,0|1,0,0]=3 18256 B12R1.374 CCCOc1cc(ccc1C)Cl 34a_100000756515_100000210303 [0,2,0,0,0,0|1,0,0]=3 18257 B12R1.374 CCCOc1cc(ccc1C)Cl 7a_100000756515_100000210303 [0,2,0,0,0,0|1,0,0]=3 18258 B12R1.374 CCCOc1cc(ccc1C)F 34a_100000690566_100000210303 [0,2,0,0,0,0|1,0,0]=3 18259 B12R1.374 CCCOc1cc(ccc1C)F 7a_100000690566_100000210303 [0,2,0,0,0,0|1,0,0]=3 18260 B12R1.374 CCCOc1cc(ccc1C)I 7a_100000766334_100000210303 [0,2,0,0,0,0|1,0,0]=3 18261 B12R1.374 CCCOc1cc(ccc1C)N 34a_100000759471_100000210303 [0,2,0,0,0,0|1,0,0]=3 18262 B12R1.374 CCCOc1cc(ccc1C)N 7a_100000759471_100000210303 [0,2,0,0,0,0|1,0,0]=3 18263 B12R1.374 CCCOc1cc(ccc1Cl)Br 34a_100000738945_100000210303 [0,2,0,0,0,0|1,0,0]=3 18264 B12R1.374 CCCOc1cc(ccc1Cl)Br 7a_100000738945_100000210303 [0,2,0,0,0,0|1,0,0]=3 18265 B12R1.374 CCCOc1cc(ccc1Cl)C 34a_100000211493_100000210303 [0,2,0,0,0,0|1,0,0]=3 18266 B12R1.374 CCCOc1cc(ccc1Cl)C 7a_100000211493_100000210303 [0,2,0,0,0,0|1,0,0]=3 18267 B12R1.374 CCCOc1cc(ccc1Cl)Cl 34a_100000211422_100000210303 [0,2,0,0,0,0|1,0,0]=3 18268 B12R1.374 CCCOc1cc(ccc1Cl)Cl 7a_100000211422_100000210303 [0,2,0,0,0,0|1,0,0]=3 18269 B12R1.374 CCCOc1cc(ccc1Cl)F 34a_100000692107_100000210303 [0,2,0,0,0,0|1,0,0]=3 18270 B12R1.374 CCCOc1cc(ccc1Cl)F 7a_100000692107_100000210303 [0,2,0,0,0,0|1,0,0]=3 18271 B12R1.374 CCCOc1cc(ccc1Cl)I 34a_100011356854_100000210303 [0,2,0,0,0,0|1,0,0]=3 18272 B12R1.374 CCCOc1cc(ccc1Cl)I 7a_100011356854_100000210303 [0,2,0,0,0,0|1,0,0]=3 18273 B12R1.374 CCCOc1cc(ccc1Cl)N 34a_100011934209_100000210303 [0,2,0,0,0,0|1,0,0]=3 18274 B12R1.374 CCCOc1cc(ccc1F)Br 34a_100000686035_100000210303 [0,2,0,0,0,0|1,0,0]=3 18275 B12R1.374 CCCOc1cc(ccc1F)Br 7a_100000686035_100000210303 [0,2,0,0,0,0|1,0,0]=3 18276 B12R1.374 CCCOc1cc(ccc1F)C 34a_100000759540_100000210303 [0,2,0,0,0,0|1,0,0]=3 18277 B12R1.374 CCCOc1cc(ccc1F)C 7a_100000759540_100000210303 [0,2,0,0,0,0|1,0,0]=3 18278 B12R1.374 CCCOc1cc(ccc1F)Cl 34a_100000757397_100000210303 [0,2,0,0,0,0|1,0,0]=3 18279 B12R1.374 CCCOc1cc(ccc1F)Cl 7a_100000757397_100000210303 [0,2,0,0,0,0|1,0,0]=3 18280 B12R1.374 CCCOc1cc(ccc1F)F 34a_100000752141_100000210303 [0,2,0,0,0,0|1,0,0]=3 18281 B12R1.374 CCCOc1cc(ccc1F)F 7a_100000752141_100000210303 [0,2,0,0,0,0|1,0,0]=3 18282 B12R1.374 CCCOc1cc(ccc1F)I 34a_100009958187_100000210303 [0,2,0,0,0,0|1,0,0]=3 18283 B12R1.374 CCCOc1cc(ccc1F)I 7a_100009958187_100000210303 [0,2,0,0,0,0|1,0,0]=3 18284 B12R1.374 CCCOc1cc(ccc1F)N 34a_100012017398_100000210303 [0,2,0,0,0,0|1,0,0]=3 18285 B12R1.374 CCCOc1cc(ccc1F)N 7a_100012017398_100000210303 [0,2,0,0,0,0|1,0,0]=3 18286 B12R1.374 CCCOc1cc(ccc1I)Br 34a_100012344904_100000210303 [0,2,0,0,0,0|1,0,0]=3 18287 B12R1.374 CCCOc1cc(ccc1I)Br 7a_100012344904_100000210303 [0,2,0,0,0,0|1,0,0]=3 18288 B12R1.374 CCCOc1cc(ccc1I)Cl 34a_100000050036_100000210303 [0,2,0,0,0,0|1,0,0]=3 18289 B12R1.374 CCCOc1cc(ccc1I)Cl 7a_100000050036_100000210303 [0,2,0,0,0,0|1,0,0]=3 18290 B12R1.374 CCCOc1cc(ccc1I)F 34a_100010084537_100000210303 [0,2,0,0,0,0|1,0,0]=3 18291 B12R1.374 CCCOc1cc(ccc1I)F 7a_100010084537_100000210303 [0,2,0,0,0,0|1,0,0]=3 18292 B12R1.374 CCCOc1cc(ccc1N)Br 34a_100000739049_100000210303 [0,2,0,0,0,0|1,0,0]=3 18293 B12R1.374 CCCOc1cc(ccc1N)Br 7a_100000739049_100000210303 [0,2,0,0,0,0|1,0,0]=3 18294 B12R1.374 CCCOc1cc(ccc1N)C 34a_100000211527_100000210303 [0,2,0,0,0,0|1,0,0]=3 18295 B12R1.374 CCCOc1cc(ccc1N)C 7a_100000211527_100000210303 [0,2,0,0,0,0|1,0,0]=3 18296 B12R1.374 CCCOc1cc(ccc1N)Cl 34a_100000185728_100000210303 [0,2,0,0,0,0|1,0,0]=3 18297 B12R1.374 CCCOc1cc(ccc1N)Cl 7a_100000185728_100000210303 [0,2,0,0,0,0|1,0,0]=3 18298 B12R1.374 CCCOc1cc(ccc1N)F 34a_100000753323_100000210303 [0,2,0,0,0,0|1,0,0]=3 18299 B12R1.374 CCCOc1cc(ccc1N)F 7a_100000753323_100000210303 [0,2,0,0,0,0|1,0,0]=3 18300 B12R1.374 CCCOc1cc(ccc1N)I 34a_100000057187_100000210303 [0,2,0,0,0,0|1,0,0]=3 18301 B12R1.374 CCCOc1cc(ccc1N)I 7a_100000057187_100000210303 [0,2,0,0,0,0|1,0,0]=3 18302 B12R1.374 CCCOc1cc(ccc1N)N 34a_100025717382_100000210303 [0,2,0,0,0,0|1,0,0]=3 18303 B12R1.374 CCCOc1cc(ccc1O)F 271570a_203496583355_200012344540 [0,2,0,0,0,0|0,0,0]=2 18304 B12R1.374 CCCOc1cc(cnc1Br)Cl 34a_100000697010_100000210303 [0,2,0,0,0,0|2,0,0]=4 18305 B12R1.374 CCCOc1cc(cnc1Br)Cl 7a_100000697010_100000210303 [0,2,0,0,0,0|2,0,0]=4 18306 B12R1.374 CCCOc1cc(cnc1Br)F 34a_100009820119_100000210303 [0,2,0,0,0,0|2,0,0]=4 18307 B12R1.374 CCCOc1cc(cnc1Br)F 7a_100009820119_100000210303 [0,2,0,0,0,0|2,0,0]=4 18308 B12R1.374 CCCOc1cc(cnc1C)Br 34a_100009864810_100000210303 [0,2,0,0,0,0|2,0,0]=4 18309 B12R1.374 CCCOc1cc(cnc1C)Br 7a_100009864810_100000210303 [0,2,0,0,0,0|2,0,0]=4 18310 B12R1.374 CCCOc1cc(cnc1Cl)Br 34a_100012354860_100000210303 [0,2,0,0,0,0|2,0,0]=4 18311 B12R1.374 CCCOc1cc(cnc1Cl)Br 7a_100012354860_100000210303 [0,2,0,0,0,0|2,0,0]=4 18312 B12R1.374 CCCOc1cc(cnc1Cl)C 34a_100012000487_100000210303 [0,2,0,0,0,0|2,0,0]=4 18313 B12R1.374 CCCOc1cc(cnc1Cl)C 7a_100012000487_100000210303 [0,2,0,0,0,0|2,0,0]=4 18314 B12R1.374 CCCOc1cc(cnc1Cl)F 34a_100000079967_100000210303 [0,2,0,0,0,0|2,0,0]=4 18315 B12R1.374 CCCOc1cc(cnc1Cl)F 7a_100000079967_100000210303 [0,2,0,0,0,0|2,0,0]=4 18316 B12R1.374 CCCOc1cc(cnc1F)Br 34a_100009819871_100000210303 [0,2,0,0,0,0|2,0,0]=4 18317 B12R1.374 CCCOc1cc(cnc1F)Br 7a_100009819871_100000210303 [0,2,0,0,0,0|2,0,0]=4 18318 B12R1.374 CCCOc1cc(cnc1F)C 34a_100009849810_100000210303 [0,2,0,0,0,0|2,0,0]=4 18319 B12R1.374 CCCOc1cc(cnc1F)C 7a_100009849810_100000210303 [0,2,0,0,0,0|2,0,0]=4 18320 B12R1.374 CCCOc1cc(cnc1F)Cl 34a_100000094372_100000210303 [0,2,0,0,0,0|2,0,0]=4 18321 B12R1.374 CCCOc1cc(cnc1F)Cl 7a_100000094372_100000210303 [0,2,0,0,0,0|2,0,0]=4 18322 B12R1.374 CCCOc1cc(cnc1I)Br 34a_100010210634_100000210303 [0,2,0,0,0,0|2,0,0]=4 18323 B12R1.374 CCCOc1cc(cnc1I)Br 7a_100010210634_100000210303 [0,2,0,0,0,0|2,0,0]=4 18324 B12R1.374 CCCOc1cc(cnc1I)Cl 34a_100010233512_100000210303 [0,2,0,0,0,0|2,0,0]=4 18325 B12R1.374 CCCOc1cc(cnc1I)Cl 7a_100010233512_100000210303 [0,2,0,0,0,0|2,0,0]=4 18326 B12R1.374 CCCOc1cc(cnc1I)F 34a_100015624800_100000210303 [0,2,0,0,0,0|2,0,0]=4 18327 B12R1.374 CCCOc1cc(cnc1I)F 7a_100015624800_100000210303 [0,2,0,0,0,0|2,0,0]=4 18328 B12R1.374 CCCOc1cc(cnc1N)Br 34a_100009819042_100000210303 [0,2,0,0,0,0|2,0,0]=4 18329 B12R1.374 CCCOc1cc(cnc1N)Br 7a_100009819042_100000210303 [0,2,0,0,0,0|2,0,0]=4 18330 B12R1.374 CCCOc1cc(cnc1N)Cl 34a_100000123674_100000210303 [0,2,0,0,0,0|2,0,0]=4 18331 B12R1.374 CCCOc1cc(cnc1N)Cl 7a_100000123674_100000210303 [0,2,0,0,0,0|2,0,0]=4 18332 B12R1.374 CCCOc1cc(cnc1N)F 34a_100000094369_100000210303 [0,2,0,0,0,0|2,0,0]=4 18333 B12R1.374 CCCOc1cc(cnc1N)F 7a_100000094369_100000210303 [0,2,0,0,0,0|2,0,0]=4 18334 B12R1.374 CCCOc1cc(ncc1Br)Br 34a_100010235016_100000210303 [0,2,0,0,0,0|2,0,0]=4 18335 B12R1.374 CCCOc1cc(ncc1Br)C 34a_100011016184_100000210303 [0,2,0,0,0,0|2,0,0]=4 18336 B12R1.374 CCCOc1cc(ncc1Br)Cl 34a_100010173860_100000210303 [0,2,0,0,0,0|2,0,0]=4 18337 B12R1.374 CCCOc1cc(ncc1C)Br 34a_100000704368_100000210303 [0,2,0,0,0,0|2,0,0]=4 18338 B12R1.374 CCCOc1cc(ncc1C)Br 7a_100000704368_100000210303 [0,2,0,0,0,0|2,0,0]=4 18339 B12R1.374 CCCOc1cc(ncc1Cl)Br 34a_100010173861_100000210303 [0,2,0,0,0,0|2,0,0]=4 18340 B12R1.374 CCCOc1cc(ncc1F)Br 34a_100009854642_100000210303 [0,2,0,0,0,0|2,0,0]=4 18341 B12R1.374 CCCOc1cc(ncc1F)Cl 34a_100009851168_100000210303 [0,2,0,0,0,0|2,0,0]=4 18342 B12R1.374 CCCOc1nc(ccc1Br)C 34a_100009817604_100000210303 [0,2,0,0,0,0|2,0,0]=4 18343 B12R1.374 CCCOc1nc(ccc1F)Cl 34a_100010729010_100000210303 [0,2,0,0,0,0|2,0,0]=4 18344 B12R1.374 CCCOc1nc(ccc1N)C 34a_100000687486_100000210303 [0,2,0,0,0,0|2,0,0]=4 18345 B12R1.374 CCCSc1cc(=O)[nH]cc1F 62a_100000210303_100009817642 [0,2,0,0,0,0|2,0,0]=4 18346 B12R1.374 CCCSc1cc(=O)[nH]cc1F 62a_100009817642_100000210303 [0,2,0,0,0,0|2,0,0]=4 18347 B12R1.374 CCCSc1cc(c[nH]c1=O)F 62a_100000210303_100009817720 [0,2,0,0,0,0|1,0,1]=4 18348 B12R1.374 CCCSc1cc(c[nH]c1=O)F 62a_100009817720_100000210303 [0,2,0,0,0,0|1,0,1]=4 18349 B12R1.374 CCCSc1cc(ccc1Br)Br 62a_100000210303_100011483371 [0,2,0,0,0,0|1,0,0]=3 18350 B12R1.374 CCCSc1cc(ccc1Br)Br 62a_100011483371_100000210303 [0,2,0,0,0,0|1,0,0]=3 18351 B12R1.374 CCCSc1cc(ccc1Br)C 62a_100000210303_100012353751 [0,2,0,0,0,0|1,0,0]=3 18352 B12R1.374 CCCSc1cc(ccc1Br)C 62a_100012353751_100000210303 [0,2,0,0,0,0|1,0,0]=3 18353 B12R1.374 CCCSc1cc(ccc1Br)Cl 62a_100000210303_100012339723 [0,2,0,0,0,0|1,0,0]=3 18354 B12R1.374 CCCSc1cc(ccc1Br)Cl 62a_100012339723_100000210303 [0,2,0,0,0,0|1,0,0]=3 18355 B12R1.374 CCCSc1cc(ccc1Br)F 62a_100000210303_100011217576 [0,2,0,0,0,0|1,0,0]=3 18356 B12R1.374 CCCSc1cc(ccc1Br)F 62a_100011217576_100000210303 [0,2,0,0,0,0|1,0,0]=3 18357 B12R1.374 CCCSc1cc(ccc1Br)N 62a_100000210303_100000750459 [0,2,0,0,0,0|1,0,0]=3 18358 B12R1.374 CCCSc1cc(ccc1Br)N 62a_100000750459_100000210303 [0,2,0,0,0,0|1,0,0]=3 18359 B12R1.374 CCCSc1cc(ccc1Br)O 62a_100000210303_100012339312 [0,2,0,0,0,0|1,0,0]=3 18360 B12R1.374 CCCSc1cc(ccc1Br)O 62a_100012339312_100000210303 [0,2,0,0,0,0|1,0,0]=3 18361 B12R1.374 CCCSc1cc(ccc1C)Br 62a_100000210303_100011344865 [0,2,0,0,0,0|1,0,0]=3 18362 B12R1.374 CCCSc1cc(ccc1C)Br 62a_100011344865_100000210303 [0,2,0,0,0,0|1,0,0]=3 18363 B12R1.374 CCCSc1cc(ccc1C)C 62a_100000210303_100000210833 [0,2,0,0,0,0|1,0,0]=3 18364 B12R1.374 CCCSc1cc(ccc1C)C 62a_100000210833_100000210303 [0,2,0,0,0,0|1,0,0]=3 18365 B12R1.374 CCCSc1cc(ccc1C)Cl 62a_100000210303_100011263213 [0,2,0,0,0,0|1,0,0]=3 18366 B12R1.374 CCCSc1cc(ccc1C)Cl 62a_100011263213_100000210303 [0,2,0,0,0,0|1,0,0]=3 18367 B12R1.374 CCCSc1cc(ccc1C)F 62a_100000210303_100011218078 [0,2,0,0,0,0|1,0,0]=3 18368 B12R1.374 CCCSc1cc(ccc1C)F 62a_100011218078_100000210303 [0,2,0,0,0,0|1,0,0]=3 18369 B12R1.374 CCCSc1cc(ccc1C)N 62a_100000210303_100000736455 [0,2,0,0,0,0|1,0,0]=3 18370 B12R1.374 CCCSc1cc(ccc1C)N 62a_100000736455_100000210303 [0,2,0,0,0,0|1,0,0]=3 18371 B12R1.374 CCCSc1cc(ccc1C)O 62a_100000210303_100011380479 [0,2,0,0,0,0|1,0,0]=3 18372 B12R1.374 CCCSc1cc(ccc1C)O 62a_100011380479_100000210303 [0,2,0,0,0,0|1,0,0]=3 18373 B12R1.374 CCCSc1cc(ccc1Cl)Br 62a_100000210303_100011772130 [0,2,0,0,0,0|1,0,0]=3 18374 B12R1.374 CCCSc1cc(ccc1Cl)Br 62a_100011772130_100000210303 [0,2,0,0,0,0|1,0,0]=3 18375 B12R1.374 CCCSc1cc(ccc1Cl)C 62a_100000210303_100012356289 [0,2,0,0,0,0|1,0,0]=3 18376 B12R1.374 CCCSc1cc(ccc1Cl)C 62a_100012356289_100000210303 [0,2,0,0,0,0|1,0,0]=3 18377 B12R1.374 CCCSc1cc(ccc1Cl)Cl 62a_100000210303_100000707729 [0,2,0,0,0,0|1,0,0]=3 18378 B12R1.374 CCCSc1cc(ccc1Cl)Cl 62a_100000707729_100000210303 [0,2,0,0,0,0|1,0,0]=3 18379 B12R1.374 CCCSc1cc(ccc1Cl)F 62a_100000210303_100011217299 [0,2,0,0,0,0|1,0,0]=3 18380 B12R1.374 CCCSc1cc(ccc1Cl)F 62a_100011217299_100000210303 [0,2,0,0,0,0|1,0,0]=3 18381 B12R1.374 CCCSc1cc(ccc1Cl)N 62a_100000210303_100012360549 [0,2,0,0,0,0|1,0,0]=3 18382 B12R1.374 CCCSc1cc(ccc1Cl)N 62a_100012360549_100000210303 [0,2,0,0,0,0|1,0,0]=3 18383 B12R1.374 CCCSc1cc(ccc1Cl)O 62a_100000049588_100000210303 [0,2,0,0,0,0|1,0,0]=3 18384 B12R1.374 CCCSc1cc(ccc1Cl)O 62a_100000210303_100000049588 [0,2,0,0,0,0|1,0,0]=3 18385 B12R1.374 CCCSc1cc(ccc1F)Br 62a_100000210303_100011217312 [0,2,0,0,0,0|1,0,0]=3 18386 B12R1.374 CCCSc1cc(ccc1F)Br 62a_100011217312_100000210303 [0,2,0,0,0,0|1,0,0]=3 18387 B12R1.374 CCCSc1cc(ccc1F)C 62a_100000210303_100000736223 [0,2,0,0,0,0|1,0,0]=3 18388 B12R1.374 CCCSc1cc(ccc1F)C 62a_100000736223_100000210303 [0,2,0,0,0,0|1,0,0]=3 18389 B12R1.374 CCCSc1cc(ccc1F)Cl 62a_100000210303_100011218116 [0,2,0,0,0,0|1,0,0]=3 18390 B12R1.374 CCCSc1cc(ccc1F)Cl 62a_100011218116_100000210303 [0,2,0,0,0,0|1,0,0]=3 18391 B12R1.374 CCCSc1cc(ccc1F)F 62a_100000210303_100011219198 [0,2,0,0,0,0|1,0,0]=3 18392 B12R1.374 CCCSc1cc(ccc1F)F 62a_100011219198_100000210303 [0,2,0,0,0,0|1,0,0]=3 18393 B12R1.374 CCCSc1cc(ccc1F)N 62a_100000210303_100000760356 [0,2,0,0,0,0|1,0,0]=3 18394 B12R1.374 CCCSc1cc(ccc1F)N 62a_100000760356_100000210303 [0,2,0,0,0,0|1,0,0]=3 18395 B12R1.374 CCCSc1cc(ccc1F)O 62a_100000210303_100000693481 [0,2,0,0,0,0|1,0,0]=3 18396 B12R1.374 CCCSc1cc(ccc1F)O 62a_100000693481_100000210303 [0,2,0,0,0,0|1,0,0]=3 18397 B12R1.374 CCCSc1cc(ccc1N)Br 62a_100000187925_100000210303 [0,2,0,0,0,0|1,0,0]=3 18398 B12R1.374 CCCSc1cc(ccc1N)Br 62a_100000210303_100000187925 [0,2,0,0,0,0|1,0,0]=3 18399 B12R1.374 CCCSc1cc(ccc1N)C 62a_100000210303_100011356834 [0,2,0,0,0,0|1,0,0]=3 18400 B12R1.374 CCCSc1cc(ccc1N)C 62a_100011356834_100000210303 [0,2,0,0,0,0|1,0,0]=3 18401 B12R1.374 CCCSc1cc(ccc1N)Cl 62a_100000210303_100000761889 [0,2,0,0,0,0|1,0,0]=3 18402 B12R1.374 CCCSc1cc(ccc1N)Cl 62a_100000761889_100000210303 [0,2,0,0,0,0|1,0,0]=3 18403 B12R1.374 CCCSc1cc(ccc1N)F 62a_100000210303_100000760547 [0,2,0,0,0,0|1,0,0]=3 18404 B12R1.374 CCCSc1cc(ccc1N)F 62a_100000760547_100000210303 [0,2,0,0,0,0|1,0,0]=3 18405 B12R1.374 CCCSc1cc(ccc1N)N 62a_100000210303_100011534242 [0,2,0,0,0,0|1,0,0]=3 18406 B12R1.374 CCCSc1cc(ccc1N)N 62a_100011534242_100000210303 [0,2,0,0,0,0|1,0,0]=3 18407 B12R1.374 CCCSc1cc(ccc1N)O 62a_100000210303_100012001276 [0,2,0,0,0,0|1,0,0]=3 18408 B12R1.374 CCCSc1cc(ccc1N)O 62a_100012001276_100000210303 [0,2,0,0,0,0|1,0,0]=3 18409 B12R1.374 CCCSc1cc(ccc1O)Br 62a_100000210303_100012355227 [0,2,0,0,0,0|0,0,0]=2 18410 B12R1.374 CCCSc1cc(ccc1O)Br 62a_100012355227_100000210303 [0,2,0,0,0,0|0,0,0]=2 18411 B12R1.374 CCCSc1cc(ccc1O)C 62a_100000210303_100000765521 [0,2,0,0,0,0|0,0,0]=2 18412 B12R1.374 CCCSc1cc(ccc1O)C 62a_100000765521_100000210303 [0,2,0,0,0,0|0,0,0]=2 18413 B12R1.374 CCCSc1cc(ccc1O)Cl 62a_100000210303_100011356953 [0,2,0,0,0,0|0,0,0]=2 18414 B12R1.374 CCCSc1cc(ccc1O)Cl 62a_100011356953_100000210303 [0,2,0,0,0,0|0,0,0]=2 18415 B12R1.374 CCCSc1cc(ccc1O)F 62a_100000210303_100000211999 [0,2,0,0,0,0|0,0,0]=2 18416 B12R1.374 CCCSc1cc(ccc1O)F 62a_100000211999_100000210303 [0,2,0,0,0,0|0,0,0]=2 18417 B12R1.374 CCCSc1cc(ccc1O)N 62a_100000210303_100011534360 [0,2,0,0,0,0|0,0,0]=2 18418 B12R1.374 CCCSc1cc(ccc1O)N 62a_100011534360_100000210303 [0,2,0,0,0,0|0,0,0]=2 18419 B12R1.374 CCCSc1cc(ccc1O)O 62a_100000210303_100009813629 [0,2,0,0,0,0|0,0,0]=2 18420 B12R1.374 CCCSc1cc(cnc1Br)N 62a_100000210303_100010201102 [0,2,0,0,0,0|2,0,0]=4 18421 B12R1.374 CCCSc1cc(cnc1Br)N 62a_100010201102_100000210303 [0,2,0,0,0,0|2,0,0]=4 18422 B12R1.374 CCCSc1cc(cnc1C)Br 62a_100000210303_200010090566 [0,2,0,0,0,0|2,0,0]=4 18423 B12R1.374 CCCSc1cc(cnc1C)Br 62a_200010090566_100000210303 [0,2,0,0,0,0|2,0,0]=4 18424 B12R1.374 CCCSc1cc(cnc1C)C 62a_100000210303_100009817436 [0,2,0,0,0,0|2,0,0]=4 18425 B12R1.374 CCCSc1cc(cnc1C)C 62a_100009817436_100000210303 [0,2,0,0,0,0|2,0,0]=4 18426 B12R1.374 CCCSc1cc(cnc1C)F 62a_100000210303_100009860710 [0,2,0,0,0,0|2,0,0]=4 18427 B12R1.374 CCCSc1cc(cnc1C)F 62a_100009860710_100000210303 [0,2,0,0,0,0|2,0,0]=4 18428 B12R1.374 CCCSc1cc(cnc1C)N 62a_100000210303_100011998591 [0,2,0,0,0,0|2,0,0]=4 18429 B12R1.374 CCCSc1cc(cnc1C)N 62a_100011998591_100000210303 [0,2,0,0,0,0|2,0,0]=4 18430 B12R1.374 CCCSc1cc(cnc1C)O 62a_100000210303_100009819603 [0,2,0,0,0,0|2,0,0]=4 18431 B12R1.374 CCCSc1cc(cnc1C)O 62a_100009819603_100000210303 [0,2,0,0,0,0|2,0,0]=4 18432 B12R1.374 CCCSc1cc(cnc1Cl)Br 62a_100000210303_100009814771 [0,2,0,0,0,0|2,0,0]=4 18433 B12R1.374 CCCSc1cc(cnc1Cl)Br 62a_100009814771_100000210303 [0,2,0,0,0,0|2,0,0]=4 18434 B12R1.374 CCCSc1cc(cnc1Cl)C 62a_100000210303_100010210167 [0,2,0,0,0,0|2,0,0]=4 18435 B12R1.374 CCCSc1cc(cnc1Cl)C 62a_100010210167_100000210303 [0,2,0,0,0,0|2,0,0]=4 18436 B12R1.374 CCCSc1cc(cnc1Cl)Cl 62a_100000210303_200000062399 [0,2,0,0,0,0|2,0,0]=4 18437 B12R1.374 CCCSc1cc(cnc1Cl)Cl 62a_200000062399_100000210303 [0,2,0,0,0,0|2,0,0]=4 18438 B12R1.374 CCCSc1cc(cnc1Cl)N 62a_100000210303_100010253917 [0,2,0,0,0,0|2,0,0]=4 18439 B12R1.374 CCCSc1cc(cnc1Cl)N 62a_100010253917_100000210303 [0,2,0,0,0,0|2,0,0]=4 18440 B12R1.374 CCCSc1cc(cnc1F)Br 62a_100000210303_100010172738 [0,2,0,0,0,0|2,0,0]=4 18441 B12R1.374 CCCSc1cc(cnc1F)Br 62a_100010172738_100000210303 [0,2,0,0,0,0|2,0,0]=4 18442 B12R1.374 CCCSc1cc(cnc1F)C 62a_100000049784_100000210303 [0,2,0,0,0,0|2,0,0]=4 18443 B12R1.374 CCCSc1cc(cnc1F)C 62a_100000210303_100000049784 [0,2,0,0,0,0|2,0,0]=4 18444 B12R1.374 CCCSc1cc(cnc1F)Cl 62a_100000210303_100010188783 [0,2,0,0,0,0|2,0,0]=4 18445 B12R1.374 CCCSc1cc(cnc1F)Cl 62a_100010188783_100000210303 [0,2,0,0,0,0|2,0,0]=4 18446 B12R1.374 CCCSc1cc(cnc1F)F 62a_100000210303_100009820768 [0,2,0,0,0,0|2,0,0]=4 18447 B12R1.374 CCCSc1cc(cnc1F)F 62a_100009820768_100000210303 [0,2,0,0,0,0|2,0,0]=4 18448 B12R1.374 CCCSc1cc(cnc1F)N 62a_100000210303_100009840397 [0,2,0,0,0,0|2,0,0]=4 18449 B12R1.374 CCCSc1cc(cnc1F)N 62a_100009840397_100000210303 [0,2,0,0,0,0|2,0,0]=4 18450 B12R1.374 CCCSc1cc(cnc1F)O 62a_100000210303_100009817267 [0,2,0,0,0,0|2,0,0]=4 18451 B12R1.374 CCCSc1cc(cnc1F)O 62a_100009817267_100000210303 [0,2,0,0,0,0|2,0,0]=4 18452 B12R1.374 CCCSc1cc(cnc1N)Br 62a_100000210303_100000760472 [0,2,0,0,0,0|2,0,0]=4 18453 B12R1.374 CCCSc1cc(cnc1N)Br 62a_100000760472_100000210303 [0,2,0,0,0,0|2,0,0]=4 18454 B12R1.374 CCCSc1cc(cnc1N)C 62a_100000049664_100000210303 [0,2,0,0,0,0|2,0,0]=4 18455 B12R1.374 CCCSc1cc(cnc1N)C 62a_100000210303_100000049664 [0,2,0,0,0,0|2,0,0]=4 18456 B12R1.374 CCCSc1cc(cnc1N)Cl 62a_100000050159_100000210303 [0,2,0,0,0,0|2,0,0]=4 18457 B12R1.374 CCCSc1cc(cnc1N)Cl 62a_100000210303_100000050159 [0,2,0,0,0,0|2,0,0]=4 18458 B12R1.374 CCCSc1cc(cnc1N)F 62a_100000210303_100009814671 [0,2,0,0,0,0|2,0,0]=4 18459 B12R1.374 CCCSc1cc(cnc1N)F 62a_100009814671_100000210303 [0,2,0,0,0,0|2,0,0]=4 18460 B12R1.374 CCCSc1cc(cnc1N)N 62a_100000210303_200011934315 [0,2,0,0,0,0|2,0,0]=4 18461 B12R1.374 CCCSc1cc(cnc1N)N 62a_200011934315_100000210303 [0,2,0,0,0,0|2,0,0]=4 18462 B12R1.374 CCCSc1cc(cnc1O)Br 62a_100000210303_100010197142 [0,2,0,0,0,0|1,0,0]=3 18463 B12R1.374 CCCSc1cc(cnc1O)Br 62a_100010197142_100000210303 [0,2,0,0,0,0|1,0,0]=3 18464 B12R1.374 CCCSc1cc(cnc1O)C 62a_100000210303_100000719714 [0,2,0,0,0,0|1,0,0]=3 18465 B12R1.374 CCCSc1cc(cnc1O)C 62a_100000719714_100000210303 [0,2,0,0,0,0|1,0,0]=3 18466 B12R1.374 CCCSc1cc(cnc1O)Cl 62a_100000210303_100010188700 [0,2,0,0,0,0|1,0,0]=3 18467 B12R1.374 CCCSc1cc(cnc1O)Cl 62a_100010188700_100000210303 [0,2,0,0,0,0|1,0,0]=3 18468 B12R1.374 CCCSc1cc(ncc1Br)Br 62a_100000210303_100010171693 [0,2,0,0,0,0|2,0,0]=4 18469 B12R1.374 CCCSc1cc(ncc1Br)Br 62a_100010171693_100000210303 [0,2,0,0,0,0|2,0,0]=4 18470 B12R1.374 CCCSc1cc(ncc1Br)Cl 62a_100000210303_100009815598 [0,2,0,0,0,0|2,0,0]=4 18471 B12R1.374 CCCSc1cc(ncc1Br)Cl 62a_100009815598_100000210303 [0,2,0,0,0,0|2,0,0]=4 18472 B12R1.374 CCCSc1cc(ncc1C)Br 62a_100000210303_100010067628 [0,2,0,0,0,0|2,0,0]=4 18473 B12R1.374 CCCSc1cc(ncc1C)Br 62a_100010067628_100000210303 [0,2,0,0,0,0|2,0,0]=4 18474 B12R1.374 CCCSc1cc(ncc1C)C 62a_100000210303_100009862788 [0,2,0,0,0,0|2,0,0]=4 18475 B12R1.374 CCCSc1cc(ncc1C)C 62a_100009862788_100000210303 [0,2,0,0,0,0|2,0,0]=4 18476 B12R1.374 CCCSc1cc(ncc1C)Cl 62a_100000210303_100010068021 [0,2,0,0,0,0|2,0,0]=4 18477 B12R1.374 CCCSc1cc(ncc1C)Cl 62a_100010068021_100000210303 [0,2,0,0,0,0|2,0,0]=4 18478 B12R1.374 CCCSc1cc(ncc1C)F 62a_100000049870_100000210303 [0,2,0,0,0,0|2,0,0]=4 18479 B12R1.374 CCCSc1cc(ncc1C)F 62a_100000210303_100000049870 [0,2,0,0,0,0|2,0,0]=4 18480 B12R1.374 CCCSc1cc(ncc1C)N 62a_100000210303_100009819938 [0,2,0,0,0,0|2,0,0]=4 18481 B12R1.374 CCCSc1cc(ncc1C)N 62a_100009819938_100000210303 [0,2,0,0,0,0|2,0,0]=4 18482 B12R1.374 CCCSc1cc(ncc1C)O 62a_100000210303_100009831917 [0,2,0,0,0,0|2,0,0]=4 18483 B12R1.374 CCCSc1cc(ncc1C)O 62a_100009831917_100000210303 [0,2,0,0,0,0|2,0,0]=4 18484 B12R1.374 CCCSc1cc(ncc1Cl)Br 62a_100000210303_100010223331 [0,2,0,0,0,0|2,0,0]=4 18485 B12R1.374 CCCSc1cc(ncc1Cl)Br 62a_100010223331_100000210303 [0,2,0,0,0,0|2,0,0]=4 18486 B12R1.374 CCCSc1cc(ncc1Cl)Cl 62a_100000210303_100010172835 [0,2,0,0,0,0|2,0,0]=4 18487 B12R1.374 CCCSc1cc(ncc1Cl)Cl 62a_100010172835_100000210303 [0,2,0,0,0,0|2,0,0]=4 18488 B12R1.374 CCCSc1cc(ncc1Cl)F 62a_100000210303_100009892587 [0,2,0,0,0,0|2,0,0]=4 18489 B12R1.374 CCCSc1cc(ncc1Cl)F 62a_100009892587_100000210303 [0,2,0,0,0,0|2,0,0]=4 18490 B12R1.374 CCCSc1cc(ncc1Cl)N 62a_100000210303_100010134119 [0,2,0,0,0,0|2,0,0]=4 18491 B12R1.374 CCCSc1cc(ncc1Cl)N 62a_100010134119_100000210303 [0,2,0,0,0,0|2,0,0]=4 18492 B12R1.374 CCCSc1cc(ncc1F)Br 62a_100000210303_100010193852 [0,2,0,0,0,0|2,0,0]=4 18493 B12R1.374 CCCSc1cc(ncc1F)Br 62a_100010193852_100000210303 [0,2,0,0,0,0|2,0,0]=4 18494 B12R1.374 CCCSc1cc(ncc1F)C 62a_100000210303_100009867690 [0,2,0,0,0,0|2,0,0]=4 18495 B12R1.374 CCCSc1cc(ncc1F)C 62a_100009867690_100000210303 [0,2,0,0,0,0|2,0,0]=4 18496 B12R1.374 CCCSc1cc(ncc1F)Cl 62a_100000210303_100000708277 [0,2,0,0,0,0|2,0,0]=4 18497 B12R1.374 CCCSc1cc(ncc1F)Cl 62a_100000708277_100000210303 [0,2,0,0,0,0|2,0,0]=4 18498 B12R1.374 CCCSc1cc(ncc1F)F 62a_100000210303_100010233071 [0,2,0,0,0,0|2,0,0]=4 18499 B12R1.374 CCCSc1cc(ncc1F)F 62a_100010233071_100000210303 [0,2,0,0,0,0|2,0,0]=4 18500 B12R1.374 CCCSc1cc(ncc1F)N 62a_100000210303_100015713587 [0,2,0,0,0,0|2,0,0]=4 18501 B12R1.374 CCCSc1cc(ncc1F)N 62a_100015713587_100000210303 [0,2,0,0,0,0|2,0,0]=4 18502 B12R1.374 CCCSc1cc(ncc1N)Cl 62a_100000050123_100000210303 [0,2,0,0,0,0|2,0,0]=4 18503 B12R1.374 CCCSc1cc(ncc1N)Cl 62a_100000210303_100000050123 [0,2,0,0,0,0|2,0,0]=4 18504 B12R1.374 CCCSc1cc(ncc1O)C 62a_100000210303_100009843476 [0,2,0,0,0,0|1,0,0]=3 18505 B12R1.374 CCCSc1cc(ncc1O)C 62a_100009843476_100000210303 [0,2,0,0,0,0|1,0,0]=3 18506 B12R1.374 CCCSc1cc(ncc1O)Cl 62a_100000210303_100000698892 [0,2,0,0,0,0|1,0,0]=3 18507 B12R1.374 CCCSc1cc(ncc1O)Cl 62a_100000698892_100000210303 [0,2,0,0,0,0|1,0,0]=3 18508 B12R1.374 CCCSc1cc(nnc1O)O 62a_100000210303_100000759565 [0,2,0,0,0,0|2,0,0]=4 18509 B12R1.374 CCCSc1cn(ccc1=O)C 62a_100000210303_100010750718 [0,2,0,0,0,0|1,0,1]=4 18510 B12R1.374 CCCSc1cn(ccc1=O)C 62a_100010750718_100000210303 [0,2,0,0,0,0|1,0,1]=4 18511 B12R1.374 CCCSc1nc(ccc1Br)N 62a_100000210303_100010192275 [0,2,0,0,0,0|2,0,0]=4 18512 B12R1.374 CCCSc1nc(ccc1Br)N 62a_100010192275_100000210303 [0,2,0,0,0,0|2,0,0]=4 18513 B12R1.374 CCCSc1nc(ccc1C)C 62a_100000210303_100009854376 [0,2,0,0,0,0|2,0,0]=4 18514 B12R1.374 CCCSc1nc(ccc1C)C 62a_100009854376_100000210303 [0,2,0,0,0,0|2,0,0]=4 18515 B12R1.374 CCCSc1nc(ccc1C)N 62a_100000126722_100000210303 [0,2,0,0,0,0|2,0,0]=4 18516 B12R1.374 CCCSc1nc(ccc1C)N 62a_100000210303_100000126722 [0,2,0,0,0,0|2,0,0]=4 18517 B12R1.374 CCCSc1nc(ccc1F)C 62a_100000210303_100009817602 [0,2,0,0,0,0|2,0,0]=4 18518 B12R1.374 CCCSc1nc(ccc1F)C 62a_100009817602_100000210303 [0,2,0,0,0,0|2,0,0]=4 18519 B12R1.374 CCCSc1nc(ccc1F)Cl 62a_100000210303_100010136221 [0,2,0,0,0,0|2,0,0]=4 18520 B12R1.374 CCCSc1nc(ccc1F)Cl 62a_100010136221_100000210303 [0,2,0,0,0,0|2,0,0]=4 18521 B12R1.374 CCCSc1nc(ccc1F)F 62a_100000210303_100010997973 [0,2,0,0,0,0|2,0,0]=4 18522 B12R1.374 CCCSc1nc(ccc1F)F 62a_100010997973_100000210303 [0,2,0,0,0,0|2,0,0]=4 18523 B12R1.374 CCCSc1nc(ccc1F)N 62a_100000210303_100010892222 [0,2,0,0,0,0|2,0,0]=4 18524 B12R1.374 CCCSc1nc(ccc1F)N 62a_100010892222_100000210303 [0,2,0,0,0,0|2,0,0]=4 18525 B12R1.374 CCCSc1nc(ccc1N)Br 62a_100000210303_100010168765 [0,2,0,0,0,0|2,0,0]=4 18526 B12R1.374 CCCSc1nc(ccc1N)Br 62a_100010168765_100000210303 [0,2,0,0,0,0|2,0,0]=4 18527 B12R1.374 CCCSc1nc(ccc1N)C 62a_100000210303_100000685570 [0,2,0,0,0,0|2,0,0]=4 18528 B12R1.374 CCCSc1nc(ccc1N)C 62a_100000685570_100000210303 [0,2,0,0,0,0|2,0,0]=4 18529 B12R1.374 CCCSc1nc(ccc1N)Cl 62a_100000210303_100010233647 [0,2,0,0,0,0|2,0,0]=4 18530 B12R1.374 CCCSc1nc(ccc1N)Cl 62a_100010233647_100000210303 [0,2,0,0,0,0|2,0,0]=4 18531 B12R1.374 CCCSc1nc(ccc1N)F 62a_100000210303_100009879877 [0,2,0,0,0,0|2,0,0]=4 18532 B12R1.374 CCCSc1nc(ccc1N)F 62a_100009879877_100000210303 [0,2,0,0,0,0|2,0,0]=4 18533 B12R1.374 CCCSc1nc(ccc1N)N 62a_100000210303_200009884323 [0,2,0,0,0,0|2,0,0]=4 18534 B12R1.374 CCCSc1nc(ccc1N)N 62a_200009884323_100000210303 [0,2,0,0,0,0|2,0,0]=4 18535 B12R1.374 CCCSc1nc(ccc1O)Br 62a_100000210303_100010253912 [0,2,0,0,0,0|1,0,0]=3 18536 B12R1.374 CCCSc1nc(ccc1O)Br 62a_100010253912_100000210303 [0,2,0,0,0,0|1,0,0]=3 18537 B12R1.374 CCCSc1nc(ccc1O)C 62a_100000210303_100000702858 [0,2,0,0,0,0|1,0,0]=3 18538 B12R1.374 CCCSc1nc(ccc1O)C 62a_100000702858_100000210303 [0,2,0,0,0,0|1,0,0]=3 18539 B12R1.374 CCCSc1nc(ccc1O)Cl 62a_100000210303_100000696390 [0,2,0,0,0,0|1,0,0]=3 18540 B12R1.374 CCCSc1nc(ccc1O)F 62a_100000210303_100010382442 [0,2,0,0,0,0|1,0,0]=3 18541 B12R1.374 CCCSc1nc(ccc1O)F 62a_100010382442_100000210303 [0,2,0,0,0,0|1,0,0]=3 18542 B12R1.374 CCNCc1cc(c[nH]c1=O)F 207a_100015525214_100000137007 [0,2,0,0,0,0|1,0,1]=4 18543 B12R1.374 CCNCc1cc(c[nH]c1=O)F 270004a_100015525214_100000137007 [0,2,0,0,0,0|1,0,1]=4 18544 B12R1.374 CCNCc1cc(ccc1Br)Br 207a_100015525214_100011266429 [0,2,0,0,0,0|1,0,0]=3 18545 B12R1.374 CCNCc1cc(ccc1Br)Br 2230a_100015525214_100011982794 [0,2,0,0,0,0|1,0,0]=3 18546 B12R1.374 CCNCc1cc(ccc1Br)Br 270004a_100015525214_100011266429 [0,2,0,0,0,0|1,0,0]=3 18547 B12R1.374 CCNCc1cc(ccc1Br)Br 34a_100000707832_100000210202 [0,2,0,0,0,0|1,0,0]=3 18548 B12R1.374 CCNCc1cc(ccc1Br)C 207a_100015525214_100011551863 [0,2,0,0,0,0|1,0,0]=3 18549 B12R1.374 CCNCc1cc(ccc1Br)C 270004a_100015525214_100011551863 [0,2,0,0,0,0|1,0,0]=3 18550 B12R1.374 CCNCc1cc(ccc1Br)Cl 207a_100015525214_100000746314 [0,2,0,0,0,0|1,0,0]=3 18551 B12R1.374 CCNCc1cc(ccc1Br)Cl 2230a_100015525214_100000733903 [0,2,0,0,0,0|1,0,0]=3 18552 B12R1.374 CCNCc1cc(ccc1Br)Cl 270004a_100015525214_100000746314 [0,2,0,0,0,0|1,0,0]=3 18553 B12R1.374 CCNCc1cc(ccc1Br)F 207a_100015525214_100000766564 [0,2,0,0,0,0|1,0,0]=3 18554 B12R1.374 CCNCc1cc(ccc1Br)F 2230a_100000742738_100000210202 [0,2,0,0,0,0|1,0,0]=3 18555 B12R1.374 CCNCc1cc(ccc1Br)F 2230a_100015525214_100000736370 [0,2,0,0,0,0|1,0,0]=3 18556 B12R1.374 CCNCc1cc(ccc1Br)F 270004a_100015525214_100000766564 [0,2,0,0,0,0|1,0,0]=3 18557 B12R1.374 CCNCc1cc(ccc1Br)F 34a_100000742738_100000210202 [0,2,0,0,0,0|1,0,0]=3 18558 B12R1.374 CCNCc1cc(ccc1Br)I 207a_100015525214_100010185652 [0,2,0,0,0,0|1,0,0]=3 18559 B12R1.374 CCNCc1cc(ccc1Br)I 2230a_100015525214_100012355412 [0,2,0,0,0,0|1,0,0]=3 18560 B12R1.374 CCNCc1cc(ccc1C)Br 207a_100015525214_100011361606 [0,2,0,0,0,0|1,0,0]=3 18561 B12R1.374 CCNCc1cc(ccc1C)Br 270004a_100015525214_100011361606 [0,2,0,0,0,0|1,0,0]=3 18562 B12R1.374 CCNCc1cc(ccc1C)C 207a_100015525214_100000211343 [0,2,0,0,0,0|1,0,0]=3 18563 B12R1.374 CCNCc1cc(ccc1C)C 2230a_100015525214_100000184699 [0,2,0,0,0,0|1,0,0]=3 18564 B12R1.374 CCNCc1cc(ccc1C)C 270004a_100015525214_100000211343 [0,2,0,0,0,0|1,0,0]=3 18565 B12R1.374 CCNCc1cc(ccc1C)C 34a_100000174964_100000210202 [0,2,0,0,0,0|1,0,0]=3 18566 B12R1.374 CCNCc1cc(ccc1C)Cl 207a_100015525214_100011551331 [0,2,0,0,0,0|1,0,0]=3 18567 B12R1.374 CCNCc1cc(ccc1C)Cl 2230a_100015525214_100012186985 [0,2,0,0,0,0|1,0,0]=3 18568 B12R1.374 CCNCc1cc(ccc1C)Cl 270004a_100015525214_100011551331 [0,2,0,0,0,0|1,0,0]=3 18569 B12R1.374 CCNCc1cc(ccc1C)Cl 34a_100000717755_100000210202 [0,2,0,0,0,0|1,0,0]=3 18570 B12R1.374 CCNCc1cc(ccc1C)F 207a_100015525214_100000697687 [0,2,0,0,0,0|1,0,0]=3 18571 B12R1.374 CCNCc1cc(ccc1C)F 2230a_100015525214_100000709795 [0,2,0,0,0,0|1,0,0]=3 18572 B12R1.374 CCNCc1cc(ccc1C)F 270004a_100015525214_100000697687 [0,2,0,0,0,0|1,0,0]=3 18573 B12R1.374 CCNCc1cc(ccc1C)F 34a_100011217291_100000210202 [0,2,0,0,0,0|1,0,0]=3 18574 B12R1.374 CCNCc1cc(ccc1C)O 34a_200009844824_100000210202 [0,2,0,0,0,0|1,0,0]=3 18575 B12R1.374 CCNCc1cc(ccc1Cl)Br 207a_100015525214_100000746309 [0,2,0,0,0,0|1,0,0]=3 18576 B12R1.374 CCNCc1cc(ccc1Cl)Br 2230a_100015525214_100000763347 [0,2,0,0,0,0|1,0,0]=3 18577 B12R1.374 CCNCc1cc(ccc1Cl)Br 270004a_100015525214_100000746309 [0,2,0,0,0,0|1,0,0]=3 18578 B12R1.374 CCNCc1cc(ccc1Cl)Br 34a_100025772652_100000210202 [0,2,0,0,0,0|1,0,0]=3 18579 B12R1.374 CCNCc1cc(ccc1Cl)C 207a_100015525214_100011551332 [0,2,0,0,0,0|1,0,0]=3 18580 B12R1.374 CCNCc1cc(ccc1Cl)C 2230a_100015525214_100009871730 [0,2,0,0,0,0|1,0,0]=3 18581 B12R1.374 CCNCc1cc(ccc1Cl)C 2230a_100025705715_100000210202 [0,2,0,0,0,0|1,0,0]=3 18582 B12R1.374 CCNCc1cc(ccc1Cl)C 270004a_100015525214_100011551332 [0,2,0,0,0,0|1,0,0]=3 18583 B12R1.374 CCNCc1cc(ccc1Cl)C 34a_100025705715_100000210202 [0,2,0,0,0,0|1,0,0]=3 18584 B12R1.374 CCNCc1cc(ccc1Cl)Cl 207a_100015525214_100000746308 [0,2,0,0,0,0|1,0,0]=3 18585 B12R1.374 CCNCc1cc(ccc1Cl)Cl 2230a_100015525214_100000756322 [0,2,0,0,0,0|1,0,0]=3 18586 B12R1.374 CCNCc1cc(ccc1Cl)Cl 270004a_100015525214_100000746308 [0,2,0,0,0,0|1,0,0]=3 18587 B12R1.374 CCNCc1cc(ccc1Cl)Cl 34a_100102946428_100000210202 [0,2,0,0,0,0|1,0,0]=3 18588 B12R1.374 CCNCc1cc(ccc1Cl)F 207a_100015525214_100011218309 [0,2,0,0,0,0|1,0,0]=3 18589 B12R1.374 CCNCc1cc(ccc1Cl)F 2230a_100011830483_100000210202 [0,2,0,0,0,0|1,0,0]=3 18590 B12R1.374 CCNCc1cc(ccc1Cl)F 2230a_100015525214_100000709952 [0,2,0,0,0,0|1,0,0]=3 18591 B12R1.374 CCNCc1cc(ccc1Cl)F 270004a_100015525214_100011218309 [0,2,0,0,0,0|1,0,0]=3 18592 B12R1.374 CCNCc1cc(ccc1Cl)F 34a_100011830483_100000210202 [0,2,0,0,0,0|1,0,0]=3 18593 B12R1.374 CCNCc1cc(ccc1Cl)I 207a_100015525214_100010254384 [0,2,0,0,0,0|1,0,0]=3 18594 B12R1.374 CCNCc1cc(ccc1Cl)I 2230a_100015525214_100010188191 [0,2,0,0,0,0|1,0,0]=3 18595 B12R1.374 CCNCc1cc(ccc1F)Br 207a_100015525214_100000211465 [0,2,0,0,0,0|1,0,0]=3 18596 B12R1.374 CCNCc1cc(ccc1F)Br 2230a_100015525214_100000736399 [0,2,0,0,0,0|1,0,0]=3 18597 B12R1.374 CCNCc1cc(ccc1F)Br 270004a_100015525214_100000211465 [0,2,0,0,0,0|1,0,0]=3 18598 B12R1.374 CCNCc1cc(ccc1F)Br 34a_100009815772_100000210202 [0,2,0,0,0,0|1,0,0]=3 18599 B12R1.374 CCNCc1cc(ccc1F)C 207a_100015525214_100000756917 [0,2,0,0,0,0|1,0,0]=3 18600 B12R1.374 CCNCc1cc(ccc1F)C 2230a_100015525214_100011260760 [0,2,0,0,0,0|1,0,0]=3 18601 B12R1.374 CCNCc1cc(ccc1F)C 270004a_100015525214_100000756917 [0,2,0,0,0,0|1,0,0]=3 18602 B12R1.374 CCNCc1cc(ccc1F)C 34a_100102693586_100000210202 [0,2,0,0,0,0|1,0,0]=3 18603 B12R1.374 CCNCc1cc(ccc1F)Cl 207a_100015525214_100000745245 [0,2,0,0,0,0|1,0,0]=3 18604 B12R1.374 CCNCc1cc(ccc1F)Cl 2230a_100015525214_100000716957 [0,2,0,0,0,0|1,0,0]=3 18605 B12R1.374 CCNCc1cc(ccc1F)Cl 270004a_100015525214_100000745245 [0,2,0,0,0,0|1,0,0]=3 18606 B12R1.374 CCNCc1cc(ccc1F)Cl 34a_100011211646_100000210202 [0,2,0,0,0,0|1,0,0]=3 18607 B12R1.374 CCNCc1cc(ccc1F)F 207a_100015525214_100000740046 [0,2,0,0,0,0|1,0,0]=3 18608 B12R1.374 CCNCc1cc(ccc1F)F 2230a_100015525214_100000741279 [0,2,0,0,0,0|1,0,0]=3 18609 B12R1.374 CCNCc1cc(ccc1F)F 270004a_100015525214_100000740046 [0,2,0,0,0,0|1,0,0]=3 18610 B12R1.374 CCNCc1cc(ccc1F)F 34a_100000752317_100000210202 [0,2,0,0,0,0|1,0,0]=3 18611 B12R1.374 CCNCc1cc(ccc1F)I 207a_100015525214_100000050626 [0,2,0,0,0,0|1,0,0]=3 18612 B12R1.374 CCNCc1cc(ccc1F)I 2230a_100015525214_200010149601 [0,2,0,0,0,0|1,0,0]=3 18613 B12R1.374 CCNCc1cc(ccc1F)O 271570a_203496583355_100000748473 [0,2,0,0,0,0|1,0,0]=3 18614 B12R1.374 CCNCc1cc(ccc1I)Br 207a_100015525214_100010185651 [0,2,0,0,0,0|1,0,0]=3 18615 B12R1.374 CCNCc1cc(ccc1I)Br 2230a_100015525214_100012362523 [0,2,0,0,0,0|1,0,0]=3 18616 B12R1.374 CCNCc1cc(ccc1I)Br 270004a_100015525214_100010185651 [0,2,0,0,0,0|1,0,0]=3 18617 B12R1.374 CCNCc1cc(ccc1I)C 207a_100015525214_100010150105 [0,2,0,0,0,0|1,0,0]=3 18618 B12R1.374 CCNCc1cc(ccc1I)C 270004a_100015525214_100010150105 [0,2,0,0,0,0|1,0,0]=3 18619 B12R1.374 CCNCc1cc(ccc1I)Cl 207a_100015525214_100010254386 [0,2,0,0,0,0|1,0,0]=3 18620 B12R1.374 CCNCc1cc(ccc1I)Cl 2230a_100015525214_100012348826 [0,2,0,0,0,0|1,0,0]=3 18621 B12R1.374 CCNCc1cc(ccc1I)Cl 270004a_100015525214_100010254386 [0,2,0,0,0,0|1,0,0]=3 18622 B12R1.374 CCNCc1cc(ccc1I)F 207a_100015525214_100010186294 [0,2,0,0,0,0|1,0,0]=3 18623 B12R1.374 CCNCc1cc(ccc1I)F 2230a_100015525214_100010149606 [0,2,0,0,0,0|1,0,0]=3 18624 B12R1.374 CCNCc1cc(ccc1I)F 270004a_100015525214_100010186294 [0,2,0,0,0,0|1,0,0]=3 18625 B12R1.374 CCNCc1cc(ccc1O)Br 34a_100000730032_100000210202 [0,2,0,0,0,0|0,0,0]=2 18626 B12R1.374 CCNCc1cc(ccc1O)Cl 34a_100000238540_100000210202 [0,2,0,0,0,0|0,0,0]=2 18627 B12R1.374 CCNCc1cc(ccc1O)O 271570a_203496583355_100000765307 [0,2,0,0,0,0|0,0,0]=2 18628 B12R1.374 CCNCc1cc(cnc1Br)Br 207a_100015525214_100010177830 [0,2,0,0,0,0|2,0,0]=4 18629 B12R1.374 CCNCc1cc(cnc1Br)Br 2230a_100015525214_100010253922 [0,2,0,0,0,0|2,0,0]=4 18630 B12R1.374 CCNCc1cc(cnc1Br)F 2230a_100010760786_100000210202 [0,2,0,0,0,0|2,0,0]=4 18631 B12R1.374 CCNCc1cc(cnc1Br)F 34a_100010760786_100000210202 [0,2,0,0,0,0|2,0,0]=4 18632 B12R1.374 CCNCc1cc(cnc1C)Cl 207a_100015525214_100000100030 [0,2,0,0,0,0|2,0,0]=4 18633 B12R1.374 CCNCc1cc(cnc1C)Cl 270004a_100015525214_100000100030 [0,2,0,0,0,0|2,0,0]=4 18634 B12R1.374 CCNCc1cc(cnc1Cl)Br 207a_100015525214_100009816941 [0,2,0,0,0,0|2,0,0]=4 18635 B12R1.374 CCNCc1cc(cnc1Cl)Br 2230a_100015525214_100009816982 [0,2,0,0,0,0|2,0,0]=4 18636 B12R1.374 CCNCc1cc(cnc1Cl)C 207a_100015525214_100000050350 [0,2,0,0,0,0|2,0,0]=4 18637 B12R1.374 CCNCc1cc(cnc1Cl)Cl 207a_100015525214_100000086932 [0,2,0,0,0,0|2,0,0]=4 18638 B12R1.374 CCNCc1cc(cnc1Cl)F 207a_100015525214_100000079965 [0,2,0,0,0,0|2,0,0]=4 18639 B12R1.374 CCNCc1cc(cnc1F)C 207a_100015525214_100009854360 [0,2,0,0,0,0|2,0,0]=4 18640 B12R1.374 CCNCc1cc(cnc1O)Br 207a_100015525214_100010064889 [0,2,0,0,0,0|1,0,0]=3 18641 B12R1.374 CCNCc1cc(cnc1O)Br 270004a_100015525214_100010064889 [0,2,0,0,0,0|1,0,0]=3 18642 B12R1.374 CCNCc1cc(ncc1Br)Br 270004a_100015525214_100010230906 [0,2,0,0,0,0|2,0,0]=4 18643 B12R1.374 CCNCc1cc(ncc1Cl)Br 270004a_100015525214_100010214479 [0,2,0,0,0,0|2,0,0]=4 18644 B12R1.374 CCNCc1cc(ncc1Cl)Cl 270004a_100015525214_100000050890 [0,2,0,0,0,0|2,0,0]=4 18645 B12R1.374 CCNCc1cc(ncc1F)Br 270004a_100015525214_100000707870 [0,2,0,0,0,0|2,0,0]=4 18646 B12R1.374 CCNCc1nc(ccc1Br)C 207a_100015525214_100010173661 [0,2,0,0,0,0|2,0,0]=4 18647 B12R1.374 CCNCc1nc(ccc1Br)C 270004a_100015525214_100010173661 [0,2,0,0,0,0|2,0,0]=4 18648 B12R1.374 CCNCc1nc(ccc1Br)Cl 270004a_100015525214_100000734296 [0,2,0,0,0,0|2,0,0]=4 18649 B12R1.374 CCNCc1nc(ccc1Cl)C 2230a_100015525214_200009852033 [0,2,0,0,0,0|2,0,0]=4 18650 B12R1.374 CCNCc1nc(ccc1Cl)Cl 2230a_100015525214_100000059412 [0,2,0,0,0,0|2,0,0]=4 18651 B12R1.374 CCNCc1nc(ccc1Cl)Cl 270004a_100015525214_100011935248 [0,2,0,0,0,0|2,0,0]=4 18652 B12R1.374 CCNCc1nc(ccc1F)Br 2230a_100015525214_100010065826 [0,2,0,0,0,0|2,0,0]=4 18653 B12R1.374 CCNCc1nc(ccc1F)Br 270004a_100015525214_100009814804 [0,2,0,0,0,0|2,0,0]=4 18654 B12R1.374 CCNCc1nc(ccc1F)Cl 2230a_100009887702_100000210202 [0,2,0,0,0,0|2,0,0]=4 18655 B12R1.374 CCNCc1nc(ccc1F)Cl 2230a_100015525214_100009881012 [0,2,0,0,0,0|2,0,0]=4 18656 B12R1.374 CCNCc1nc(ccc1F)Cl 270004a_100015525214_100000050918 [0,2,0,0,0,0|2,0,0]=4 18657 B12R1.374 CCNCc1nc(ccc1F)Cl 34a_100009887702_100000210202 [0,2,0,0,0,0|2,0,0]=4 18658 B12R1.374 CCNCc1nc(ccc1O)C 2230a_100015525214_100020630696 [0,2,0,0,0,0|1,0,0]=3 18659 B12R1.374 CCOCc1cc(ccc1Br)Br 34a_100011266457_100000210202 [0,2,0,0,0,0|1,0,0]=3 18660 B12R1.374 CCOCc1cc(ccc1Br)Br 34a_100121572206_100011982794 [0,2,0,0,0,0|1,0,0]=3 18661 B12R1.374 CCOCc1cc(ccc1Br)Br 7a_100011266457_100000210202 [0,2,0,0,0,0|1,0,0]=3 18662 B12R1.374 CCOCc1cc(ccc1Br)C 34a_100012361352_100000210202 [0,2,0,0,0,0|1,0,0]=3 18663 B12R1.374 CCOCc1cc(ccc1Br)C 7a_100012361352_100000210202 [0,2,0,0,0,0|1,0,0]=3 18664 B12R1.374 CCOCc1cc(ccc1Br)Cl 34a_100012355668_100000210202 [0,2,0,0,0,0|1,0,0]=3 18665 B12R1.374 CCOCc1cc(ccc1Br)Cl 34a_100121572206_100000733903 [0,2,0,0,0,0|1,0,0]=3 18666 B12R1.374 CCOCc1cc(ccc1Br)Cl 7a_100012355668_100000210202 [0,2,0,0,0,0|1,0,0]=3 18667 B12R1.374 CCOCc1cc(ccc1Br)F 34a_100011217561_100000210202 [0,2,0,0,0,0|1,0,0]=3 18668 B12R1.374 CCOCc1cc(ccc1Br)F 34a_100121572206_100000736370 [0,2,0,0,0,0|1,0,0]=3 18669 B12R1.374 CCOCc1cc(ccc1Br)F 7a_100011217561_100000210202 [0,2,0,0,0,0|1,0,0]=3 18670 B12R1.374 CCOCc1cc(ccc1Br)I 34a_100121572206_100012355412 [0,2,0,0,0,0|1,0,0]=3 18671 B12R1.374 CCOCc1cc(ccc1Br)I 7a_100012359683_100000210202 [0,2,0,0,0,0|1,0,0]=3 18672 B12R1.374 CCOCc1cc(ccc1Br)N 34a_100012347228_100000210202 [0,2,0,0,0,0|1,0,0]=3 18673 B12R1.374 CCOCc1cc(ccc1C)Br 34a_100000700630_100000210202 [0,2,0,0,0,0|1,0,0]=3 18674 B12R1.374 CCOCc1cc(ccc1C)Br 7a_100000700630_100000210202 [0,2,0,0,0,0|1,0,0]=3 18675 B12R1.374 CCOCc1cc(ccc1C)C 34a_100121572206_100000184699 [0,2,0,0,0,0|1,0,0]=3 18676 B12R1.374 CCOCc1cc(ccc1C)C 34a_200011215349_100000210202 [0,2,0,0,0,0|1,0,0]=3 18677 B12R1.374 CCOCc1cc(ccc1C)C 7a_200011215349_100000210202 [0,2,0,0,0,0|1,0,0]=3 18678 B12R1.374 CCOCc1cc(ccc1C)Cl 34a_100012002407_100000210202 [0,2,0,0,0,0|1,0,0]=3 18679 B12R1.374 CCOCc1cc(ccc1C)Cl 34a_100121572206_100012186985 [0,2,0,0,0,0|1,0,0]=3 18680 B12R1.374 CCOCc1cc(ccc1C)Cl 7a_100012002407_100000210202 [0,2,0,0,0,0|1,0,0]=3 18681 B12R1.374 CCOCc1cc(ccc1C)F 34a_100011219218_100000210202 [0,2,0,0,0,0|1,0,0]=3 18682 B12R1.374 CCOCc1cc(ccc1C)F 34a_100121572206_100000709795 [0,2,0,0,0,0|1,0,0]=3 18683 B12R1.374 CCOCc1cc(ccc1C)F 7a_100011219218_100000210202 [0,2,0,0,0,0|1,0,0]=3 18684 B12R1.374 CCOCc1cc(ccc1C)I 34a_100010150140_100000210202 [0,2,0,0,0,0|1,0,0]=3 18685 B12R1.374 CCOCc1cc(ccc1C)I 7a_100010150140_100000210202 [0,2,0,0,0,0|1,0,0]=3 18686 B12R1.374 CCOCc1cc(ccc1Cl)Br 34a_100011215897_100000210202 [0,2,0,0,0,0|1,0,0]=3 18687 B12R1.374 CCOCc1cc(ccc1Cl)Br 34a_100121572206_100000763347 [0,2,0,0,0,0|1,0,0]=3 18688 B12R1.374 CCOCc1cc(ccc1Cl)Br 7a_100011215897_100000210202 [0,2,0,0,0,0|1,0,0]=3 18689 B12R1.374 CCOCc1cc(ccc1Cl)C 34a_100009878994_100000210202 [0,2,0,0,0,0|1,0,0]=3 18690 B12R1.374 CCOCc1cc(ccc1Cl)C 34a_100121572206_100009871730 [0,2,0,0,0,0|1,0,0]=3 18691 B12R1.374 CCOCc1cc(ccc1Cl)C 7a_100009878994_100000210202 [0,2,0,0,0,0|1,0,0]=3 18692 B12R1.374 CCOCc1cc(ccc1Cl)Cl 34a_100000698905_100000210202 [0,2,0,0,0,0|1,0,0]=3 18693 B12R1.374 CCOCc1cc(ccc1Cl)Cl 34a_100121572206_100000756322 [0,2,0,0,0,0|1,0,0]=3 18694 B12R1.374 CCOCc1cc(ccc1Cl)Cl 7a_100000698905_100000210202 [0,2,0,0,0,0|1,0,0]=3 18695 B12R1.374 CCOCc1cc(ccc1Cl)F 34a_100011218361_100000210202 [0,2,0,0,0,0|1,0,0]=3 18696 B12R1.374 CCOCc1cc(ccc1Cl)F 34a_100121572206_100000709952 [0,2,0,0,0,0|1,0,0]=3 18697 B12R1.374 CCOCc1cc(ccc1Cl)F 7a_100011218361_100000210202 [0,2,0,0,0,0|1,0,0]=3 18698 B12R1.374 CCOCc1cc(ccc1Cl)I 34a_100010128486_100000210202 [0,2,0,0,0,0|1,0,0]=3 18699 B12R1.374 CCOCc1cc(ccc1Cl)I 34a_100121572206_100010188191 [0,2,0,0,0,0|1,0,0]=3 18700 B12R1.374 CCOCc1cc(ccc1Cl)I 7a_100010128486_100000210202 [0,2,0,0,0,0|1,0,0]=3 18701 B12R1.374 CCOCc1cc(ccc1Cl)N 34a_100011273577_100000210202 [0,2,0,0,0,0|1,0,0]=3 18702 B12R1.374 CCOCc1cc(ccc1F)Br 34a_100000246282_100000210202 [0,2,0,0,0,0|1,0,0]=3 18703 B12R1.374 CCOCc1cc(ccc1F)Br 34a_100121572206_100000736399 [0,2,0,0,0,0|1,0,0]=3 18704 B12R1.374 CCOCc1cc(ccc1F)Br 7a_100000246282_100000210202 [0,2,0,0,0,0|1,0,0]=3 18705 B12R1.374 CCOCc1cc(ccc1F)C 34a_100011692775_100000210202 [0,2,0,0,0,0|1,0,0]=3 18706 B12R1.374 CCOCc1cc(ccc1F)C 34a_100121572206_100011260760 [0,2,0,0,0,0|1,0,0]=3 18707 B12R1.374 CCOCc1cc(ccc1F)C 7a_100011692775_100000210202 [0,2,0,0,0,0|1,0,0]=3 18708 B12R1.374 CCOCc1cc(ccc1F)Cl 34a_100011217248_100000210202 [0,2,0,0,0,0|1,0,0]=3 18709 B12R1.374 CCOCc1cc(ccc1F)Cl 34a_100121572206_100000716957 [0,2,0,0,0,0|1,0,0]=3 18710 B12R1.374 CCOCc1cc(ccc1F)Cl 7a_100011217248_100000210202 [0,2,0,0,0,0|1,0,0]=3 18711 B12R1.374 CCOCc1cc(ccc1F)F 34a_100011217725_100000210202 [0,2,0,0,0,0|1,0,0]=3 18712 B12R1.374 CCOCc1cc(ccc1F)F 34a_100121572206_100000741279 [0,2,0,0,0,0|1,0,0]=3 18713 B12R1.374 CCOCc1cc(ccc1F)F 7a_100011217725_100000210202 [0,2,0,0,0,0|1,0,0]=3 18714 B12R1.374 CCOCc1cc(ccc1F)I 34a_100000049604_100000210202 [0,2,0,0,0,0|1,0,0]=3 18715 B12R1.374 CCOCc1cc(ccc1F)I 34a_100121572206_200010149601 [0,2,0,0,0,0|1,0,0]=3 18716 B12R1.374 CCOCc1cc(ccc1F)I 7a_100000049604_100000210202 [0,2,0,0,0,0|1,0,0]=3 18717 B12R1.374 CCOCc1cc(ccc1F)N 34a_100011218011_100000210202 [0,2,0,0,0,0|1,0,0]=3 18718 B12R1.374 CCOCc1cc(ccc1I)Br 34a_100011356890_100000210202 [0,2,0,0,0,0|1,0,0]=3 18719 B12R1.374 CCOCc1cc(ccc1I)Br 34a_100121572206_100012362523 [0,2,0,0,0,0|1,0,0]=3 18720 B12R1.374 CCOCc1cc(ccc1I)Br 7a_100011356890_100000210202 [0,2,0,0,0,0|1,0,0]=3 18721 B12R1.374 CCOCc1cc(ccc1I)Cl 34a_100121572206_100012348826 [0,2,0,0,0,0|1,0,0]=3 18722 B12R1.374 CCOCc1cc(ccc1I)F 34a_100010255287_100000210202 [0,2,0,0,0,0|1,0,0]=3 18723 B12R1.374 CCOCc1cc(ccc1I)F 34a_100121572206_100010149606 [0,2,0,0,0,0|1,0,0]=3 18724 B12R1.374 CCOCc1cc(ccc1I)F 7a_100010255287_100000210202 [0,2,0,0,0,0|1,0,0]=3 18725 B12R1.374 CCOCc1cc(ccc1N)Br 34a_100012353972_100000210202 [0,2,0,0,0,0|1,0,0]=3 18726 B12R1.374 CCOCc1cc(ccc1N)Br 7a_100012353972_100000210202 [0,2,0,0,0,0|1,0,0]=3 18727 B12R1.374 CCOCc1cc(ccc1N)C 34a_100011215565_100000210202 [0,2,0,0,0,0|1,0,0]=3 18728 B12R1.374 CCOCc1cc(ccc1N)C 7a_100011215565_100000210202 [0,2,0,0,0,0|1,0,0]=3 18729 B12R1.374 CCOCc1cc(ccc1N)Cl 34a_100011214999_100000210202 [0,2,0,0,0,0|1,0,0]=3 18730 B12R1.374 CCOCc1cc(ccc1N)Cl 7a_100011214999_100000210202 [0,2,0,0,0,0|1,0,0]=3 18731 B12R1.374 CCOCc1cc(ccc1N)F 34a_100011296978_100000210202 [0,2,0,0,0,0|1,0,0]=3 18732 B12R1.374 CCOCc1cc(ccc1N)F 7a_100011296978_100000210202 [0,2,0,0,0,0|1,0,0]=3 18733 B12R1.374 CCOCc1cc(ccc1O)F 34a_100121572206_100010161318 [0,2,0,0,0,0|0,0,0]=2 18734 B12R1.374 CCOCc1cc(cnc1Br)Br 34a_100121572206_100010253922 [0,2,0,0,0,0|2,0,0]=4 18735 B12R1.374 CCOCc1cc(cnc1Br)Cl 34a_200010065233_100000210202 [0,2,0,0,0,0|2,0,0]=4 18736 B12R1.374 CCOCc1cc(cnc1Br)Cl 7a_200010065233_100000210202 [0,2,0,0,0,0|2,0,0]=4 18737 B12R1.374 CCOCc1cc(cnc1C)Br 34a_100010894652_100000210202 [0,2,0,0,0,0|2,0,0]=4 18738 B12R1.374 CCOCc1cc(cnc1C)Br 7a_100010894652_100000210202 [0,2,0,0,0,0|2,0,0]=4 18739 B12R1.374 CCOCc1cc(cnc1Cl)Br 34a_100000734252_100000210202 [0,2,0,0,0,0|2,0,0]=4 18740 B12R1.374 CCOCc1cc(cnc1Cl)Br 34a_100121572206_100009816982 [0,2,0,0,0,0|2,0,0]=4 18741 B12R1.374 CCOCc1cc(cnc1Cl)Br 7a_100000734252_100000210202 [0,2,0,0,0,0|2,0,0]=4 18742 B12R1.374 CCOCc1cc(cnc1Cl)C 34a_100000118064_100000210202 [0,2,0,0,0,0|2,0,0]=4 18743 B12R1.374 CCOCc1cc(cnc1Cl)C 7a_100000118064_100000210202 [0,2,0,0,0,0|2,0,0]=4 18744 B12R1.374 CCOCc1cc(cnc1Cl)Cl 34a_100000084153_100000210202 [0,2,0,0,0,0|2,0,0]=4 18745 B12R1.374 CCOCc1cc(cnc1Cl)Cl 7a_100000084153_100000210202 [0,2,0,0,0,0|2,0,0]=4 18746 B12R1.374 CCOCc1cc(cnc1Cl)F 34a_100000079972_100000210202 [0,2,0,0,0,0|2,0,0]=4 18747 B12R1.374 CCOCc1cc(cnc1Cl)F 7a_100000079972_100000210202 [0,2,0,0,0,0|2,0,0]=4 18748 B12R1.374 CCOCc1cc(cnc1F)Br 34a_100010202234_100000210202 [0,2,0,0,0,0|2,0,0]=4 18749 B12R1.374 CCOCc1cc(cnc1F)Br 7a_100010202234_100000210202 [0,2,0,0,0,0|2,0,0]=4 18750 B12R1.374 CCOCc1cc(cnc1F)Cl 34a_200000081815_100000210202 [0,2,0,0,0,0|2,0,0]=4 18751 B12R1.374 CCOCc1cc(cnc1F)Cl 7a_200000081815_100000210202 [0,2,0,0,0,0|2,0,0]=4 18752 B12R1.374 CCOCc1cc(cnc1N)Br 34a_100011934449_100000210202 [0,2,0,0,0,0|2,0,0]=4 18753 B12R1.374 CCOCc1cc(cnc1N)Br 7a_100011934449_100000210202 [0,2,0,0,0,0|2,0,0]=4 18754 B12R1.374 CCOCc1cc(ncc1Br)Br 34a_100010245045_100000210202 [0,2,0,0,0,0|2,0,0]=4 18755 B12R1.374 CCOCc1cc(ncc1Br)Br 7a_100010245045_100000210202 [0,2,0,0,0,0|2,0,0]=4 18756 B12R1.374 CCOCc1cc(ncc1Br)C 34a_100015579599_100000210202 [0,2,0,0,0,0|2,0,0]=4 18757 B12R1.374 CCOCc1cc(ncc1Br)Cl 34a_100010245067_100000210202 [0,2,0,0,0,0|2,0,0]=4 18758 B12R1.374 CCOCc1cc(ncc1Br)Cl 7a_100010245067_100000210202 [0,2,0,0,0,0|2,0,0]=4 18759 B12R1.374 CCOCc1cc(ncc1Cl)Cl 34a_100000081519_100000210202 [0,2,0,0,0,0|2,0,0]=4 18760 B12R1.374 CCOCc1cc(ncc1Cl)Cl 7a_100000081519_100000210202 [0,2,0,0,0,0|2,0,0]=4 18761 B12R1.374 CCOCc1cc(ncc1F)Cl 34a_100000081974_100000210202 [0,2,0,0,0,0|2,0,0]=4 18762 B12R1.374 CCOCc1cc(ncc1F)Cl 7a_100000081974_100000210202 [0,2,0,0,0,0|2,0,0]=4 18763 B12R1.374 CCOCc1cc(ncc1F)F 34a_100000730792_100000210202 [0,2,0,0,0,0|2,0,0]=4 18764 B12R1.374 CCOCc1cc(ncc1F)F 7a_100000730792_100000210202 [0,2,0,0,0,0|2,0,0]=4 18765 B12R1.374 CCOCc1nc(ccc1Br)Br 34a_200010065229_100000210202 [0,2,0,0,0,0|2,0,0]=4 18766 B12R1.374 CCOCc1nc(ccc1Br)Br 7a_200010065229_100000210202 [0,2,0,0,0,0|2,0,0]=4 18767 B12R1.374 CCOCc1nc(ccc1Br)C 34a_100010074375_100000210202 [0,2,0,0,0,0|2,0,0]=4 18768 B12R1.374 CCOCc1nc(ccc1Br)Cl 34a_100010244999_100000210202 [0,2,0,0,0,0|2,0,0]=4 18769 B12R1.374 CCOCc1nc(ccc1Br)F 34a_100000701195_100000210202 [0,2,0,0,0,0|2,0,0]=4 18770 B12R1.374 CCOCc1nc(ccc1Cl)C 34a_100121572206_200009852033 [0,2,0,0,0,0|2,0,0]=4 18771 B12R1.374 CCOCc1nc(ccc1Cl)Cl 34a_100000749784_100000210202 [0,2,0,0,0,0|2,0,0]=4 18772 B12R1.374 CCOCc1nc(ccc1Cl)Cl 34a_100121572206_100000059412 [0,2,0,0,0,0|2,0,0]=4 18773 B12R1.374 CCOCc1nc(ccc1F)Br 34a_100121572206_100010065826 [0,2,0,0,0,0|2,0,0]=4 18774 B12R1.374 CCOCc1nc(ccc1F)Cl 34a_100121572206_100009881012 [0,2,0,0,0,0|2,0,0]=4 18775 B12R1.374 CCOCc1nc(ccc1O)C 34a_100121572206_100020630696 [0,2,0,0,0,0|1,0,0]=3 18776 B12R1.374 CCSCc1cc(ccc1Br)Br 62a_100000210202_100011982794 [0,2,0,0,0,0|1,0,0]=3 18777 B12R1.374 CCSCc1cc(ccc1Br)Br 62a_100011982794_100000210202 [0,2,0,0,0,0|1,0,0]=3 18778 B12R1.374 CCSCc1cc(ccc1Br)Cl 62a_100000210202_100000733903 [0,2,0,0,0,0|1,0,0]=3 18779 B12R1.374 CCSCc1cc(ccc1Br)Cl 62a_100000733903_100000210202 [0,2,0,0,0,0|1,0,0]=3 18780 B12R1.374 CCSCc1cc(ccc1Br)F 62a_100000210202_100000736370 [0,2,0,0,0,0|1,0,0]=3 18781 B12R1.374 CCSCc1cc(ccc1Br)F 62a_100000736370_100000210202 [0,2,0,0,0,0|1,0,0]=3 18782 B12R1.374 CCSCc1cc(ccc1Br)I 62a_100000210202_100012355412 [0,2,0,0,0,0|1,0,0]=3 18783 B12R1.374 CCSCc1cc(ccc1Br)I 62a_100012355412_100000210202 [0,2,0,0,0,0|1,0,0]=3 18784 B12R1.374 CCSCc1cc(ccc1C)C 62a_100000184699_100000210202 [0,2,0,0,0,0|1,0,0]=3 18785 B12R1.374 CCSCc1cc(ccc1C)C 62a_100000210202_100000184699 [0,2,0,0,0,0|1,0,0]=3 18786 B12R1.374 CCSCc1cc(ccc1C)Cl 62a_100000210202_100012186985 [0,2,0,0,0,0|1,0,0]=3 18787 B12R1.374 CCSCc1cc(ccc1C)Cl 62a_100012186985_100000210202 [0,2,0,0,0,0|1,0,0]=3 18788 B12R1.374 CCSCc1cc(ccc1C)F 62a_100000210202_100000709795 [0,2,0,0,0,0|1,0,0]=3 18789 B12R1.374 CCSCc1cc(ccc1C)F 62a_100000709795_100000210202 [0,2,0,0,0,0|1,0,0]=3 18790 B12R1.374 CCSCc1cc(ccc1Cl)Br 62a_100000210202_100000763347 [0,2,0,0,0,0|1,0,0]=3 18791 B12R1.374 CCSCc1cc(ccc1Cl)Br 62a_100000763347_100000210202 [0,2,0,0,0,0|1,0,0]=3 18792 B12R1.374 CCSCc1cc(ccc1Cl)C 62a_100000210202_100009871730 [0,2,0,0,0,0|1,0,0]=3 18793 B12R1.374 CCSCc1cc(ccc1Cl)C 62a_100009871730_100000210202 [0,2,0,0,0,0|1,0,0]=3 18794 B12R1.374 CCSCc1cc(ccc1Cl)Cl 62a_100000210202_100000756322 [0,2,0,0,0,0|1,0,0]=3 18795 B12R1.374 CCSCc1cc(ccc1Cl)Cl 62a_100000756322_100000210202 [0,2,0,0,0,0|1,0,0]=3 18796 B12R1.374 CCSCc1cc(ccc1Cl)F 62a_100000210202_100000709952 [0,2,0,0,0,0|1,0,0]=3 18797 B12R1.374 CCSCc1cc(ccc1Cl)F 62a_100000709952_100000210202 [0,2,0,0,0,0|1,0,0]=3 18798 B12R1.374 CCSCc1cc(ccc1Cl)I 62a_100000210202_100010188191 [0,2,0,0,0,0|1,0,0]=3 18799 B12R1.374 CCSCc1cc(ccc1Cl)I 62a_100010188191_100000210202 [0,2,0,0,0,0|1,0,0]=3 18800 B12R1.374 CCSCc1cc(ccc1F)Br 62a_100000210202_100000736399 [0,2,0,0,0,0|1,0,0]=3 18801 B12R1.374 CCSCc1cc(ccc1F)Br 62a_100000736399_100000210202 [0,2,0,0,0,0|1,0,0]=3 18802 B12R1.374 CCSCc1cc(ccc1F)C 62a_100000210202_100011260760 [0,2,0,0,0,0|1,0,0]=3 18803 B12R1.374 CCSCc1cc(ccc1F)C 62a_100011260760_100000210202 [0,2,0,0,0,0|1,0,0]=3 18804 B12R1.374 CCSCc1cc(ccc1F)Cl 62a_100000210202_100000716957 [0,2,0,0,0,0|1,0,0]=3 18805 B12R1.374 CCSCc1cc(ccc1F)Cl 62a_100000716957_100000210202 [0,2,0,0,0,0|1,0,0]=3 18806 B12R1.374 CCSCc1cc(ccc1F)F 62a_100000210202_100000685659 [0,2,0,0,0,0|1,0,0]=3 18807 B12R1.374 CCSCc1cc(ccc1F)F 62a_100000685659_100000210202 [0,2,0,0,0,0|1,0,0]=3 18808 B12R1.374 CCSCc1cc(ccc1F)I 62a_100000210202_200010149601 [0,2,0,0,0,0|1,0,0]=3 18809 B12R1.374 CCSCc1cc(ccc1F)I 62a_200010149601_100000210202 [0,2,0,0,0,0|1,0,0]=3 18810 B12R1.374 CCSCc1cc(ccc1I)Br 62a_100000210202_100012362523 [0,2,0,0,0,0|1,0,0]=3 18811 B12R1.374 CCSCc1cc(ccc1I)Br 62a_100012362523_100000210202 [0,2,0,0,0,0|1,0,0]=3 18812 B12R1.374 CCSCc1cc(ccc1I)Cl 62a_100000210202_100012348826 [0,2,0,0,0,0|1,0,0]=3 18813 B12R1.374 CCSCc1cc(ccc1I)Cl 62a_100012348826_100000210202 [0,2,0,0,0,0|1,0,0]=3 18814 B12R1.374 CCSCc1cc(ccc1I)F 62a_100000210202_100010149606 [0,2,0,0,0,0|1,0,0]=3 18815 B12R1.374 CCSCc1cc(ccc1I)F 62a_100010149606_100000210202 [0,2,0,0,0,0|1,0,0]=3 18816 B12R1.374 CCSCc1cc(ccc1O)F 62a_100000210202_100010161318 [0,2,0,0,0,0|0,0,0]=2 18817 B12R1.374 CCSCc1cc(ccc1O)F 62a_100010161318_100000210202 [0,2,0,0,0,0|0,0,0]=2 18818 B12R1.374 CCSCc1cc(cnc1Br)Br 62a_100000210202_100010253922 [0,2,0,0,0,0|2,0,0]=4 18819 B12R1.374 CCSCc1cc(cnc1Br)Br 62a_100010253922_100000210202 [0,2,0,0,0,0|2,0,0]=4 18820 B12R1.374 CCSCc1cc(cnc1Cl)Br 62a_100000210202_100009816982 [0,2,0,0,0,0|2,0,0]=4 18821 B12R1.374 CCSCc1cc(cnc1Cl)Br 62a_100009816982_100000210202 [0,2,0,0,0,0|2,0,0]=4 18822 B12R1.374 CCSCc1nc(ccc1Cl)C 62a_100000210202_200009852033 [0,2,0,0,0,0|2,0,0]=4 18823 B12R1.374 CCSCc1nc(ccc1Cl)C 62a_200009852033_100000210202 [0,2,0,0,0,0|2,0,0]=4 18824 B12R1.374 CCSCc1nc(ccc1Cl)Cl 62a_100000059412_100000210202 [0,2,0,0,0,0|2,0,0]=4 18825 B12R1.374 CCSCc1nc(ccc1Cl)Cl 62a_100000210202_100000059412 [0,2,0,0,0,0|2,0,0]=4 18826 B12R1.374 CCSCc1nc(ccc1F)Br 62a_100000210202_100010065826 [0,2,0,0,0,0|2,0,0]=4 18827 B12R1.374 CCSCc1nc(ccc1F)Br 62a_100010065826_100000210202 [0,2,0,0,0,0|2,0,0]=4 18828 B12R1.374 CCSCc1nc(ccc1F)Cl 62a_100000210202_100009881012 [0,2,0,0,0,0|2,0,0]=4 18829 B12R1.374 CCSCc1nc(ccc1F)Cl 62a_100009881012_100000210202 [0,2,0,0,0,0|2,0,0]=4 18830 B12R1.374 CCSCc1nc(ccc1O)C 62a_100000210202_100020630696 [0,2,0,0,0,0|1,0,0]=3 18831 B12R1.374 CCSCc1nc(ccc1O)C 62a_100020630696_100000210202 [0,2,0,0,0,0|1,0,0]=3 18832 B12R1.374 CNCCc1cc(ccc1C)C 2230a_200011485678_200000210301 [0,2,0,0,0,0|1,0,0]=3 18833 B12R1.374 CNCCc1cc(ccc1C)C 34a_200011485678_200000210301 [0,2,0,0,0,0|1,0,0]=3 18834 B12R1.374 CNCCc1cc(ccc1Cl)Cl 2230a_100000705354_200000210301 [0,2,0,0,0,0|1,0,0]=3 18835 B12R1.374 CNCCc1cc(ccc1Cl)Cl 34a_100000705354_200000210301 [0,2,0,0,0,0|1,0,0]=3 18836 B12R1.374 CNCCc1cc(ccc1F)Cl 2230a_200011997525_200000210301 [0,2,0,0,0,0|1,0,0]=3 18837 B12R1.374 CNCCc1cc(ccc1F)Cl 34a_200011997525_200000210301 [0,2,0,0,0,0|1,0,0]=3 18838 B12R1.374 CNCCc1cc(ccc1F)F 2230a_106832991635_100011755056 [0,2,0,0,0,0|1,0,0]=3 18839 B12R1.374 CNCCc1cc(ccc1F)F 34a_100102657272_100011755056 [0,2,0,0,0,0|1,0,0]=3 18840 B12R1.374 CNCCc1cc(ccc1F)F 7a_106832991635_100011755056 [0,2,0,0,0,0|1,0,0]=3 18841 B12R1.374 COCCc1cc(ccc1Br)Cl 34a_100012426913_200000210301 [0,2,0,0,0,0|1,0,0]=3 18842 B12R1.374 COCCc1cc(ccc1Br)Cl 7a_100012426913_200000210301 [0,2,0,0,0,0|1,0,0]=3 18843 B12R1.374 COCCc1cc(ccc1C)C 34a_100011694955_200000210301 [0,2,0,0,0,0|1,0,0]=3 18844 B12R1.374 COCCc1cc(ccc1C)C 7a_100011694955_200000210301 [0,2,0,0,0,0|1,0,0]=3 18845 B12R1.374 COCCc1cc(ccc1Cl)Cl 34a_100011754359_200000210301 [0,2,0,0,0,0|1,0,0]=3 18846 B12R1.374 COCCc1cc(ccc1Cl)Cl 7a_100011754359_200000210301 [0,2,0,0,0,0|1,0,0]=3 18847 B12R1.374 COCCc1cc(ccc1F)F 34a_100011755048_200000210301 [0,2,0,0,0,0|1,0,0]=3 18848 B12R1.374 COCCc1cc(ccc1F)F 34a_100138415774_100011755056 [0,2,0,0,0,0|1,0,0]=3 18849 B12R1.374 COCCc1cc(ccc1F)F 7a_100011755048_200000210301 [0,2,0,0,0,0|1,0,0]=3 18850 B12R1.374 COCNc1cc(ccc1C)C 2230a_100000185781_100000766300 [0,2,0,0,0,0|2,0,0]=4 18851 B12R1.374 COCOc1cc(ccc1O)C 271570a_203496583355_200023989289 [0,2,0,0,0,0|1,0,0]=3 18852 B12R1.374 COCOc1cc(ccc1O)F 271570a_203496583355_200012568746 [0,2,0,0,0,0|1,0,0]=3 18853 B12R1.374 COCSc1cc(ccc1Br)Br 62a_100000766300_100011483371 [0,2,0,0,0,0|2,0,0]=4 18854 B12R1.374 COCSc1cc(ccc1Br)Br 62a_100011483371_100000766300 [0,2,0,0,0,0|2,0,0]=4 18855 B12R1.374 COCSc1cc(ccc1Br)C 62a_100000766300_100012353751 [0,2,0,0,0,0|2,0,0]=4 18856 B12R1.374 COCSc1cc(ccc1Br)C 62a_100012353751_100000766300 [0,2,0,0,0,0|2,0,0]=4 18857 B12R1.374 COCSc1cc(ccc1Br)Cl 62a_100000766300_100012339723 [0,2,0,0,0,0|2,0,0]=4 18858 B12R1.374 COCSc1cc(ccc1Br)Cl 62a_100012339723_100000766300 [0,2,0,0,0,0|2,0,0]=4 18859 B12R1.374 COCSc1cc(ccc1Br)F 62a_100000766300_100011217576 [0,2,0,0,0,0|2,0,0]=4 18860 B12R1.374 COCSc1cc(ccc1Br)F 62a_100011217576_100000766300 [0,2,0,0,0,0|2,0,0]=4 18861 B12R1.374 COCSc1cc(ccc1Br)N 62a_100000750459_100000766300 [0,2,0,0,0,0|2,0,0]=4 18862 B12R1.374 COCSc1cc(ccc1Br)N 62a_100000766300_100000750459 [0,2,0,0,0,0|2,0,0]=4 18863 B12R1.374 COCSc1cc(ccc1Br)O 62a_100000766300_100012339312 [0,2,0,0,0,0|2,0,0]=4 18864 B12R1.374 COCSc1cc(ccc1Br)O 62a_100012339312_100000766300 [0,2,0,0,0,0|2,0,0]=4 18865 B12R1.374 COCSc1cc(ccc1C)Br 62a_100000766300_100011344865 [0,2,0,0,0,0|2,0,0]=4 18866 B12R1.374 COCSc1cc(ccc1C)Br 62a_100011344865_100000766300 [0,2,0,0,0,0|2,0,0]=4 18867 B12R1.374 COCSc1cc(ccc1C)C 62a_100000210833_100000766300 [0,2,0,0,0,0|2,0,0]=4 18868 B12R1.374 COCSc1cc(ccc1C)C 62a_100000766300_100000210833 [0,2,0,0,0,0|2,0,0]=4 18869 B12R1.374 COCSc1cc(ccc1C)Cl 62a_100000766300_100011263213 [0,2,0,0,0,0|2,0,0]=4 18870 B12R1.374 COCSc1cc(ccc1C)Cl 62a_100011263213_100000766300 [0,2,0,0,0,0|2,0,0]=4 18871 B12R1.374 COCSc1cc(ccc1C)F 62a_100000766300_100011218078 [0,2,0,0,0,0|2,0,0]=4 18872 B12R1.374 COCSc1cc(ccc1C)F 62a_100011218078_100000766300 [0,2,0,0,0,0|2,0,0]=4 18873 B12R1.374 COCSc1cc(ccc1C)N 62a_100000736455_100000766300 [0,2,0,0,0,0|2,0,0]=4 18874 B12R1.374 COCSc1cc(ccc1C)N 62a_100000766300_100000736455 [0,2,0,0,0,0|2,0,0]=4 18875 B12R1.374 COCSc1cc(ccc1C)O 62a_100000766300_100011380479 [0,2,0,0,0,0|2,0,0]=4 18876 B12R1.374 COCSc1cc(ccc1C)O 62a_100011380479_100000766300 [0,2,0,0,0,0|2,0,0]=4 18877 B12R1.374 COCSc1cc(ccc1Cl)Br 62a_100000766300_100011772130 [0,2,0,0,0,0|2,0,0]=4 18878 B12R1.374 COCSc1cc(ccc1Cl)Br 62a_100011772130_100000766300 [0,2,0,0,0,0|2,0,0]=4 18879 B12R1.374 COCSc1cc(ccc1Cl)C 62a_100000766300_100012356289 [0,2,0,0,0,0|2,0,0]=4 18880 B12R1.374 COCSc1cc(ccc1Cl)C 62a_100012356289_100000766300 [0,2,0,0,0,0|2,0,0]=4 18881 B12R1.374 COCSc1cc(ccc1Cl)Cl 62a_100000707729_100000766300 [0,2,0,0,0,0|2,0,0]=4 18882 B12R1.374 COCSc1cc(ccc1Cl)Cl 62a_100000766300_100000707729 [0,2,0,0,0,0|2,0,0]=4 18883 B12R1.374 COCSc1cc(ccc1Cl)F 62a_100000766300_100011217299 [0,2,0,0,0,0|2,0,0]=4 18884 B12R1.374 COCSc1cc(ccc1Cl)F 62a_100011217299_100000766300 [0,2,0,0,0,0|2,0,0]=4 18885 B12R1.374 COCSc1cc(ccc1Cl)N 62a_100000766300_100012360549 [0,2,0,0,0,0|2,0,0]=4 18886 B12R1.374 COCSc1cc(ccc1Cl)N 62a_100012360549_100000766300 [0,2,0,0,0,0|2,0,0]=4 18887 B12R1.374 COCSc1cc(ccc1Cl)O 62a_100000049588_100000766300 [0,2,0,0,0,0|2,0,0]=4 18888 B12R1.374 COCSc1cc(ccc1Cl)O 62a_100000766300_100000049588 [0,2,0,0,0,0|2,0,0]=4 18889 B12R1.374 COCSc1cc(ccc1F)Br 62a_100000766300_100011217312 [0,2,0,0,0,0|2,0,0]=4 18890 B12R1.374 COCSc1cc(ccc1F)Br 62a_100011217312_100000766300 [0,2,0,0,0,0|2,0,0]=4 18891 B12R1.374 COCSc1cc(ccc1F)C 62a_100000736223_100000766300 [0,2,0,0,0,0|2,0,0]=4 18892 B12R1.374 COCSc1cc(ccc1F)C 62a_100000766300_100000736223 [0,2,0,0,0,0|2,0,0]=4 18893 B12R1.374 COCSc1cc(ccc1F)Cl 62a_100000766300_100011218116 [0,2,0,0,0,0|2,0,0]=4 18894 B12R1.374 COCSc1cc(ccc1F)Cl 62a_100011218116_100000766300 [0,2,0,0,0,0|2,0,0]=4 18895 B12R1.374 COCSc1cc(ccc1F)F 62a_100000766300_100011219198 [0,2,0,0,0,0|2,0,0]=4 18896 B12R1.374 COCSc1cc(ccc1F)F 62a_100011219198_100000766300 [0,2,0,0,0,0|2,0,0]=4 18897 B12R1.374 COCSc1cc(ccc1F)N 62a_100000760356_100000766300 [0,2,0,0,0,0|2,0,0]=4 18898 B12R1.374 COCSc1cc(ccc1F)N 62a_100000766300_100000760356 [0,2,0,0,0,0|2,0,0]=4 18899 B12R1.374 COCSc1cc(ccc1F)O 62a_100000693481_100000766300 [0,2,0,0,0,0|2,0,0]=4 18900 B12R1.374 COCSc1cc(ccc1F)O 62a_100000766300_100000693481 [0,2,0,0,0,0|2,0,0]=4 18901 B12R1.374 COCSc1cc(ccc1N)Br 62a_100000187925_100000766300 [0,2,0,0,0,0|2,0,0]=4 18902 B12R1.374 COCSc1cc(ccc1N)Br 62a_100000766300_100000187925 [0,2,0,0,0,0|2,0,0]=4 18903 B12R1.374 COCSc1cc(ccc1N)C 62a_100000766300_100011356834 [0,2,0,0,0,0|2,0,0]=4 18904 B12R1.374 COCSc1cc(ccc1N)C 62a_100011356834_100000766300 [0,2,0,0,0,0|2,0,0]=4 18905 B12R1.374 COCSc1cc(ccc1N)Cl 62a_100000761889_100000766300 [0,2,0,0,0,0|2,0,0]=4 18906 B12R1.374 COCSc1cc(ccc1N)Cl 62a_100000766300_100000761889 [0,2,0,0,0,0|2,0,0]=4 18907 B12R1.374 COCSc1cc(ccc1N)F 62a_100000760547_100000766300 [0,2,0,0,0,0|2,0,0]=4 18908 B12R1.374 COCSc1cc(ccc1N)F 62a_100000766300_100000760547 [0,2,0,0,0,0|2,0,0]=4 18909 B12R1.374 COCSc1cc(ccc1N)N 62a_100000766300_100011534242 [0,2,0,0,0,0|2,0,0]=4 18910 B12R1.374 COCSc1cc(ccc1N)N 62a_100011534242_100000766300 [0,2,0,0,0,0|2,0,0]=4 18911 B12R1.374 COCSc1cc(ccc1N)O 62a_100000766300_100012001276 [0,2,0,0,0,0|2,0,0]=4 18912 B12R1.374 COCSc1cc(ccc1N)O 62a_100012001276_100000766300 [0,2,0,0,0,0|2,0,0]=4 18913 B12R1.374 COCSc1cc(ccc1O)Br 62a_100000766300_100012355227 [0,2,0,0,0,0|1,0,0]=3 18914 B12R1.374 COCSc1cc(ccc1O)Br 62a_100012355227_100000766300 [0,2,0,0,0,0|1,0,0]=3 18915 B12R1.374 COCSc1cc(ccc1O)C 62a_100000765521_100000766300 [0,2,0,0,0,0|1,0,0]=3 18916 B12R1.374 COCSc1cc(ccc1O)C 62a_100000766300_100000765521 [0,2,0,0,0,0|1,0,0]=3 18917 B12R1.374 COCSc1cc(ccc1O)Cl 62a_100000766300_100011356953 [0,2,0,0,0,0|1,0,0]=3 18918 B12R1.374 COCSc1cc(ccc1O)Cl 62a_100011356953_100000766300 [0,2,0,0,0,0|1,0,0]=3 18919 B12R1.374 COCSc1cc(ccc1O)F 62a_100000211999_100000766300 [0,2,0,0,0,0|1,0,0]=3 18920 B12R1.374 COCSc1cc(ccc1O)F 62a_100000766300_100000211999 [0,2,0,0,0,0|1,0,0]=3 18921 B12R1.374 COCSc1cc(ccc1O)N 62a_100000766300_100011534360 [0,2,0,0,0,0|1,0,0]=3 18922 B12R1.374 COCSc1cc(ccc1O)N 62a_100011534360_100000766300 [0,2,0,0,0,0|1,0,0]=3 18923 B12R1.374 COCSc1cc(ccc1O)O 62a_100000766300_100009813629 [0,2,0,0,0,0|1,0,0]=3 18924 B12R1.374 COCSc1cc(cnc1O)Br 62a_100000766300_100010197142 [0,2,0,0,0,0|2,0,0]=4 18925 B12R1.374 COCSc1cc(cnc1O)Br 62a_100010197142_100000766300 [0,2,0,0,0,0|2,0,0]=4 18926 B12R1.374 COCSc1cc(cnc1O)C 62a_100000719714_100000766300 [0,2,0,0,0,0|2,0,0]=4 18927 B12R1.374 COCSc1cc(cnc1O)C 62a_100000766300_100000719714 [0,2,0,0,0,0|2,0,0]=4 18928 B12R1.374 COCSc1cc(cnc1O)Cl 62a_100000766300_100010188700 [0,2,0,0,0,0|2,0,0]=4 18929 B12R1.374 COCSc1cc(cnc1O)Cl 62a_100010188700_100000766300 [0,2,0,0,0,0|2,0,0]=4 18930 B12R1.374 COCSc1cc(ncc1O)C 62a_100000766300_100009843476 [0,2,0,0,0,0|2,0,0]=4 18931 B12R1.374 COCSc1cc(ncc1O)C 62a_100009843476_100000766300 [0,2,0,0,0,0|2,0,0]=4 18932 B12R1.374 COCSc1cc(ncc1O)Cl 62a_100000698892_100000766300 [0,2,0,0,0,0|2,0,0]=4 18933 B12R1.374 COCSc1cc(ncc1O)Cl 62a_100000766300_100000698892 [0,2,0,0,0,0|2,0,0]=4 18934 B12R1.374 COCSc1nc(ccc1O)Br 62a_100000766300_100010253912 [0,2,0,0,0,0|2,0,0]=4 18935 B12R1.374 COCSc1nc(ccc1O)Br 62a_100010253912_100000766300 [0,2,0,0,0,0|2,0,0]=4 18936 B12R1.374 COCSc1nc(ccc1O)C 62a_100000702858_100000766300 [0,2,0,0,0,0|2,0,0]=4 18937 B12R1.374 COCSc1nc(ccc1O)C 62a_100000766300_100000702858 [0,2,0,0,0,0|2,0,0]=4 18938 B12R1.374 COCSc1nc(ccc1O)Cl 62a_100000766300_100000696390 [0,2,0,0,0,0|2,0,0]=4 18939 B12R1.374 COCSc1nc(ccc1O)F 62a_100000766300_100010382442 [0,2,0,0,0,0|2,0,0]=4 18940 B12R1.374 COCSc1nc(ccc1O)F 62a_100010382442_100000766300 [0,2,0,0,0,0|2,0,0]=4 18941 B12R1.374 CSCCc1cc(ccc1F)F 62a_100011755056_200000210301 [0,2,0,0,0,0|1,0,0]=3 18942 B12R1.374 CSCCc1cc(ccc1F)F 62a_200000210301_100011755056 [0,2,0,0,0,0|1,0,0]=3 18943 B12R1.374 CSCNc1cc(ccc1Br)Br 34a_100000737762_100011218213 [0,2,0,0,0,0|2,0,0]=4 18944 B12R1.374 CSCNc1cc(ccc1Br)C 34a_100000745044_100011218213 [0,2,0,0,0,0|2,0,0]=4 18945 B12R1.374 CSCNc1cc(ccc1Br)Cl 34a_100000687073_100011218213 [0,2,0,0,0,0|2,0,0]=4 18946 B12R1.374 CSCNc1cc(ccc1Br)F 34a_100000687223_100011218213 [0,2,0,0,0,0|2,0,0]=4 18947 B12R1.374 CSCNc1cc(ccc1Br)O 34a_100011999798_100011218213 [0,2,0,0,0,0|2,0,0]=4 18948 B12R1.374 CSCNc1cc(ccc1C)Br 34a_100000741167_100011218213 [0,2,0,0,0,0|2,0,0]=4 18949 B12R1.374 CSCNc1cc(ccc1C)C 2230a_100000185781_100011218213 [0,2,0,0,0,0|2,0,0]=4 18950 B12R1.374 CSCNc1cc(ccc1C)C 34a_100000185781_100011218213 [0,2,0,0,0,0|2,0,0]=4 18951 B12R1.374 CSCNc1cc(ccc1C)Cl 34a_100000211374_100011218213 [0,2,0,0,0,0|2,0,0]=4 18952 B12R1.374 CSCNc1cc(ccc1C)F 34a_100000211107_100011218213 [0,2,0,0,0,0|2,0,0]=4 18953 B12R1.374 CSCNc1cc(ccc1C)O 34a_100011216113_100011218213 [0,2,0,0,0,0|2,0,0]=4 18954 B12R1.374 CSCNc1cc(ccc1Cl)Br 34a_100000750497_100011218213 [0,2,0,0,0,0|2,0,0]=4 18955 B12R1.374 CSCNc1cc(ccc1Cl)C 34a_100011215360_100011218213 [0,2,0,0,0,0|2,0,0]=4 18956 B12R1.374 CSCNc1cc(ccc1Cl)Cl 34a_100000184485_100011218213 [0,2,0,0,0,0|2,0,0]=4 18957 B12R1.374 CSCNc1cc(ccc1Cl)F 34a_100000751338_100011218213 [0,2,0,0,0,0|2,0,0]=4 18958 B12R1.374 CSCNc1cc(ccc1Cl)I 34a_200000761891_100011218213 [0,2,0,0,0,0|2,0,0]=4 18959 B12R1.374 CSCNc1cc(ccc1Cl)O 34a_100011934297_100011218213 [0,2,0,0,0,0|2,0,0]=4 18960 B12R1.374 CSCNc1cc(ccc1F)Br 34a_100000740924_100011218213 [0,2,0,0,0,0|2,0,0]=4 18961 B12R1.374 CSCNc1cc(ccc1F)C 34a_100000211285_100011218213 [0,2,0,0,0,0|2,0,0]=4 18962 B12R1.374 CSCNc1cc(ccc1F)Cl 34a_100000212115_100011218213 [0,2,0,0,0,0|2,0,0]=4 18963 B12R1.374 CSCNc1cc(ccc1F)F 34a_100000210742_100011218213 [0,2,0,0,0,0|2,0,0]=4 18964 B12R1.374 CSCNc1cc(ccc1F)I 34a_100011464823_100011218213 [0,2,0,0,0,0|2,0,0]=4 18965 B12R1.374 CSCNc1cc(ccc1F)O 34a_100012017239_100011218213 [0,2,0,0,0,0|2,0,0]=4 18966 B12R1.374 CSCNc1cc(ccc1I)Br 34a_100000743836_100011218213 [0,2,0,0,0,0|2,0,0]=4 18967 B12R1.374 CSCNc1cc(ccc1I)C 34a_100011216686_100011218213 [0,2,0,0,0,0|2,0,0]=4 18968 B12R1.374 CSCNc1cc(ccc1I)Cl 34a_100000761886_100011218213 [0,2,0,0,0,0|2,0,0]=4 18969 B12R1.374 CSCNc1cc(ccc1I)F 34a_100011218093_100011218213 [0,2,0,0,0,0|2,0,0]=4 18970 B12R1.374 CSCNc1cc(ccc1O)Br 34a_100000752626_100011218213 [0,2,0,0,0,0|1,0,0]=3 18971 B12R1.374 CSCNc1cc(ccc1O)C 34a_100011215204_100011218213 [0,2,0,0,0,0|1,0,0]=3 18972 B12R1.374 CSCNc1cc(ccc1O)Cl 34a_100000210500_100011218213 [0,2,0,0,0,0|1,0,0]=3 18973 B12R1.374 CSCNc1cc(ccc1O)F 34a_100000759472_100011218213 [0,2,0,0,0,0|1,0,0]=3 18974 B12R1.374 CSCOc1cc(ccc1Br)Br 34a_100011220040_100011218213 [0,2,0,0,0,0|2,0,0]=4 18975 B12R1.374 CSCOc1cc(ccc1Br)C 34a_100012002257_100011218213 [0,2,0,0,0,0|2,0,0]=4 18976 B12R1.374 CSCOc1cc(ccc1Br)Cl 34a_100012339455_100011218213 [0,2,0,0,0,0|2,0,0]=4 18977 B12R1.374 CSCOc1cc(ccc1Br)F 34a_100000690578_100011218213 [0,2,0,0,0,0|2,0,0]=4 18978 B12R1.374 CSCOc1cc(ccc1Br)I 34a_100012356990_100011218213 [0,2,0,0,0,0|2,0,0]=4 18979 B12R1.374 CSCOc1cc(ccc1C)Br 34a_100000685420_100011218213 [0,2,0,0,0,0|2,0,0]=4 18980 B12R1.374 CSCOc1cc(ccc1C)C 34a_100000210931_100011218213 [0,2,0,0,0,0|2,0,0]=4 18981 B12R1.374 CSCOc1cc(ccc1C)Cl 34a_100000756515_100011218213 [0,2,0,0,0,0|2,0,0]=4 18982 B12R1.374 CSCOc1cc(ccc1C)F 34a_100000690566_100011218213 [0,2,0,0,0,0|2,0,0]=4 18983 B12R1.374 CSCOc1cc(ccc1C)N 34a_100000759471_100011218213 [0,2,0,0,0,0|2,0,0]=4 18984 B12R1.374 CSCOc1cc(ccc1Cl)Br 34a_100000738945_100011218213 [0,2,0,0,0,0|2,0,0]=4 18985 B12R1.374 CSCOc1cc(ccc1Cl)C 34a_100000211493_100011218213 [0,2,0,0,0,0|2,0,0]=4 18986 B12R1.374 CSCOc1cc(ccc1Cl)Cl 34a_100000211422_100011218213 [0,2,0,0,0,0|2,0,0]=4 18987 B12R1.374 CSCOc1cc(ccc1Cl)F 34a_100000692107_100011218213 [0,2,0,0,0,0|2,0,0]=4 18988 B12R1.374 CSCOc1cc(ccc1Cl)I 34a_100011356854_100011218213 [0,2,0,0,0,0|2,0,0]=4 18989 B12R1.374 CSCOc1cc(ccc1Cl)N 34a_100011934209_100011218213 [0,2,0,0,0,0|2,0,0]=4 18990 B12R1.374 CSCOc1cc(ccc1F)Br 34a_100000686035_100011218213 [0,2,0,0,0,0|2,0,0]=4 18991 B12R1.374 CSCOc1cc(ccc1F)C 34a_100000759540_100011218213 [0,2,0,0,0,0|2,0,0]=4 18992 B12R1.374 CSCOc1cc(ccc1F)Cl 34a_100000757397_100011218213 [0,2,0,0,0,0|2,0,0]=4 18993 B12R1.374 CSCOc1cc(ccc1F)F 34a_100000752141_100011218213 [0,2,0,0,0,0|2,0,0]=4 18994 B12R1.374 CSCOc1cc(ccc1F)I 34a_100009958187_100011218213 [0,2,0,0,0,0|2,0,0]=4 18995 B12R1.374 CSCOc1cc(ccc1F)N 34a_100012017398_100011218213 [0,2,0,0,0,0|2,0,0]=4 18996 B12R1.374 CSCOc1cc(ccc1I)Br 34a_100012344904_100011218213 [0,2,0,0,0,0|2,0,0]=4 18997 B12R1.374 CSCOc1cc(ccc1I)Cl 34a_100000050036_100011218213 [0,2,0,0,0,0|2,0,0]=4 18998 B12R1.374 CSCOc1cc(ccc1I)F 34a_100010084537_100011218213 [0,2,0,0,0,0|2,0,0]=4 18999 B12R1.374 CSCOc1cc(ccc1N)Br 34a_100000739049_100011218213 [0,2,0,0,0,0|2,0,0]=4 19000 B12R1.374 CSCOc1cc(ccc1N)C 34a_100000211527_100011218213 [0,2,0,0,0,0|2,0,0]=4 19001 B12R1.374 CSCOc1cc(ccc1N)Cl 34a_100000185728_100011218213 [0,2,0,0,0,0|2,0,0]=4 19002 B12R1.374 CSCOc1cc(ccc1N)F 34a_100000753323_100011218213 [0,2,0,0,0,0|2,0,0]=4 19003 B12R1.374 CSCOc1cc(ccc1N)I 34a_100000057187_100011218213 [0,2,0,0,0,0|2,0,0]=4 19004 B12R1.374 CSCOc1cc(ccc1N)N 34a_100025717382_100011218213 [0,2,0,0,0,0|2,0,0]=4 19005 B12R1.374 CSCSc1cc(ccc1Br)Br 62a_100011218213_100011483371 [0,2,0,0,0,0|2,0,0]=4 19006 B12R1.374 CSCSc1cc(ccc1Br)Br 62a_100011483371_100011218213 [0,2,0,0,0,0|2,0,0]=4 19007 B12R1.374 CSCSc1cc(ccc1Br)C 62a_100011218213_100012353751 [0,2,0,0,0,0|2,0,0]=4 19008 B12R1.374 CSCSc1cc(ccc1Br)C 62a_100012353751_100011218213 [0,2,0,0,0,0|2,0,0]=4 19009 B12R1.374 CSCSc1cc(ccc1Br)Cl 62a_100011218213_100012339723 [0,2,0,0,0,0|2,0,0]=4 19010 B12R1.374 CSCSc1cc(ccc1Br)Cl 62a_100012339723_100011218213 [0,2,0,0,0,0|2,0,0]=4 19011 B12R1.374 CSCSc1cc(ccc1Br)F 62a_100011217576_100011218213 [0,2,0,0,0,0|2,0,0]=4 19012 B12R1.374 CSCSc1cc(ccc1Br)F 62a_100011218213_100011217576 [0,2,0,0,0,0|2,0,0]=4 19013 B12R1.374 CSCSc1cc(ccc1Br)N 62a_100000750459_100011218213 [0,2,0,0,0,0|2,0,0]=4 19014 B12R1.374 CSCSc1cc(ccc1Br)N 62a_100011218213_100000750459 [0,2,0,0,0,0|2,0,0]=4 19015 B12R1.374 CSCSc1cc(ccc1Br)O 62a_100011218213_100012339312 [0,2,0,0,0,0|2,0,0]=4 19016 B12R1.374 CSCSc1cc(ccc1Br)O 62a_100012339312_100011218213 [0,2,0,0,0,0|2,0,0]=4 19017 B12R1.374 CSCSc1cc(ccc1C)Br 62a_100011218213_100011344865 [0,2,0,0,0,0|2,0,0]=4 19018 B12R1.374 CSCSc1cc(ccc1C)Br 62a_100011344865_100011218213 [0,2,0,0,0,0|2,0,0]=4 19019 B12R1.374 CSCSc1cc(ccc1C)C 62a_100000210833_100011218213 [0,2,0,0,0,0|2,0,0]=4 19020 B12R1.374 CSCSc1cc(ccc1C)C 62a_100011218213_100000210833 [0,2,0,0,0,0|2,0,0]=4 19021 B12R1.374 CSCSc1cc(ccc1C)Cl 62a_100011218213_100011263213 [0,2,0,0,0,0|2,0,0]=4 19022 B12R1.374 CSCSc1cc(ccc1C)Cl 62a_100011263213_100011218213 [0,2,0,0,0,0|2,0,0]=4 19023 B12R1.374 CSCSc1cc(ccc1C)F 62a_100011218078_100011218213 [0,2,0,0,0,0|2,0,0]=4 19024 B12R1.374 CSCSc1cc(ccc1C)F 62a_100011218213_100011218078 [0,2,0,0,0,0|2,0,0]=4 19025 B12R1.374 CSCSc1cc(ccc1C)N 62a_100000736455_100011218213 [0,2,0,0,0,0|2,0,0]=4 19026 B12R1.374 CSCSc1cc(ccc1C)N 62a_100011218213_100000736455 [0,2,0,0,0,0|2,0,0]=4 19027 B12R1.374 CSCSc1cc(ccc1C)O 62a_100011218213_100011380479 [0,2,0,0,0,0|2,0,0]=4 19028 B12R1.374 CSCSc1cc(ccc1C)O 62a_100011380479_100011218213 [0,2,0,0,0,0|2,0,0]=4 19029 B12R1.374 CSCSc1cc(ccc1Cl)Br 62a_100011218213_100011772130 [0,2,0,0,0,0|2,0,0]=4 19030 B12R1.374 CSCSc1cc(ccc1Cl)Br 62a_100011772130_100011218213 [0,2,0,0,0,0|2,0,0]=4 19031 B12R1.374 CSCSc1cc(ccc1Cl)C 62a_100011218213_100012356289 [0,2,0,0,0,0|2,0,0]=4 19032 B12R1.374 CSCSc1cc(ccc1Cl)C 62a_100012356289_100011218213 [0,2,0,0,0,0|2,0,0]=4 19033 B12R1.374 CSCSc1cc(ccc1Cl)Cl 62a_100000707729_100011218213 [0,2,0,0,0,0|2,0,0]=4 19034 B12R1.374 CSCSc1cc(ccc1Cl)Cl 62a_100011218213_100000707729 [0,2,0,0,0,0|2,0,0]=4 19035 B12R1.374 CSCSc1cc(ccc1Cl)F 62a_100011217299_100011218213 [0,2,0,0,0,0|2,0,0]=4 19036 B12R1.374 CSCSc1cc(ccc1Cl)F 62a_100011218213_100011217299 [0,2,0,0,0,0|2,0,0]=4 19037 B12R1.374 CSCSc1cc(ccc1Cl)N 62a_100011218213_100012360549 [0,2,0,0,0,0|2,0,0]=4 19038 B12R1.374 CSCSc1cc(ccc1Cl)N 62a_100012360549_100011218213 [0,2,0,0,0,0|2,0,0]=4 19039 B12R1.374 CSCSc1cc(ccc1Cl)O 62a_100000049588_100011218213 [0,2,0,0,0,0|2,0,0]=4 19040 B12R1.374 CSCSc1cc(ccc1Cl)O 62a_100011218213_100000049588 [0,2,0,0,0,0|2,0,0]=4 19041 B12R1.374 CSCSc1cc(ccc1F)Br 62a_100011217312_100011218213 [0,2,0,0,0,0|2,0,0]=4 19042 B12R1.374 CSCSc1cc(ccc1F)Br 62a_100011218213_100011217312 [0,2,0,0,0,0|2,0,0]=4 19043 B12R1.374 CSCSc1cc(ccc1F)C 62a_100000736223_100011218213 [0,2,0,0,0,0|2,0,0]=4 19044 B12R1.374 CSCSc1cc(ccc1F)C 62a_100011218213_100000736223 [0,2,0,0,0,0|2,0,0]=4 19045 B12R1.374 CSCSc1cc(ccc1F)Cl 62a_100011218116_100011218213 [0,2,0,0,0,0|2,0,0]=4 19046 B12R1.374 CSCSc1cc(ccc1F)Cl 62a_100011218213_100011218116 [0,2,0,0,0,0|2,0,0]=4 19047 B12R1.374 CSCSc1cc(ccc1F)F 62a_100011218213_100011219198 [0,2,0,0,0,0|2,0,0]=4 19048 B12R1.374 CSCSc1cc(ccc1F)F 62a_100011219198_100011218213 [0,2,0,0,0,0|2,0,0]=4 19049 B12R1.374 CSCSc1cc(ccc1F)N 62a_100000760356_100011218213 [0,2,0,0,0,0|2,0,0]=4 19050 B12R1.374 CSCSc1cc(ccc1F)N 62a_100011218213_100000760356 [0,2,0,0,0,0|2,0,0]=4 19051 B12R1.374 CSCSc1cc(ccc1F)O 62a_100000693481_100011218213 [0,2,0,0,0,0|2,0,0]=4 19052 B12R1.374 CSCSc1cc(ccc1F)O 62a_100011218213_100000693481 [0,2,0,0,0,0|2,0,0]=4 19053 B12R1.374 CSCSc1cc(ccc1N)Br 62a_100000187925_100011218213 [0,2,0,0,0,0|2,0,0]=4 19054 B12R1.374 CSCSc1cc(ccc1N)Br 62a_100011218213_100000187925 [0,2,0,0,0,0|2,0,0]=4 19055 B12R1.374 CSCSc1cc(ccc1N)C 62a_100011218213_100011356834 [0,2,0,0,0,0|2,0,0]=4 19056 B12R1.374 CSCSc1cc(ccc1N)C 62a_100011356834_100011218213 [0,2,0,0,0,0|2,0,0]=4 19057 B12R1.374 CSCSc1cc(ccc1N)Cl 62a_100000761889_100011218213 [0,2,0,0,0,0|2,0,0]=4 19058 B12R1.374 CSCSc1cc(ccc1N)Cl 62a_100011218213_100000761889 [0,2,0,0,0,0|2,0,0]=4 19059 B12R1.374 CSCSc1cc(ccc1N)F 62a_100000760547_100011218213 [0,2,0,0,0,0|2,0,0]=4 19060 B12R1.374 CSCSc1cc(ccc1N)F 62a_100011218213_100000760547 [0,2,0,0,0,0|2,0,0]=4 19061 B12R1.374 CSCSc1cc(ccc1N)N 62a_100011218213_100011534242 [0,2,0,0,0,0|2,0,0]=4 19062 B12R1.374 CSCSc1cc(ccc1N)N 62a_100011534242_100011218213 [0,2,0,0,0,0|2,0,0]=4 19063 B12R1.374 CSCSc1cc(ccc1N)O 62a_100011218213_100012001276 [0,2,0,0,0,0|2,0,0]=4 19064 B12R1.374 CSCSc1cc(ccc1N)O 62a_100012001276_100011218213 [0,2,0,0,0,0|2,0,0]=4 19065 B12R1.374 CSCSc1cc(ccc1O)Br 62a_100011218213_100012355227 [0,2,0,0,0,0|1,0,0]=3 19066 B12R1.374 CSCSc1cc(ccc1O)Br 62a_100012355227_100011218213 [0,2,0,0,0,0|1,0,0]=3 19067 B12R1.374 CSCSc1cc(ccc1O)C 62a_100000765521_100011218213 [0,2,0,0,0,0|1,0,0]=3 19068 B12R1.374 CSCSc1cc(ccc1O)C 62a_100011218213_100000765521 [0,2,0,0,0,0|1,0,0]=3 19069 B12R1.374 CSCSc1cc(ccc1O)Cl 62a_100011218213_100011356953 [0,2,0,0,0,0|1,0,0]=3 19070 B12R1.374 CSCSc1cc(ccc1O)Cl 62a_100011356953_100011218213 [0,2,0,0,0,0|1,0,0]=3 19071 B12R1.374 CSCSc1cc(ccc1O)F 62a_100000211999_100011218213 [0,2,0,0,0,0|1,0,0]=3 19072 B12R1.374 CSCSc1cc(ccc1O)F 62a_100011218213_100000211999 [0,2,0,0,0,0|1,0,0]=3 19073 B12R1.374 CSCSc1cc(ccc1O)N 62a_100011218213_100011534360 [0,2,0,0,0,0|1,0,0]=3 19074 B12R1.374 CSCSc1cc(ccc1O)N 62a_100011534360_100011218213 [0,2,0,0,0,0|1,0,0]=3 19075 B12R1.374 CSCSc1cc(ccc1O)O 62a_100011218213_100009813629 [0,2,0,0,0,0|1,0,0]=3 19076 B12R1.374 CSCSc1cc(cnc1O)Br 62a_100010197142_100011218213 [0,2,0,0,0,0|2,0,0]=4 19077 B12R1.374 CSCSc1cc(cnc1O)Br 62a_100011218213_100010197142 [0,2,0,0,0,0|2,0,0]=4 19078 B12R1.374 CSCSc1cc(cnc1O)C 62a_100000719714_100011218213 [0,2,0,0,0,0|2,0,0]=4 19079 B12R1.374 CSCSc1cc(cnc1O)C 62a_100011218213_100000719714 [0,2,0,0,0,0|2,0,0]=4 19080 B12R1.374 CSCSc1cc(cnc1O)Cl 62a_100010188700_100011218213 [0,2,0,0,0,0|2,0,0]=4 19081 B12R1.374 CSCSc1cc(cnc1O)Cl 62a_100011218213_100010188700 [0,2,0,0,0,0|2,0,0]=4 19082 B12R1.374 CSCSc1cc(ncc1O)C 62a_100009843476_100011218213 [0,2,0,0,0,0|2,0,0]=4 19083 B12R1.374 CSCSc1cc(ncc1O)C 62a_100011218213_100009843476 [0,2,0,0,0,0|2,0,0]=4 19084 B12R1.374 CSCSc1cc(ncc1O)Cl 62a_100000698892_100011218213 [0,2,0,0,0,0|2,0,0]=4 19085 B12R1.374 CSCSc1cc(ncc1O)Cl 62a_100011218213_100000698892 [0,2,0,0,0,0|2,0,0]=4 19086 B12R1.374 CSCSc1nc(ccc1O)Br 62a_100010253912_100011218213 [0,2,0,0,0,0|2,0,0]=4 19087 B12R1.374 CSCSc1nc(ccc1O)Br 62a_100011218213_100010253912 [0,2,0,0,0,0|2,0,0]=4 19088 B12R1.374 CSCSc1nc(ccc1O)C 62a_100000702858_100011218213 [0,2,0,0,0,0|2,0,0]=4 19089 B12R1.374 CSCSc1nc(ccc1O)C 62a_100011218213_100000702858 [0,2,0,0,0,0|2,0,0]=4 19090 B12R1.374 CSCSc1nc(ccc1O)Cl 62a_100011218213_100000696390 [0,2,0,0,0,0|2,0,0]=4 19091 B12R1.374 CSCSc1nc(ccc1O)F 62a_100010382442_100011218213 [0,2,0,0,0,0|2,0,0]=4 19092 B12R1.374 CSCSc1nc(ccc1O)F 62a_100011218213_100010382442 [0,2,0,0,0,0|2,0,0]=4 19093 B12R1.374 Cc1cc(c(cn1)O)SCCF 62a_100009843476_100011217306 [0,2,0,0,0,0|2,0,0]=4 19094 B12R1.374 Cc1cc(c(cn1)O)SCCF 62a_100011217306_100009843476 [0,2,0,0,0,0|2,0,0]=4 19095 B12R1.374 Cc1cc(c(cn1)O)SCCO 62a_100000211926_100009843476 [0,2,0,0,0,0|2,0,0]=4 19096 B12R1.374 Cc1cc(c(cn1)O)SCCO 62a_100009843476_100000211926 [0,2,0,0,0,0|2,0,0]=4 19097 B12R1.374 Cc1ccc(c(c1)CCN[13CH3])C 2230a_200011485678_200025704644 [0,2,0,0,0,0|1,0,0]=3 19098 B12R1.374 Cc1ccc(c(c1)CCN[13CH3])C 34a_200011485678_200025704644 [0,2,0,0,0,0|1,0,0]=3 19099 B12R1.374 Cc1ccc(c(c1)CCO[13CH3])C 34a_100011694955_200025704644 [0,2,0,0,0,0|1,0,0]=3 19100 B12R1.374 Cc1ccc(c(c1)CCO[13CH3])C 7a_100011694955_200025704644 [0,2,0,0,0,0|1,0,0]=3 19101 B12R1.374 Cc1ccc(c(c1)CNCF)C 34a_100000174964_100015361967 [0,2,0,0,0,0|2,0,0]=4 19102 B12R1.374 Cc1ccc(c(c1)CNCF)Cl 34a_100025705715_100015361967 [0,2,0,0,0,0|2,0,0]=4 19103 B12R1.374 Cc1ccc(c(c1)CNCF)F 34a_100102693586_100015361967 [0,2,0,0,0,0|2,0,0]=4 19104 B12R1.374 Cc1ccc(c(c1)COCF)Br 34a_100012361352_100015361967 [0,2,0,0,0,0|2,0,0]=4 19105 B12R1.374 Cc1ccc(c(c1)COCF)Br 7a_100012361352_100015361967 [0,2,0,0,0,0|2,0,0]=4 19106 B12R1.374 Cc1ccc(c(c1)COCF)C 34a_200011215349_100015361967 [0,2,0,0,0,0|2,0,0]=4 19107 B12R1.374 Cc1ccc(c(c1)COCF)C 7a_200011215349_100015361967 [0,2,0,0,0,0|2,0,0]=4 19108 B12R1.374 Cc1ccc(c(c1)COCF)Cl 34a_100009878994_100015361967 [0,2,0,0,0,0|2,0,0]=4 19109 B12R1.374 Cc1ccc(c(c1)COCF)Cl 7a_100009878994_100015361967 [0,2,0,0,0,0|2,0,0]=4 19110 B12R1.374 Cc1ccc(c(c1)COCF)F 34a_100011692775_100015361967 [0,2,0,0,0,0|2,0,0]=4 19111 B12R1.374 Cc1ccc(c(c1)COCF)F 7a_100011692775_100015361967 [0,2,0,0,0,0|2,0,0]=4 19112 B12R1.374 Cc1ccc(c(c1)COCF)N 34a_100011215565_100015361967 [0,2,0,0,0,0|2,0,0]=4 19113 B12R1.374 Cc1ccc(c(c1)COCF)N 7a_100011215565_100015361967 [0,2,0,0,0,0|2,0,0]=4 19114 B12R1.374 Cc1ccc(c(c1)CSCF)C 62a_100000184699_100015361967 [0,2,0,0,0,0|2,0,0]=4 19115 B12R1.374 Cc1ccc(c(c1)CSCF)C 62a_100015361967_100000184699 [0,2,0,0,0,0|2,0,0]=4 19116 B12R1.374 Cc1ccc(c(c1)CSCF)Cl 62a_100009871730_100015361967 [0,2,0,0,0,0|2,0,0]=4 19117 B12R1.374 Cc1ccc(c(c1)CSCF)Cl 62a_100015361967_100009871730 [0,2,0,0,0,0|2,0,0]=4 19118 B12R1.374 Cc1ccc(c(c1)CSCF)F 62a_100011260760_100015361967 [0,2,0,0,0,0|2,0,0]=4 19119 B12R1.374 Cc1ccc(c(c1)CSCF)F 62a_100015361967_100011260760 [0,2,0,0,0,0|2,0,0]=4 19120 B12R1.374 Cc1ccc(c(c1)NCC=O)O 34a_100011215204_200009817547 [0,2,0,0,0,0|1,0,1]=4 19121 B12R1.374 Cc1ccc(c(c1)NCCF)Br 34a_100000745044_100011217306 [0,2,0,0,0,0|2,0,0]=4 19122 B12R1.374 Cc1ccc(c(c1)NCCF)C 2230a_100000185781_100011217306 [0,2,0,0,0,0|2,0,0]=4 19123 B12R1.374 Cc1ccc(c(c1)NCCF)C 34a_100000185781_100011217306 [0,2,0,0,0,0|2,0,0]=4 19124 B12R1.374 Cc1ccc(c(c1)NCCF)C 7a_100000185781_100011217306 [0,2,0,0,0,0|2,0,0]=4 19125 B12R1.374 Cc1ccc(c(c1)NCCF)Cl 34a_100011215360_100011217306 [0,2,0,0,0,0|2,0,0]=4 19126 B12R1.374 Cc1ccc(c(c1)NCCF)F 34a_100000211285_100011217306 [0,2,0,0,0,0|2,0,0]=4 19127 B12R1.374 Cc1ccc(c(c1)NCCF)I 34a_100011216686_100011217306 [0,2,0,0,0,0|2,0,0]=4 19128 B12R1.374 Cc1ccc(c(c1)NCCF)O 34a_100011215204_100011217306 [0,2,0,0,0,0|1,0,0]=3 19129 B12R1.374 Cc1ccc(c(c1)NCCO)Br 34a_100000745044_100000211926 [0,2,0,0,0,0|2,0,0]=4 19130 B12R1.374 Cc1ccc(c(c1)NCCO)C 2230a_100000185781_100000211926 [0,2,0,0,0,0|2,0,0]=4 19131 B12R1.374 Cc1ccc(c(c1)NCCO)C 34a_100000185781_100000211926 [0,2,0,0,0,0|2,0,0]=4 19132 B12R1.374 Cc1ccc(c(c1)NCCO)C 7a_100000185781_100000211926 [0,2,0,0,0,0|2,0,0]=4 19133 B12R1.374 Cc1ccc(c(c1)NCCO)Cl 34a_100011215360_100000211926 [0,2,0,0,0,0|2,0,0]=4 19134 B12R1.374 Cc1ccc(c(c1)NCCO)F 34a_100000211285_100000211926 [0,2,0,0,0,0|2,0,0]=4 19135 B12R1.374 Cc1ccc(c(c1)NCCO)I 34a_100011216686_100000211926 [0,2,0,0,0,0|2,0,0]=4 19136 B12R1.374 Cc1ccc(c(c1)NCCO)O 34a_100011215204_100000211926 [0,2,0,0,0,0|1,0,0]=3 19137 B12R1.374 Cc1ccc(c(c1)OCCF)Br 34a_100012002257_100011217306 [0,2,0,0,0,0|2,0,0]=4 19138 B12R1.374 Cc1ccc(c(c1)OCCF)Br 7a_100012002257_100011217306 [0,2,0,0,0,0|2,0,0]=4 19139 B12R1.374 Cc1ccc(c(c1)OCCF)C 34a_100000210931_100011217306 [0,2,0,0,0,0|2,0,0]=4 19140 B12R1.374 Cc1ccc(c(c1)OCCF)C 7a_100000210931_100011217306 [0,2,0,0,0,0|2,0,0]=4 19141 B12R1.374 Cc1ccc(c(c1)OCCF)Cl 34a_100000211493_100011217306 [0,2,0,0,0,0|2,0,0]=4 19142 B12R1.374 Cc1ccc(c(c1)OCCF)Cl 7a_100000211493_100011217306 [0,2,0,0,0,0|2,0,0]=4 19143 B12R1.374 Cc1ccc(c(c1)OCCF)F 34a_100000759540_100011217306 [0,2,0,0,0,0|2,0,0]=4 19144 B12R1.374 Cc1ccc(c(c1)OCCF)F 7a_100000759540_100011217306 [0,2,0,0,0,0|2,0,0]=4 19145 B12R1.374 Cc1ccc(c(c1)OCCF)N 34a_100000211527_100011217306 [0,2,0,0,0,0|2,0,0]=4 19146 B12R1.374 Cc1ccc(c(c1)OCCF)N 7a_100000211527_100011217306 [0,2,0,0,0,0|2,0,0]=4 19147 B12R1.374 Cc1ccc(c(c1)OCCO)Br 34a_100012002257_100000211926 [0,2,0,0,0,0|2,0,0]=4 19148 B12R1.374 Cc1ccc(c(c1)OCCO)Br 7a_100012002257_100000211926 [0,2,0,0,0,0|2,0,0]=4 19149 B12R1.374 Cc1ccc(c(c1)OCCO)C 34a_100000210931_100000211926 [0,2,0,0,0,0|2,0,0]=4 19150 B12R1.374 Cc1ccc(c(c1)OCCO)C 7a_100000210931_100000211926 [0,2,0,0,0,0|2,0,0]=4 19151 B12R1.374 Cc1ccc(c(c1)OCCO)Cl 34a_100000211493_100000211926 [0,2,0,0,0,0|2,0,0]=4 19152 B12R1.374 Cc1ccc(c(c1)OCCO)Cl 7a_100000211493_100000211926 [0,2,0,0,0,0|2,0,0]=4 19153 B12R1.374 Cc1ccc(c(c1)OCCO)F 34a_100000759540_100000211926 [0,2,0,0,0,0|2,0,0]=4 19154 B12R1.374 Cc1ccc(c(c1)OCCO)F 7a_100000759540_100000211926 [0,2,0,0,0,0|2,0,0]=4 19155 B12R1.374 Cc1ccc(c(c1)OCCO)N 34a_100000211527_100000211926 [0,2,0,0,0,0|2,0,0]=4 19156 B12R1.374 Cc1ccc(c(c1)OCCO)N 7a_100000211527_100000211926 [0,2,0,0,0,0|2,0,0]=4 19157 B12R1.374 Cc1ccc(c(c1)SCC#N)O 62a_100000765521_100011215382 [0,2,0,0,0,0|1,0,1]=4 19158 B12R1.374 Cc1ccc(c(c1)SCC#N)O 62a_100011215382_100000765521 [0,2,0,0,0,0|1,0,1]=4 19159 B12R1.374 Cc1ccc(c(c1)SCC=O)O 62a_100000765521_200015260668 [0,2,0,0,0,0|1,0,1]=4 19160 B12R1.374 Cc1ccc(c(c1)SCC=O)O 62a_200015260668_100000765521 [0,2,0,0,0,0|1,0,1]=4 19161 B12R1.374 Cc1ccc(c(c1)SCCF)Br 62a_100011217306_100012353751 [0,2,0,0,0,0|2,0,0]=4 19162 B12R1.374 Cc1ccc(c(c1)SCCF)Br 62a_100012353751_100011217306 [0,2,0,0,0,0|2,0,0]=4 19163 B12R1.374 Cc1ccc(c(c1)SCCF)C 62a_100000210833_100011217306 [0,2,0,0,0,0|2,0,0]=4 19164 B12R1.374 Cc1ccc(c(c1)SCCF)C 62a_100011217306_100000210833 [0,2,0,0,0,0|2,0,0]=4 19165 B12R1.374 Cc1ccc(c(c1)SCCF)Cl 62a_100011217306_100012356289 [0,2,0,0,0,0|2,0,0]=4 19166 B12R1.374 Cc1ccc(c(c1)SCCF)Cl 62a_100012356289_100011217306 [0,2,0,0,0,0|2,0,0]=4 19167 B12R1.374 Cc1ccc(c(c1)SCCF)F 62a_100000736223_100011217306 [0,2,0,0,0,0|2,0,0]=4 19168 B12R1.374 Cc1ccc(c(c1)SCCF)F 62a_100011217306_100000736223 [0,2,0,0,0,0|2,0,0]=4 19169 B12R1.374 Cc1ccc(c(c1)SCCF)N 62a_100011217306_100011356834 [0,2,0,0,0,0|2,0,0]=4 19170 B12R1.374 Cc1ccc(c(c1)SCCF)N 62a_100011356834_100011217306 [0,2,0,0,0,0|2,0,0]=4 19171 B12R1.374 Cc1ccc(c(c1)SCCF)O 62a_100000765521_100011217306 [0,2,0,0,0,0|1,0,0]=3 19172 B12R1.374 Cc1ccc(c(c1)SCCF)O 62a_100011217306_100000765521 [0,2,0,0,0,0|1,0,0]=3 19173 B12R1.374 Cc1ccc(c(c1)SCCO)Br 62a_100000211926_100012353751 [0,2,0,0,0,0|2,0,0]=4 19174 B12R1.374 Cc1ccc(c(c1)SCCO)Br 62a_100012353751_100000211926 [0,2,0,0,0,0|2,0,0]=4 19175 B12R1.374 Cc1ccc(c(c1)SCCO)C 62a_100000210833_100000211926 [0,2,0,0,0,0|2,0,0]=4 19176 B12R1.374 Cc1ccc(c(c1)SCCO)C 62a_100000211926_100000210833 [0,2,0,0,0,0|2,0,0]=4 19177 B12R1.374 Cc1ccc(c(c1)SCCO)Cl 62a_100000211926_100012356289 [0,2,0,0,0,0|2,0,0]=4 19178 B12R1.374 Cc1ccc(c(c1)SCCO)Cl 62a_100012356289_100000211926 [0,2,0,0,0,0|2,0,0]=4 19179 B12R1.374 Cc1ccc(c(c1)SCCO)F 62a_100000211926_100000736223 [0,2,0,0,0,0|2,0,0]=4 19180 B12R1.374 Cc1ccc(c(c1)SCCO)F 62a_100000736223_100000211926 [0,2,0,0,0,0|2,0,0]=4 19181 B12R1.374 Cc1ccc(c(c1)SCCO)N 62a_100000211926_100011356834 [0,2,0,0,0,0|2,0,0]=4 19182 B12R1.374 Cc1ccc(c(c1)SCCO)N 62a_100011356834_100000211926 [0,2,0,0,0,0|2,0,0]=4 19183 B12R1.374 Cc1ccc(c(c1)SCCO)O 62a_100000211926_100000765521 [0,2,0,0,0,0|1,0,0]=3 19184 B12R1.374 Cc1ccc(c(c1)SCCO)O 62a_100000765521_100000211926 [0,2,0,0,0,0|1,0,0]=3 19185 B12R1.374 Cc1ccc(c(n1)CSCF)O 62a_100015361967_100020630696 [0,2,0,0,0,0|2,0,0]=4 19186 B12R1.374 Cc1ccc(c(n1)CSCF)O 62a_100020630696_100015361967 [0,2,0,0,0,0|2,0,0]=4 19187 B12R1.374 Cc1ccc(c(n1)SCCF)O 62a_100000702858_100011217306 [0,2,0,0,0,0|2,0,0]=4 19188 B12R1.374 Cc1ccc(c(n1)SCCF)O 62a_100011217306_100000702858 [0,2,0,0,0,0|2,0,0]=4 19189 B12R1.374 Cc1ccc(c(n1)SCCO)O 62a_100000211926_100000702858 [0,2,0,0,0,0|2,0,0]=4 19190 B12R1.374 Cc1ccc(c(n1)SCCO)O 62a_100000702858_100000211926 [0,2,0,0,0,0|2,0,0]=4 19191 B12R1.374 Cc1ccc(cc1CNCF)Cl 34a_100000717755_100015361967 [0,2,0,0,0,0|2,0,0]=4 19192 B12R1.374 Cc1ccc(cc1CNCF)F 34a_100011217291_100015361967 [0,2,0,0,0,0|2,0,0]=4 19193 B12R1.374 Cc1ccc(cc1CNCF)O 34a_200009844824_100015361967 [0,2,0,0,0,0|2,0,0]=4 19194 B12R1.374 Cc1ccc(cc1COCF)Br 34a_100000700630_100015361967 [0,2,0,0,0,0|2,0,0]=4 19195 B12R1.374 Cc1ccc(cc1COCF)Br 7a_100000700630_100015361967 [0,2,0,0,0,0|2,0,0]=4 19196 B12R1.374 Cc1ccc(cc1COCF)Cl 34a_100012002407_100015361967 [0,2,0,0,0,0|2,0,0]=4 19197 B12R1.374 Cc1ccc(cc1COCF)Cl 7a_100012002407_100015361967 [0,2,0,0,0,0|2,0,0]=4 19198 B12R1.374 Cc1ccc(cc1COCF)F 34a_100011219218_100015361967 [0,2,0,0,0,0|2,0,0]=4 19199 B12R1.374 Cc1ccc(cc1COCF)F 7a_100011219218_100015361967 [0,2,0,0,0,0|2,0,0]=4 19200 B12R1.374 Cc1ccc(cc1COCF)I 34a_100010150140_100015361967 [0,2,0,0,0,0|2,0,0]=4 19201 B12R1.374 Cc1ccc(cc1COCF)I 7a_100010150140_100015361967 [0,2,0,0,0,0|2,0,0]=4 19202 B12R1.374 Cc1ccc(cc1CSCF)Cl 62a_100012186985_100015361967 [0,2,0,0,0,0|2,0,0]=4 19203 B12R1.374 Cc1ccc(cc1CSCF)Cl 62a_100015361967_100012186985 [0,2,0,0,0,0|2,0,0]=4 19204 B12R1.374 Cc1ccc(cc1CSCF)F 62a_100000709795_100015361967 [0,2,0,0,0,0|2,0,0]=4 19205 B12R1.374 Cc1ccc(cc1CSCF)F 62a_100015361967_100000709795 [0,2,0,0,0,0|2,0,0]=4 19206 B12R1.374 Cc1ccc(cc1NCCF)Br 34a_100000741167_100011217306 [0,2,0,0,0,0|2,0,0]=4 19207 B12R1.374 Cc1ccc(cc1NCCF)Br 7a_100000741167_100011217306 [0,2,0,0,0,0|2,0,0]=4 19208 B12R1.374 Cc1ccc(cc1NCCF)Cl 34a_100000211374_100011217306 [0,2,0,0,0,0|2,0,0]=4 19209 B12R1.374 Cc1ccc(cc1NCCF)Cl 7a_100000211374_100011217306 [0,2,0,0,0,0|2,0,0]=4 19210 B12R1.374 Cc1ccc(cc1NCCF)F 34a_100000211107_100011217306 [0,2,0,0,0,0|2,0,0]=4 19211 B12R1.374 Cc1ccc(cc1NCCF)F 7a_100000211107_100011217306 [0,2,0,0,0,0|2,0,0]=4 19212 B12R1.374 Cc1ccc(cc1NCCF)I 7a_100000761890_100011217306 [0,2,0,0,0,0|2,0,0]=4 19213 B12R1.374 Cc1ccc(cc1NCCF)O 34a_100011216113_100011217306 [0,2,0,0,0,0|2,0,0]=4 19214 B12R1.374 Cc1ccc(cc1NCCO)Br 34a_100000741167_100000211926 [0,2,0,0,0,0|2,0,0]=4 19215 B12R1.374 Cc1ccc(cc1NCCO)Br 7a_100000741167_100000211926 [0,2,0,0,0,0|2,0,0]=4 19216 B12R1.374 Cc1ccc(cc1NCCO)Cl 34a_100000211374_100000211926 [0,2,0,0,0,0|2,0,0]=4 19217 B12R1.374 Cc1ccc(cc1NCCO)Cl 7a_100000211374_100000211926 [0,2,0,0,0,0|2,0,0]=4 19218 B12R1.374 Cc1ccc(cc1NCCO)F 34a_100000211107_100000211926 [0,2,0,0,0,0|2,0,0]=4 19219 B12R1.374 Cc1ccc(cc1NCCO)F 7a_100000211107_100000211926 [0,2,0,0,0,0|2,0,0]=4 19220 B12R1.374 Cc1ccc(cc1NCCO)I 7a_100000761890_100000211926 [0,2,0,0,0,0|2,0,0]=4 19221 B12R1.374 Cc1ccc(cc1NCCO)O 34a_100011216113_100000211926 [0,2,0,0,0,0|2,0,0]=4 19222 B12R1.374 Cc1ccc(cc1OCCF)Br 34a_100000685420_100011217306 [0,2,0,0,0,0|2,0,0]=4 19223 B12R1.374 Cc1ccc(cc1OCCF)Br 7a_100000685420_100011217306 [0,2,0,0,0,0|2,0,0]=4 19224 B12R1.374 Cc1ccc(cc1OCCF)Cl 34a_100000756515_100011217306 [0,2,0,0,0,0|2,0,0]=4 19225 B12R1.374 Cc1ccc(cc1OCCF)Cl 7a_100000756515_100011217306 [0,2,0,0,0,0|2,0,0]=4 19226 B12R1.374 Cc1ccc(cc1OCCF)F 34a_100000690566_100011217306 [0,2,0,0,0,0|2,0,0]=4 19227 B12R1.374 Cc1ccc(cc1OCCF)F 7a_100000690566_100011217306 [0,2,0,0,0,0|2,0,0]=4 19228 B12R1.374 Cc1ccc(cc1OCCF)I 7a_100000766334_100011217306 [0,2,0,0,0,0|2,0,0]=4 19229 B12R1.374 Cc1ccc(cc1OCCF)N 34a_100000759471_100011217306 [0,2,0,0,0,0|2,0,0]=4 19230 B12R1.374 Cc1ccc(cc1OCCF)N 7a_100000759471_100011217306 [0,2,0,0,0,0|2,0,0]=4 19231 B12R1.374 Cc1ccc(cc1OCCO)Br 34a_100000685420_100000211926 [0,2,0,0,0,0|2,0,0]=4 19232 B12R1.374 Cc1ccc(cc1OCCO)Br 7a_100000685420_100000211926 [0,2,0,0,0,0|2,0,0]=4 19233 B12R1.374 Cc1ccc(cc1OCCO)Cl 34a_100000756515_100000211926 [0,2,0,0,0,0|2,0,0]=4 19234 B12R1.374 Cc1ccc(cc1OCCO)Cl 7a_100000756515_100000211926 [0,2,0,0,0,0|2,0,0]=4 19235 B12R1.374 Cc1ccc(cc1OCCO)F 34a_100000690566_100000211926 [0,2,0,0,0,0|2,0,0]=4 19236 B12R1.374 Cc1ccc(cc1OCCO)F 7a_100000690566_100000211926 [0,2,0,0,0,0|2,0,0]=4 19237 B12R1.374 Cc1ccc(cc1OCCO)I 7a_100000766334_100000211926 [0,2,0,0,0,0|2,0,0]=4 19238 B12R1.374 Cc1ccc(cc1OCCO)N 34a_100000759471_100000211926 [0,2,0,0,0,0|2,0,0]=4 19239 B12R1.374 Cc1ccc(cc1OCCO)N 7a_100000759471_100000211926 [0,2,0,0,0,0|2,0,0]=4 19240 B12R1.374 Cc1ccc(cc1SCCF)Br 62a_100011217306_100011344865 [0,2,0,0,0,0|2,0,0]=4 19241 B12R1.374 Cc1ccc(cc1SCCF)Br 62a_100011344865_100011217306 [0,2,0,0,0,0|2,0,0]=4 19242 B12R1.374 Cc1ccc(cc1SCCF)Cl 62a_100011217306_100011263213 [0,2,0,0,0,0|2,0,0]=4 19243 B12R1.374 Cc1ccc(cc1SCCF)Cl 62a_100011263213_100011217306 [0,2,0,0,0,0|2,0,0]=4 19244 B12R1.374 Cc1ccc(cc1SCCF)F 62a_100011217306_100011218078 [0,2,0,0,0,0|2,0,0]=4 19245 B12R1.374 Cc1ccc(cc1SCCF)F 62a_100011218078_100011217306 [0,2,0,0,0,0|2,0,0]=4 19246 B12R1.374 Cc1ccc(cc1SCCF)N 62a_100000736455_100011217306 [0,2,0,0,0,0|2,0,0]=4 19247 B12R1.374 Cc1ccc(cc1SCCF)N 62a_100011217306_100000736455 [0,2,0,0,0,0|2,0,0]=4 19248 B12R1.374 Cc1ccc(cc1SCCF)O 62a_100011217306_100011380479 [0,2,0,0,0,0|2,0,0]=4 19249 B12R1.374 Cc1ccc(cc1SCCF)O 62a_100011380479_100011217306 [0,2,0,0,0,0|2,0,0]=4 19250 B12R1.374 Cc1ccc(cc1SCCO)Br 62a_100000211926_100011344865 [0,2,0,0,0,0|2,0,0]=4 19251 B12R1.374 Cc1ccc(cc1SCCO)Br 62a_100011344865_100000211926 [0,2,0,0,0,0|2,0,0]=4 19252 B12R1.374 Cc1ccc(cc1SCCO)Cl 62a_100000211926_100011263213 [0,2,0,0,0,0|2,0,0]=4 19253 B12R1.374 Cc1ccc(cc1SCCO)Cl 62a_100011263213_100000211926 [0,2,0,0,0,0|2,0,0]=4 19254 B12R1.374 Cc1ccc(cc1SCCO)F 62a_100000211926_100011218078 [0,2,0,0,0,0|2,0,0]=4 19255 B12R1.374 Cc1ccc(cc1SCCO)F 62a_100011218078_100000211926 [0,2,0,0,0,0|2,0,0]=4 19256 B12R1.374 Cc1ccc(cc1SCCO)N 62a_100000211926_100000736455 [0,2,0,0,0,0|2,0,0]=4 19257 B12R1.374 Cc1ccc(cc1SCCO)N 62a_100000736455_100000211926 [0,2,0,0,0,0|2,0,0]=4 19258 B12R1.374 Cc1ccc(cc1SCCO)O 62a_100000211926_100011380479 [0,2,0,0,0,0|2,0,0]=4 19259 B12R1.374 Cc1ccc(cc1SCCO)O 62a_100011380479_100000211926 [0,2,0,0,0,0|2,0,0]=4 19260 B12R1.374 Cc1cnc(c(c1)SCCF)O 62a_100000719714_100011217306 [0,2,0,0,0,0|2,0,0]=4 19261 B12R1.374 Cc1cnc(c(c1)SCCF)O 62a_100011217306_100000719714 [0,2,0,0,0,0|2,0,0]=4 19262 B12R1.374 Cc1cnc(c(c1)SCCO)O 62a_100000211926_100000719714 [0,2,0,0,0,0|2,0,0]=4 19263 B12R1.374 Cc1cnc(c(c1)SCCO)O 62a_100000719714_100000211926 [0,2,0,0,0,0|2,0,0]=4 19264 B12R1.374 FCCNc1cc(ccc1Br)Br 34a_100000737762_100011217306 [0,2,0,0,0,0|2,0,0]=4 19265 B12R1.374 FCCNc1cc(ccc1Br)Cl 34a_100000687073_100011217306 [0,2,0,0,0,0|2,0,0]=4 19266 B12R1.374 FCCNc1cc(ccc1Br)F 34a_100000687223_100011217306 [0,2,0,0,0,0|2,0,0]=4 19267 B12R1.374 FCCNc1cc(ccc1Cl)Br 34a_100000750497_100011217306 [0,2,0,0,0,0|2,0,0]=4 19268 B12R1.374 FCCNc1cc(ccc1Cl)Cl 34a_100000184485_100011217306 [0,2,0,0,0,0|2,0,0]=4 19269 B12R1.374 FCCNc1cc(ccc1Cl)F 34a_100000751338_100011217306 [0,2,0,0,0,0|2,0,0]=4 19270 B12R1.374 FCCNc1cc(ccc1Cl)I 34a_200000761891_100011217306 [0,2,0,0,0,0|2,0,0]=4 19271 B12R1.374 FCCNc1cc(ccc1F)Br 34a_100000740924_100011217306 [0,2,0,0,0,0|2,0,0]=4 19272 B12R1.374 FCCNc1cc(ccc1F)Cl 34a_100000212115_100011217306 [0,2,0,0,0,0|2,0,0]=4 19273 B12R1.374 FCCNc1cc(ccc1F)F 34a_100000210742_100011217306 [0,2,0,0,0,0|2,0,0]=4 19274 B12R1.374 FCCNc1cc(ccc1F)I 34a_100011464823_100011217306 [0,2,0,0,0,0|2,0,0]=4 19275 B12R1.374 FCCNc1cc(ccc1I)Br 34a_100000743836_100011217306 [0,2,0,0,0,0|2,0,0]=4 19276 B12R1.374 FCCNc1cc(ccc1I)Cl 34a_100000761886_100011217306 [0,2,0,0,0,0|2,0,0]=4 19277 B12R1.374 FCCNc1cc(ccc1I)F 34a_100011218093_100011217306 [0,2,0,0,0,0|2,0,0]=4 19278 B12R1.374 FCCOc1cc(ccc1Br)Br 34a_100011220040_100011217306 [0,2,0,0,0,0|2,0,0]=4 19279 B12R1.374 FCCOc1cc(ccc1Br)Br 7a_100011220040_100011217306 [0,2,0,0,0,0|2,0,0]=4 19280 B12R1.374 FCCOc1cc(ccc1Br)Cl 34a_100012339455_100011217306 [0,2,0,0,0,0|2,0,0]=4 19281 B12R1.374 FCCOc1cc(ccc1Br)Cl 7a_100012339455_100011217306 [0,2,0,0,0,0|2,0,0]=4 19282 B12R1.374 FCCOc1cc(ccc1Br)F 34a_100000690578_100011217306 [0,2,0,0,0,0|2,0,0]=4 19283 B12R1.374 FCCOc1cc(ccc1Br)F 7a_100000690578_100011217306 [0,2,0,0,0,0|2,0,0]=4 19284 B12R1.374 FCCOc1cc(ccc1Br)I 34a_100012356990_100011217306 [0,2,0,0,0,0|2,0,0]=4 19285 B12R1.374 FCCOc1cc(ccc1Br)I 7a_100012356990_100011217306 [0,2,0,0,0,0|2,0,0]=4 19286 B12R1.374 FCCOc1cc(ccc1Cl)Br 34a_100000738945_100011217306 [0,2,0,0,0,0|2,0,0]=4 19287 B12R1.374 FCCOc1cc(ccc1Cl)Br 7a_100000738945_100011217306 [0,2,0,0,0,0|2,0,0]=4 19288 B12R1.374 FCCOc1cc(ccc1Cl)Cl 34a_100000211422_100011217306 [0,2,0,0,0,0|2,0,0]=4 19289 B12R1.374 FCCOc1cc(ccc1Cl)Cl 7a_100000211422_100011217306 [0,2,0,0,0,0|2,0,0]=4 19290 B12R1.374 FCCOc1cc(ccc1Cl)F 34a_100000692107_100011217306 [0,2,0,0,0,0|2,0,0]=4 19291 B12R1.374 FCCOc1cc(ccc1Cl)F 7a_100000692107_100011217306 [0,2,0,0,0,0|2,0,0]=4 19292 B12R1.374 FCCOc1cc(ccc1Cl)I 34a_100011356854_100011217306 [0,2,0,0,0,0|2,0,0]=4 19293 B12R1.374 FCCOc1cc(ccc1Cl)I 7a_100011356854_100011217306 [0,2,0,0,0,0|2,0,0]=4 19294 B12R1.374 FCCOc1cc(ccc1F)Br 34a_100000686035_100011217306 [0,2,0,0,0,0|2,0,0]=4 19295 B12R1.374 FCCOc1cc(ccc1F)Br 7a_100000686035_100011217306 [0,2,0,0,0,0|2,0,0]=4 19296 B12R1.374 FCCOc1cc(ccc1F)Cl 34a_100000757397_100011217306 [0,2,0,0,0,0|2,0,0]=4 19297 B12R1.374 FCCOc1cc(ccc1F)Cl 7a_100000757397_100011217306 [0,2,0,0,0,0|2,0,0]=4 19298 B12R1.374 FCCOc1cc(ccc1F)F 34a_100000752141_100011217306 [0,2,0,0,0,0|2,0,0]=4 19299 B12R1.374 FCCOc1cc(ccc1F)F 7a_100000752141_100011217306 [0,2,0,0,0,0|2,0,0]=4 19300 B12R1.374 FCCOc1cc(ccc1F)I 34a_100009958187_100011217306 [0,2,0,0,0,0|2,0,0]=4 19301 B12R1.374 FCCOc1cc(ccc1F)I 7a_100009958187_100011217306 [0,2,0,0,0,0|2,0,0]=4 19302 B12R1.374 FCCOc1cc(ccc1I)Br 34a_100012344904_100011217306 [0,2,0,0,0,0|2,0,0]=4 19303 B12R1.374 FCCOc1cc(ccc1I)Br 7a_100012344904_100011217306 [0,2,0,0,0,0|2,0,0]=4 19304 B12R1.374 FCCOc1cc(ccc1I)Cl 34a_100000050036_100011217306 [0,2,0,0,0,0|2,0,0]=4 19305 B12R1.374 FCCOc1cc(ccc1I)Cl 7a_100000050036_100011217306 [0,2,0,0,0,0|2,0,0]=4 19306 B12R1.374 FCCOc1cc(ccc1I)F 34a_100010084537_100011217306 [0,2,0,0,0,0|2,0,0]=4 19307 B12R1.374 FCCOc1cc(ccc1I)F 7a_100010084537_100011217306 [0,2,0,0,0,0|2,0,0]=4 19308 B12R1.374 FCCSc1cc(ccc1Br)Br 62a_100011217306_100011483371 [0,2,0,0,0,0|2,0,0]=4 19309 B12R1.374 FCCSc1cc(ccc1Br)Br 62a_100011483371_100011217306 [0,2,0,0,0,0|2,0,0]=4 19310 B12R1.374 FCCSc1cc(ccc1Br)Cl 62a_100011217306_100012339723 [0,2,0,0,0,0|2,0,0]=4 19311 B12R1.374 FCCSc1cc(ccc1Br)Cl 62a_100012339723_100011217306 [0,2,0,0,0,0|2,0,0]=4 19312 B12R1.374 FCCSc1cc(ccc1Br)F 62a_100011217306_100011217576 [0,2,0,0,0,0|2,0,0]=4 19313 B12R1.374 FCCSc1cc(ccc1Br)F 62a_100011217576_100011217306 [0,2,0,0,0,0|2,0,0]=4 19314 B12R1.374 FCCSc1cc(ccc1Cl)Br 62a_100011217306_100011772130 [0,2,0,0,0,0|2,0,0]=4 19315 B12R1.374 FCCSc1cc(ccc1Cl)Br 62a_100011772130_100011217306 [0,2,0,0,0,0|2,0,0]=4 19316 B12R1.374 FCCSc1cc(ccc1Cl)Cl 62a_100000707729_100011217306 [0,2,0,0,0,0|2,0,0]=4 19317 B12R1.374 FCCSc1cc(ccc1Cl)Cl 62a_100011217306_100000707729 [0,2,0,0,0,0|2,0,0]=4 19318 B12R1.374 FCCSc1cc(ccc1Cl)F 62a_100011217299_100011217306 [0,2,0,0,0,0|2,0,0]=4 19319 B12R1.374 FCCSc1cc(ccc1Cl)F 62a_100011217306_100011217299 [0,2,0,0,0,0|2,0,0]=4 19320 B12R1.374 FCCSc1cc(ccc1F)Br 62a_100011217306_100011217312 [0,2,0,0,0,0|2,0,0]=4 19321 B12R1.374 FCCSc1cc(ccc1F)Br 62a_100011217312_100011217306 [0,2,0,0,0,0|2,0,0]=4 19322 B12R1.374 FCCSc1cc(ccc1F)Cl 62a_100011217306_100011218116 [0,2,0,0,0,0|2,0,0]=4 19323 B12R1.374 FCCSc1cc(ccc1F)Cl 62a_100011218116_100011217306 [0,2,0,0,0,0|2,0,0]=4 19324 B12R1.374 FCCSc1cc(ccc1F)F 62a_100011217306_100011219198 [0,2,0,0,0,0|2,0,0]=4 19325 B12R1.374 FCCSc1cc(ccc1F)F 62a_100011219198_100011217306 [0,2,0,0,0,0|2,0,0]=4 19326 B12R1.374 FCNCc1cc(ccc1Br)Br 34a_100000707832_100015361967 [0,2,0,0,0,0|2,0,0]=4 19327 B12R1.374 FCNCc1cc(ccc1Br)F 34a_100000742738_100015361967 [0,2,0,0,0,0|2,0,0]=4 19328 B12R1.374 FCNCc1cc(ccc1Cl)Br 34a_100025772652_100015361967 [0,2,0,0,0,0|2,0,0]=4 19329 B12R1.374 FCNCc1cc(ccc1Cl)Cl 34a_100102946428_100015361967 [0,2,0,0,0,0|2,0,0]=4 19330 B12R1.374 FCNCc1cc(ccc1Cl)F 34a_100011830483_100015361967 [0,2,0,0,0,0|2,0,0]=4 19331 B12R1.374 FCNCc1cc(ccc1F)Br 34a_100009815772_100015361967 [0,2,0,0,0,0|2,0,0]=4 19332 B12R1.374 FCNCc1cc(ccc1F)Cl 34a_100011211646_100015361967 [0,2,0,0,0,0|2,0,0]=4 19333 B12R1.374 FCNCc1cc(ccc1F)F 34a_100000752317_100015361967 [0,2,0,0,0,0|2,0,0]=4 19334 B12R1.374 FCOCc1cc(ccc1Br)Br 34a_100011266457_100015361967 [0,2,0,0,0,0|2,0,0]=4 19335 B12R1.374 FCOCc1cc(ccc1Br)Br 7a_100011266457_100015361967 [0,2,0,0,0,0|2,0,0]=4 19336 B12R1.374 FCOCc1cc(ccc1Br)Cl 34a_100012355668_100015361967 [0,2,0,0,0,0|2,0,0]=4 19337 B12R1.374 FCOCc1cc(ccc1Br)Cl 7a_100012355668_100015361967 [0,2,0,0,0,0|2,0,0]=4 19338 B12R1.374 FCOCc1cc(ccc1Br)F 34a_100011217561_100015361967 [0,2,0,0,0,0|2,0,0]=4 19339 B12R1.374 FCOCc1cc(ccc1Br)F 7a_100011217561_100015361967 [0,2,0,0,0,0|2,0,0]=4 19340 B12R1.374 FCOCc1cc(ccc1Br)I 7a_100012359683_100015361967 [0,2,0,0,0,0|2,0,0]=4 19341 B12R1.374 FCOCc1cc(ccc1Cl)Br 34a_100011215897_100015361967 [0,2,0,0,0,0|2,0,0]=4 19342 B12R1.374 FCOCc1cc(ccc1Cl)Br 7a_100011215897_100015361967 [0,2,0,0,0,0|2,0,0]=4 19343 B12R1.374 FCOCc1cc(ccc1Cl)Cl 34a_100000698905_100015361967 [0,2,0,0,0,0|2,0,0]=4 19344 B12R1.374 FCOCc1cc(ccc1Cl)Cl 7a_100000698905_100015361967 [0,2,0,0,0,0|2,0,0]=4 19345 B12R1.374 FCOCc1cc(ccc1Cl)F 34a_100011218361_100015361967 [0,2,0,0,0,0|2,0,0]=4 19346 B12R1.374 FCOCc1cc(ccc1Cl)F 7a_100011218361_100015361967 [0,2,0,0,0,0|2,0,0]=4 19347 B12R1.374 FCOCc1cc(ccc1Cl)I 34a_100010128486_100015361967 [0,2,0,0,0,0|2,0,0]=4 19348 B12R1.374 FCOCc1cc(ccc1Cl)I 7a_100010128486_100015361967 [0,2,0,0,0,0|2,0,0]=4 19349 B12R1.374 FCOCc1cc(ccc1F)Br 34a_100000246282_100015361967 [0,2,0,0,0,0|2,0,0]=4 19350 B12R1.374 FCOCc1cc(ccc1F)Br 7a_100000246282_100015361967 [0,2,0,0,0,0|2,0,0]=4 19351 B12R1.374 FCOCc1cc(ccc1F)Cl 34a_100011217248_100015361967 [0,2,0,0,0,0|2,0,0]=4 19352 B12R1.374 FCOCc1cc(ccc1F)Cl 7a_100011217248_100015361967 [0,2,0,0,0,0|2,0,0]=4 19353 B12R1.374 FCOCc1cc(ccc1F)F 34a_100011217725_100015361967 [0,2,0,0,0,0|2,0,0]=4 19354 B12R1.374 FCOCc1cc(ccc1F)F 7a_100011217725_100015361967 [0,2,0,0,0,0|2,0,0]=4 19355 B12R1.374 FCOCc1cc(ccc1F)I 34a_100000049604_100015361967 [0,2,0,0,0,0|2,0,0]=4 19356 B12R1.374 FCOCc1cc(ccc1F)I 7a_100000049604_100015361967 [0,2,0,0,0,0|2,0,0]=4 19357 B12R1.374 FCOCc1cc(ccc1I)Br 34a_100011356890_100015361967 [0,2,0,0,0,0|2,0,0]=4 19358 B12R1.374 FCOCc1cc(ccc1I)Br 7a_100011356890_100015361967 [0,2,0,0,0,0|2,0,0]=4 19359 B12R1.374 FCOCc1cc(ccc1I)F 34a_100010255287_100015361967 [0,2,0,0,0,0|2,0,0]=4 19360 B12R1.374 FCOCc1cc(ccc1I)F 7a_100010255287_100015361967 [0,2,0,0,0,0|2,0,0]=4 19361 B12R1.374 FCSCc1cc(ccc1Br)Br 62a_100011982794_100015361967 [0,2,0,0,0,0|2,0,0]=4 19362 B12R1.374 FCSCc1cc(ccc1Br)Br 62a_100015361967_100011982794 [0,2,0,0,0,0|2,0,0]=4 19363 B12R1.374 FCSCc1cc(ccc1Br)Cl 62a_100000733903_100015361967 [0,2,0,0,0,0|2,0,0]=4 19364 B12R1.374 FCSCc1cc(ccc1Br)Cl 62a_100015361967_100000733903 [0,2,0,0,0,0|2,0,0]=4 19365 B12R1.374 FCSCc1cc(ccc1Br)F 62a_100000736370_100015361967 [0,2,0,0,0,0|2,0,0]=4 19366 B12R1.374 FCSCc1cc(ccc1Br)F 62a_100015361967_100000736370 [0,2,0,0,0,0|2,0,0]=4 19367 B12R1.374 FCSCc1cc(ccc1Br)I 62a_100012355412_100015361967 [0,2,0,0,0,0|2,0,0]=4 19368 B12R1.374 FCSCc1cc(ccc1Br)I 62a_100015361967_100012355412 [0,2,0,0,0,0|2,0,0]=4 19369 B12R1.374 FCSCc1cc(ccc1Cl)Br 62a_100000763347_100015361967 [0,2,0,0,0,0|2,0,0]=4 19370 B12R1.374 FCSCc1cc(ccc1Cl)Br 62a_100015361967_100000763347 [0,2,0,0,0,0|2,0,0]=4 19371 B12R1.374 FCSCc1cc(ccc1Cl)Cl 62a_100000756322_100015361967 [0,2,0,0,0,0|2,0,0]=4 19372 B12R1.374 FCSCc1cc(ccc1Cl)Cl 62a_100015361967_100000756322 [0,2,0,0,0,0|2,0,0]=4 19373 B12R1.374 FCSCc1cc(ccc1Cl)F 62a_100000709952_100015361967 [0,2,0,0,0,0|2,0,0]=4 19374 B12R1.374 FCSCc1cc(ccc1Cl)F 62a_100015361967_100000709952 [0,2,0,0,0,0|2,0,0]=4 19375 B12R1.374 FCSCc1cc(ccc1Cl)I 62a_100010188191_100015361967 [0,2,0,0,0,0|2,0,0]=4 19376 B12R1.374 FCSCc1cc(ccc1Cl)I 62a_100015361967_100010188191 [0,2,0,0,0,0|2,0,0]=4 19377 B12R1.374 FCSCc1cc(ccc1F)Br 62a_100000736399_100015361967 [0,2,0,0,0,0|2,0,0]=4 19378 B12R1.374 FCSCc1cc(ccc1F)Br 62a_100015361967_100000736399 [0,2,0,0,0,0|2,0,0]=4 19379 B12R1.374 FCSCc1cc(ccc1F)Cl 62a_100000716957_100015361967 [0,2,0,0,0,0|2,0,0]=4 19380 B12R1.374 FCSCc1cc(ccc1F)Cl 62a_100015361967_100000716957 [0,2,0,0,0,0|2,0,0]=4 19381 B12R1.374 FCSCc1cc(ccc1F)F 62a_100000685659_100015361967 [0,2,0,0,0,0|2,0,0]=4 19382 B12R1.374 FCSCc1cc(ccc1F)F 62a_100015361967_100000685659 [0,2,0,0,0,0|2,0,0]=4 19383 B12R1.374 FCSCc1cc(ccc1F)I 62a_100015361967_200010149601 [0,2,0,0,0,0|2,0,0]=4 19384 B12R1.374 FCSCc1cc(ccc1F)I 62a_200010149601_100015361967 [0,2,0,0,0,0|2,0,0]=4 19385 B12R1.374 FCSCc1cc(ccc1I)Br 62a_100012362523_100015361967 [0,2,0,0,0,0|2,0,0]=4 19386 B12R1.374 FCSCc1cc(ccc1I)Br 62a_100015361967_100012362523 [0,2,0,0,0,0|2,0,0]=4 19387 B12R1.374 FCSCc1cc(ccc1I)Cl 62a_100012348826_100015361967 [0,2,0,0,0,0|2,0,0]=4 19388 B12R1.374 FCSCc1cc(ccc1I)Cl 62a_100015361967_100012348826 [0,2,0,0,0,0|2,0,0]=4 19389 B12R1.374 FCSCc1cc(ccc1I)F 62a_100010149606_100015361967 [0,2,0,0,0,0|2,0,0]=4 19390 B12R1.374 FCSCc1cc(ccc1I)F 62a_100015361967_100010149606 [0,2,0,0,0,0|2,0,0]=4 19391 B12R1.374 N#CCSc1cc(ccc1O)Br 62a_100011215382_100012355227 [0,2,0,0,0,0|1,0,1]=4 19392 B12R1.374 N#CCSc1cc(ccc1O)Br 62a_100012355227_100011215382 [0,2,0,0,0,0|1,0,1]=4 19393 B12R1.374 N#CCSc1cc(ccc1O)Cl 62a_100011215382_100011356953 [0,2,0,0,0,0|1,0,1]=4 19394 B12R1.374 N#CCSc1cc(ccc1O)Cl 62a_100011356953_100011215382 [0,2,0,0,0,0|1,0,1]=4 19395 B12R1.374 N#CCSc1cc(ccc1O)F 62a_100000211999_100011215382 [0,2,0,0,0,0|1,0,1]=4 19396 B12R1.374 N#CCSc1cc(ccc1O)F 62a_100011215382_100000211999 [0,2,0,0,0,0|1,0,1]=4 19397 B12R1.374 N#CCSc1cc(ccc1O)N 62a_100011215382_100011534360 [0,2,0,0,0,0|1,0,1]=4 19398 B12R1.374 N#CCSc1cc(ccc1O)N 62a_100011534360_100011215382 [0,2,0,0,0,0|1,0,1]=4 19399 B12R1.374 N#CCSc1cc(ccc1O)O 62a_100011215382_100009813629 [0,2,0,0,0,0|1,0,1]=4 19400 B12R1.374 Nc1ccc(c(c1)COCF)Br 34a_100012347228_100015361967 [0,2,0,0,0,0|2,0,0]=4 19401 B12R1.374 Nc1ccc(c(c1)COCF)Cl 34a_100011273577_100015361967 [0,2,0,0,0,0|2,0,0]=4 19402 B12R1.374 Nc1ccc(c(c1)COCF)F 34a_100011218011_100015361967 [0,2,0,0,0,0|2,0,0]=4 19403 B12R1.374 Nc1ccc(c(c1)OCCF)Cl 34a_100011934209_100011217306 [0,2,0,0,0,0|2,0,0]=4 19404 B12R1.374 Nc1ccc(c(c1)OCCF)F 34a_100012017398_100011217306 [0,2,0,0,0,0|2,0,0]=4 19405 B12R1.374 Nc1ccc(c(c1)OCCF)F 7a_100012017398_100011217306 [0,2,0,0,0,0|2,0,0]=4 19406 B12R1.374 Nc1ccc(c(c1)OCCF)N 34a_100025717382_100011217306 [0,2,0,0,0,0|2,0,0]=4 19407 B12R1.374 Nc1ccc(c(c1)OCCO)Cl 34a_100011934209_100000211926 [0,2,0,0,0,0|2,0,0]=4 19408 B12R1.374 Nc1ccc(c(c1)OCCO)F 34a_100012017398_100000211926 [0,2,0,0,0,0|2,0,0]=4 19409 B12R1.374 Nc1ccc(c(c1)OCCO)F 7a_100012017398_100000211926 [0,2,0,0,0,0|2,0,0]=4 19410 B12R1.374 Nc1ccc(c(c1)OCCO)N 34a_100025717382_100000211926 [0,2,0,0,0,0|2,0,0]=4 19411 B12R1.374 Nc1ccc(c(c1)SCC=O)O 62a_100011534360_200015260668 [0,2,0,0,0,0|1,0,1]=4 19412 B12R1.374 Nc1ccc(c(c1)SCC=O)O 62a_200015260668_100011534360 [0,2,0,0,0,0|1,0,1]=4 19413 B12R1.374 Nc1ccc(c(c1)SCCF)Br 62a_100000750459_100011217306 [0,2,0,0,0,0|2,0,0]=4 19414 B12R1.374 Nc1ccc(c(c1)SCCF)Br 62a_100011217306_100000750459 [0,2,0,0,0,0|2,0,0]=4 19415 B12R1.374 Nc1ccc(c(c1)SCCF)Cl 62a_100011217306_100012360549 [0,2,0,0,0,0|2,0,0]=4 19416 B12R1.374 Nc1ccc(c(c1)SCCF)Cl 62a_100012360549_100011217306 [0,2,0,0,0,0|2,0,0]=4 19417 B12R1.374 Nc1ccc(c(c1)SCCF)F 62a_100000760356_100011217306 [0,2,0,0,0,0|2,0,0]=4 19418 B12R1.374 Nc1ccc(c(c1)SCCF)F 62a_100011217306_100000760356 [0,2,0,0,0,0|2,0,0]=4 19419 B12R1.374 Nc1ccc(c(c1)SCCF)N 62a_100011217306_100011534242 [0,2,0,0,0,0|2,0,0]=4 19420 B12R1.374 Nc1ccc(c(c1)SCCF)N 62a_100011534242_100011217306 [0,2,0,0,0,0|2,0,0]=4 19421 B12R1.374 Nc1ccc(c(c1)SCCF)O 62a_100011217306_100011534360 [0,2,0,0,0,0|1,0,0]=3 19422 B12R1.374 Nc1ccc(c(c1)SCCF)O 62a_100011534360_100011217306 [0,2,0,0,0,0|1,0,0]=3 19423 B12R1.374 Nc1ccc(c(c1)SCCO)Br 62a_100000211926_100000750459 [0,2,0,0,0,0|2,0,0]=4 19424 B12R1.374 Nc1ccc(c(c1)SCCO)Br 62a_100000750459_100000211926 [0,2,0,0,0,0|2,0,0]=4 19425 B12R1.374 Nc1ccc(c(c1)SCCO)Cl 62a_100000211926_100012360549 [0,2,0,0,0,0|2,0,0]=4 19426 B12R1.374 Nc1ccc(c(c1)SCCO)Cl 62a_100012360549_100000211926 [0,2,0,0,0,0|2,0,0]=4 19427 B12R1.374 Nc1ccc(c(c1)SCCO)F 62a_100000211926_100000760356 [0,2,0,0,0,0|2,0,0]=4 19428 B12R1.374 Nc1ccc(c(c1)SCCO)F 62a_100000760356_100000211926 [0,2,0,0,0,0|2,0,0]=4 19429 B12R1.374 Nc1ccc(c(c1)SCCO)N 62a_100000211926_100011534242 [0,2,0,0,0,0|2,0,0]=4 19430 B12R1.374 Nc1ccc(c(c1)SCCO)N 62a_100011534242_100000211926 [0,2,0,0,0,0|2,0,0]=4 19431 B12R1.374 Nc1ccc(c(c1)SCCO)O 62a_100000211926_100011534360 [0,2,0,0,0,0|1,0,0]=3 19432 B12R1.374 Nc1ccc(c(c1)SCCO)O 62a_100011534360_100000211926 [0,2,0,0,0,0|1,0,0]=3 19433 B12R1.374 Nc1ccc(cc1COCF)Br 34a_100012353972_100015361967 [0,2,0,0,0,0|2,0,0]=4 19434 B12R1.374 Nc1ccc(cc1COCF)Br 7a_100012353972_100015361967 [0,2,0,0,0,0|2,0,0]=4 19435 B12R1.374 Nc1ccc(cc1COCF)Cl 34a_100011214999_100015361967 [0,2,0,0,0,0|2,0,0]=4 19436 B12R1.374 Nc1ccc(cc1COCF)Cl 7a_100011214999_100015361967 [0,2,0,0,0,0|2,0,0]=4 19437 B12R1.374 Nc1ccc(cc1COCF)F 34a_100011296978_100015361967 [0,2,0,0,0,0|2,0,0]=4 19438 B12R1.374 Nc1ccc(cc1COCF)F 7a_100011296978_100015361967 [0,2,0,0,0,0|2,0,0]=4 19439 B12R1.374 Nc1ccc(cc1OCCF)Br 34a_100000739049_100011217306 [0,2,0,0,0,0|2,0,0]=4 19440 B12R1.374 Nc1ccc(cc1OCCF)Br 7a_100000739049_100011217306 [0,2,0,0,0,0|2,0,0]=4 19441 B12R1.374 Nc1ccc(cc1OCCF)Cl 34a_100000185728_100011217306 [0,2,0,0,0,0|2,0,0]=4 19442 B12R1.374 Nc1ccc(cc1OCCF)Cl 7a_100000185728_100011217306 [0,2,0,0,0,0|2,0,0]=4 19443 B12R1.374 Nc1ccc(cc1OCCF)F 34a_100000753323_100011217306 [0,2,0,0,0,0|2,0,0]=4 19444 B12R1.374 Nc1ccc(cc1OCCF)F 7a_100000753323_100011217306 [0,2,0,0,0,0|2,0,0]=4 19445 B12R1.374 Nc1ccc(cc1OCCF)I 34a_100000057187_100011217306 [0,2,0,0,0,0|2,0,0]=4 19446 B12R1.374 Nc1ccc(cc1OCCF)I 7a_100000057187_100011217306 [0,2,0,0,0,0|2,0,0]=4 19447 B12R1.374 Nc1ccc(cc1OCCO)Br 34a_100000739049_100000211926 [0,2,0,0,0,0|2,0,0]=4 19448 B12R1.374 Nc1ccc(cc1OCCO)Br 7a_100000739049_100000211926 [0,2,0,0,0,0|2,0,0]=4 19449 B12R1.374 Nc1ccc(cc1OCCO)Cl 34a_100000185728_100000211926 [0,2,0,0,0,0|2,0,0]=4 19450 B12R1.374 Nc1ccc(cc1OCCO)Cl 7a_100000185728_100000211926 [0,2,0,0,0,0|2,0,0]=4 19451 B12R1.374 Nc1ccc(cc1OCCO)F 34a_100000753323_100000211926 [0,2,0,0,0,0|2,0,0]=4 19452 B12R1.374 Nc1ccc(cc1OCCO)F 7a_100000753323_100000211926 [0,2,0,0,0,0|2,0,0]=4 19453 B12R1.374 Nc1ccc(cc1OCCO)I 34a_100000057187_100000211926 [0,2,0,0,0,0|2,0,0]=4 19454 B12R1.374 Nc1ccc(cc1OCCO)I 7a_100000057187_100000211926 [0,2,0,0,0,0|2,0,0]=4 19455 B12R1.374 Nc1ccc(cc1SCCF)Br 62a_100000187925_100011217306 [0,2,0,0,0,0|2,0,0]=4 19456 B12R1.374 Nc1ccc(cc1SCCF)Br 62a_100011217306_100000187925 [0,2,0,0,0,0|2,0,0]=4 19457 B12R1.374 Nc1ccc(cc1SCCF)Cl 62a_100000761889_100011217306 [0,2,0,0,0,0|2,0,0]=4 19458 B12R1.374 Nc1ccc(cc1SCCF)Cl 62a_100011217306_100000761889 [0,2,0,0,0,0|2,0,0]=4 19459 B12R1.374 Nc1ccc(cc1SCCF)F 62a_100000760547_100011217306 [0,2,0,0,0,0|2,0,0]=4 19460 B12R1.374 Nc1ccc(cc1SCCF)F 62a_100011217306_100000760547 [0,2,0,0,0,0|2,0,0]=4 19461 B12R1.374 Nc1ccc(cc1SCCF)O 62a_100011217306_100012001276 [0,2,0,0,0,0|2,0,0]=4 19462 B12R1.374 Nc1ccc(cc1SCCF)O 62a_100012001276_100011217306 [0,2,0,0,0,0|2,0,0]=4 19463 B12R1.374 Nc1ccc(cc1SCCO)Br 62a_100000187925_100000211926 [0,2,0,0,0,0|2,0,0]=4 19464 B12R1.374 Nc1ccc(cc1SCCO)Br 62a_100000211926_100000187925 [0,2,0,0,0,0|2,0,0]=4 19465 B12R1.374 Nc1ccc(cc1SCCO)Cl 62a_100000211926_100000761889 [0,2,0,0,0,0|2,0,0]=4 19466 B12R1.374 Nc1ccc(cc1SCCO)Cl 62a_100000761889_100000211926 [0,2,0,0,0,0|2,0,0]=4 19467 B12R1.374 Nc1ccc(cc1SCCO)F 62a_100000211926_100000760547 [0,2,0,0,0,0|2,0,0]=4 19468 B12R1.374 Nc1ccc(cc1SCCO)F 62a_100000760547_100000211926 [0,2,0,0,0,0|2,0,0]=4 19469 B12R1.374 Nc1ccc(cc1SCCO)O 62a_100000211926_100012001276 [0,2,0,0,0,0|2,0,0]=4 19470 B12R1.374 Nc1ccc(cc1SCCO)O 62a_100012001276_100000211926 [0,2,0,0,0,0|2,0,0]=4 19471 B12R1.374 O=CCNc1cc(ccc1O)Br 34a_100000752626_200009817547 [0,2,0,0,0,0|1,0,1]=4 19472 B12R1.374 O=CCNc1cc(ccc1O)Cl 34a_100000210500_200009817547 [0,2,0,0,0,0|1,0,1]=4 19473 B12R1.374 O=CCNc1cc(ccc1O)F 34a_100000759472_200009817547 [0,2,0,0,0,0|1,0,1]=4 19474 B12R1.374 O=CCSc1cc(ccc1O)Br 62a_100012355227_200015260668 [0,2,0,0,0,0|1,0,1]=4 19475 B12R1.374 O=CCSc1cc(ccc1O)Br 62a_200015260668_100012355227 [0,2,0,0,0,0|1,0,1]=4 19476 B12R1.374 O=CCSc1cc(ccc1O)Cl 62a_100011356953_200015260668 [0,2,0,0,0,0|1,0,1]=4 19477 B12R1.374 O=CCSc1cc(ccc1O)Cl 62a_200015260668_100011356953 [0,2,0,0,0,0|1,0,1]=4 19478 B12R1.374 O=CCSc1cc(ccc1O)F 62a_100000211999_200015260668 [0,2,0,0,0,0|1,0,1]=4 19479 B12R1.374 O=CCSc1cc(ccc1O)F 62a_200015260668_100000211999 [0,2,0,0,0,0|1,0,1]=4 19480 B12R1.374 O=CCSc1cc(ccc1O)O 62a_200015260668_100009813629 [0,2,0,0,0,0|1,0,1]=4 19481 B12R1.374 OCCNc1cc(ccc1Br)Br 34a_100000737762_100000211926 [0,2,0,0,0,0|2,0,0]=4 19482 B12R1.374 OCCNc1cc(ccc1Br)Cl 34a_100000687073_100000211926 [0,2,0,0,0,0|2,0,0]=4 19483 B12R1.374 OCCNc1cc(ccc1Br)F 34a_100000687223_100000211926 [0,2,0,0,0,0|2,0,0]=4 19484 B12R1.374 OCCNc1cc(ccc1Br)O 34a_100011999798_100000211926 [0,2,0,0,0,0|2,0,0]=4 19485 B12R1.374 OCCNc1cc(ccc1Cl)Br 34a_100000750497_100000211926 [0,2,0,0,0,0|2,0,0]=4 19486 B12R1.374 OCCNc1cc(ccc1Cl)Cl 34a_100000184485_100000211926 [0,2,0,0,0,0|2,0,0]=4 19487 B12R1.374 OCCNc1cc(ccc1Cl)F 34a_100000751338_100000211926 [0,2,0,0,0,0|2,0,0]=4 19488 B12R1.374 OCCNc1cc(ccc1Cl)I 34a_200000761891_100000211926 [0,2,0,0,0,0|2,0,0]=4 19489 B12R1.374 OCCNc1cc(ccc1Cl)O 34a_100011934297_100000211926 [0,2,0,0,0,0|2,0,0]=4 19490 B12R1.374 OCCNc1cc(ccc1F)Br 34a_100000740924_100000211926 [0,2,0,0,0,0|2,0,0]=4 19491 B12R1.374 OCCNc1cc(ccc1F)Cl 34a_100000212115_100000211926 [0,2,0,0,0,0|2,0,0]=4 19492 B12R1.374 OCCNc1cc(ccc1F)F 34a_100000210742_100000211926 [0,2,0,0,0,0|2,0,0]=4 19493 B12R1.374 OCCNc1cc(ccc1F)I 34a_100011464823_100000211926 [0,2,0,0,0,0|2,0,0]=4 19494 B12R1.374 OCCNc1cc(ccc1F)O 34a_100012017239_100000211926 [0,2,0,0,0,0|2,0,0]=4 19495 B12R1.374 OCCNc1cc(ccc1I)Br 34a_100000743836_100000211926 [0,2,0,0,0,0|2,0,0]=4 19496 B12R1.374 OCCNc1cc(ccc1I)Cl 34a_100000761886_100000211926 [0,2,0,0,0,0|2,0,0]=4 19497 B12R1.374 OCCNc1cc(ccc1I)F 34a_100011218093_100000211926 [0,2,0,0,0,0|2,0,0]=4 19498 B12R1.374 OCCNc1cc(ccc1O)Br 34a_100000752626_100000211926 [0,2,0,0,0,0|1,0,0]=3 19499 B12R1.374 OCCNc1cc(ccc1O)Cl 34a_100000210500_100000211926 [0,2,0,0,0,0|1,0,0]=3 19500 B12R1.374 OCCNc1cc(ccc1O)F 34a_100000759472_100000211926 [0,2,0,0,0,0|1,0,0]=3 19501 B12R1.374 OCCOc1cc(ccc1Br)Br 34a_100011220040_100000211926 [0,2,0,0,0,0|2,0,0]=4 19502 B12R1.374 OCCOc1cc(ccc1Br)Br 7a_100011220040_100000211926 [0,2,0,0,0,0|2,0,0]=4 19503 B12R1.374 OCCOc1cc(ccc1Br)Cl 34a_100012339455_100000211926 [0,2,0,0,0,0|2,0,0]=4 19504 B12R1.374 OCCOc1cc(ccc1Br)Cl 7a_100012339455_100000211926 [0,2,0,0,0,0|2,0,0]=4 19505 B12R1.374 OCCOc1cc(ccc1Br)F 34a_100000690578_100000211926 [0,2,0,0,0,0|2,0,0]=4 19506 B12R1.374 OCCOc1cc(ccc1Br)F 7a_100000690578_100000211926 [0,2,0,0,0,0|2,0,0]=4 19507 B12R1.374 OCCOc1cc(ccc1Br)I 34a_100012356990_100000211926 [0,2,0,0,0,0|2,0,0]=4 19508 B12R1.374 OCCOc1cc(ccc1Br)I 7a_100012356990_100000211926 [0,2,0,0,0,0|2,0,0]=4 19509 B12R1.374 OCCOc1cc(ccc1Cl)Br 34a_100000738945_100000211926 [0,2,0,0,0,0|2,0,0]=4 19510 B12R1.374 OCCOc1cc(ccc1Cl)Br 7a_100000738945_100000211926 [0,2,0,0,0,0|2,0,0]=4 19511 B12R1.374 OCCOc1cc(ccc1Cl)Cl 34a_100000211422_100000211926 [0,2,0,0,0,0|2,0,0]=4 19512 B12R1.374 OCCOc1cc(ccc1Cl)Cl 7a_100000211422_100000211926 [0,2,0,0,0,0|2,0,0]=4 19513 B12R1.374 OCCOc1cc(ccc1Cl)F 34a_100000692107_100000211926 [0,2,0,0,0,0|2,0,0]=4 19514 B12R1.374 OCCOc1cc(ccc1Cl)F 7a_100000692107_100000211926 [0,2,0,0,0,0|2,0,0]=4 19515 B12R1.374 OCCOc1cc(ccc1Cl)I 34a_100011356854_100000211926 [0,2,0,0,0,0|2,0,0]=4 19516 B12R1.374 OCCOc1cc(ccc1Cl)I 7a_100011356854_100000211926 [0,2,0,0,0,0|2,0,0]=4 19517 B12R1.374 OCCOc1cc(ccc1F)Br 34a_100000686035_100000211926 [0,2,0,0,0,0|2,0,0]=4 19518 B12R1.374 OCCOc1cc(ccc1F)Br 7a_100000686035_100000211926 [0,2,0,0,0,0|2,0,0]=4 19519 B12R1.374 OCCOc1cc(ccc1F)Cl 34a_100000757397_100000211926 [0,2,0,0,0,0|2,0,0]=4 19520 B12R1.374 OCCOc1cc(ccc1F)Cl 7a_100000757397_100000211926 [0,2,0,0,0,0|2,0,0]=4 19521 B12R1.374 OCCOc1cc(ccc1F)F 34a_100000752141_100000211926 [0,2,0,0,0,0|2,0,0]=4 19522 B12R1.374 OCCOc1cc(ccc1F)F 7a_100000752141_100000211926 [0,2,0,0,0,0|2,0,0]=4 19523 B12R1.374 OCCOc1cc(ccc1F)I 34a_100009958187_100000211926 [0,2,0,0,0,0|2,0,0]=4 19524 B12R1.374 OCCOc1cc(ccc1F)I 7a_100009958187_100000211926 [0,2,0,0,0,0|2,0,0]=4 19525 B12R1.374 OCCOc1cc(ccc1I)Br 34a_100012344904_100000211926 [0,2,0,0,0,0|2,0,0]=4 19526 B12R1.374 OCCOc1cc(ccc1I)Br 7a_100012344904_100000211926 [0,2,0,0,0,0|2,0,0]=4 19527 B12R1.374 OCCOc1cc(ccc1I)Cl 34a_100000050036_100000211926 [0,2,0,0,0,0|2,0,0]=4 19528 B12R1.374 OCCOc1cc(ccc1I)Cl 7a_100000050036_100000211926 [0,2,0,0,0,0|2,0,0]=4 19529 B12R1.374 OCCOc1cc(ccc1I)F 34a_100010084537_100000211926 [0,2,0,0,0,0|2,0,0]=4 19530 B12R1.374 OCCOc1cc(ccc1I)F 7a_100010084537_100000211926 [0,2,0,0,0,0|2,0,0]=4 19531 B12R1.374 OCCSc1cc(ccc1Br)Br 62a_100000211926_100011483371 [0,2,0,0,0,0|2,0,0]=4 19532 B12R1.374 OCCSc1cc(ccc1Br)Br 62a_100011483371_100000211926 [0,2,0,0,0,0|2,0,0]=4 19533 B12R1.374 OCCSc1cc(ccc1Br)Cl 62a_100000211926_100012339723 [0,2,0,0,0,0|2,0,0]=4 19534 B12R1.374 OCCSc1cc(ccc1Br)Cl 62a_100012339723_100000211926 [0,2,0,0,0,0|2,0,0]=4 19535 B12R1.374 OCCSc1cc(ccc1Br)F 62a_100000211926_100011217576 [0,2,0,0,0,0|2,0,0]=4 19536 B12R1.374 OCCSc1cc(ccc1Br)F 62a_100011217576_100000211926 [0,2,0,0,0,0|2,0,0]=4 19537 B12R1.374 OCCSc1cc(ccc1Br)O 62a_100000211926_100012339312 [0,2,0,0,0,0|2,0,0]=4 19538 B12R1.374 OCCSc1cc(ccc1Br)O 62a_100012339312_100000211926 [0,2,0,0,0,0|2,0,0]=4 19539 B12R1.374 OCCSc1cc(ccc1Cl)Br 62a_100000211926_100011772130 [0,2,0,0,0,0|2,0,0]=4 19540 B12R1.374 OCCSc1cc(ccc1Cl)Br 62a_100011772130_100000211926 [0,2,0,0,0,0|2,0,0]=4 19541 B12R1.374 OCCSc1cc(ccc1Cl)Cl 62a_100000211926_100000707729 [0,2,0,0,0,0|2,0,0]=4 19542 B12R1.374 OCCSc1cc(ccc1Cl)Cl 62a_100000707729_100000211926 [0,2,0,0,0,0|2,0,0]=4 19543 B12R1.374 OCCSc1cc(ccc1Cl)F 62a_100000211926_100011217299 [0,2,0,0,0,0|2,0,0]=4 19544 B12R1.374 OCCSc1cc(ccc1Cl)F 62a_100011217299_100000211926 [0,2,0,0,0,0|2,0,0]=4 19545 B12R1.374 OCCSc1cc(ccc1Cl)O 62a_100000049588_100000211926 [0,2,0,0,0,0|2,0,0]=4 19546 B12R1.374 OCCSc1cc(ccc1Cl)O 62a_100000211926_100000049588 [0,2,0,0,0,0|2,0,0]=4 19547 B12R1.374 OCCSc1cc(ccc1F)Br 62a_100000211926_100011217312 [0,2,0,0,0,0|2,0,0]=4 19548 B12R1.374 OCCSc1cc(ccc1F)Br 62a_100011217312_100000211926 [0,2,0,0,0,0|2,0,0]=4 19549 B12R1.374 OCCSc1cc(ccc1F)Cl 62a_100000211926_100011218116 [0,2,0,0,0,0|2,0,0]=4 19550 B12R1.374 OCCSc1cc(ccc1F)Cl 62a_100011218116_100000211926 [0,2,0,0,0,0|2,0,0]=4 19551 B12R1.374 OCCSc1cc(ccc1F)F 62a_100000211926_100011219198 [0,2,0,0,0,0|2,0,0]=4 19552 B12R1.374 OCCSc1cc(ccc1F)F 62a_100011219198_100000211926 [0,2,0,0,0,0|2,0,0]=4 19553 B12R1.374 OCCSc1cc(ccc1F)O 62a_100000211926_100000693481 [0,2,0,0,0,0|2,0,0]=4 19554 B12R1.374 OCCSc1cc(ccc1F)O 62a_100000693481_100000211926 [0,2,0,0,0,0|2,0,0]=4 19555 B12R1.374 OCCSc1cc(ccc1O)Br 62a_100000211926_100012355227 [0,2,0,0,0,0|1,0,0]=3 19556 B12R1.374 OCCSc1cc(ccc1O)Br 62a_100012355227_100000211926 [0,2,0,0,0,0|1,0,0]=3 19557 B12R1.374 OCCSc1cc(ccc1O)Cl 62a_100000211926_100011356953 [0,2,0,0,0,0|1,0,0]=3 19558 B12R1.374 OCCSc1cc(ccc1O)Cl 62a_100011356953_100000211926 [0,2,0,0,0,0|1,0,0]=3 19559 B12R1.374 OCCSc1cc(ccc1O)F 62a_100000211926_100000211999 [0,2,0,0,0,0|1,0,0]=3 19560 B12R1.374 OCCSc1cc(ccc1O)F 62a_100000211999_100000211926 [0,2,0,0,0,0|1,0,0]=3 19561 B12R1.374 OCCSc1cc(ccc1O)O 62a_100000211926_100009813629 [0,2,0,0,0,0|1,0,0]=3 19562 B12R1.374 OCCSc1cc(cnc1O)Br 62a_100000211926_100010197142 [0,2,0,0,0,0|2,0,0]=4 19563 B12R1.374 OCCSc1cc(cnc1O)Br 62a_100010197142_100000211926 [0,2,0,0,0,0|2,0,0]=4 19564 B12R1.374 OCCSc1cc(cnc1O)Cl 62a_100000211926_100010188700 [0,2,0,0,0,0|2,0,0]=4 19565 B12R1.374 OCCSc1cc(cnc1O)Cl 62a_100010188700_100000211926 [0,2,0,0,0,0|2,0,0]=4 19566 B12R1.374 OCCSc1cc(ncc1O)Cl 62a_100000211926_100000698892 [0,2,0,0,0,0|2,0,0]=4 19567 B12R1.374 OCCSc1cc(ncc1O)Cl 62a_100000698892_100000211926 [0,2,0,0,0,0|2,0,0]=4 19568 B12R1.374 OCCSc1nc(ccc1O)Br 62a_100000211926_100010253912 [0,2,0,0,0,0|2,0,0]=4 19569 B12R1.374 OCCSc1nc(ccc1O)Br 62a_100010253912_100000211926 [0,2,0,0,0,0|2,0,0]=4 19570 B12R1.374 OCCSc1nc(ccc1O)Cl 62a_100000211926_100000696390 [0,2,0,0,0,0|2,0,0]=4 19571 B12R1.374 OCCSc1nc(ccc1O)F 62a_100000211926_100010382442 [0,2,0,0,0,0|2,0,0]=4 19572 B12R1.374 OCCSc1nc(ccc1O)F 62a_100010382442_100000211926 [0,2,0,0,0,0|2,0,0]=4 19573 B12R1.374 Oc1ccc(c(c1)NCCF)Br 34a_100011999798_100011217306 [0,2,0,0,0,0|2,0,0]=4 19574 B12R1.374 Oc1ccc(c(c1)NCCF)Cl 34a_100011934297_100011217306 [0,2,0,0,0,0|2,0,0]=4 19575 B12R1.374 Oc1ccc(c(c1)NCCF)F 34a_100012017239_100011217306 [0,2,0,0,0,0|2,0,0]=4 19576 B12R1.374 Oc1ccc(c(c1)SCCF)Br 62a_100011217306_100012339312 [0,2,0,0,0,0|2,0,0]=4 19577 B12R1.374 Oc1ccc(c(c1)SCCF)Br 62a_100012339312_100011217306 [0,2,0,0,0,0|2,0,0]=4 19578 B12R1.374 Oc1ccc(c(c1)SCCF)Cl 62a_100000049588_100011217306 [0,2,0,0,0,0|2,0,0]=4 19579 B12R1.374 Oc1ccc(c(c1)SCCF)Cl 62a_100011217306_100000049588 [0,2,0,0,0,0|2,0,0]=4 19580 B12R1.374 Oc1ccc(c(c1)SCCF)F 62a_100000693481_100011217306 [0,2,0,0,0,0|2,0,0]=4 19581 B12R1.374 Oc1ccc(c(c1)SCCF)F 62a_100011217306_100000693481 [0,2,0,0,0,0|2,0,0]=4 19582 B12R1.374 Oc1ccc(c(c1)SCCF)O 62a_100011217306_100009813629 [0,2,0,0,0,0|1,0,0]=3 19583 B12R1.374 Oc1ccc(cc1CNCF)Br 34a_100000730032_100015361967 [0,2,0,0,0,0|1,0,0]=3 19584 B12R1.374 Oc1ccc(cc1CNCF)Cl 34a_100000238540_100015361967 [0,2,0,0,0,0|1,0,0]=3 19585 B12R1.374 Oc1ccc(cc1CSCF)F 62a_100010161318_100015361967 [0,2,0,0,0,0|1,0,0]=3 19586 B12R1.374 Oc1ccc(cc1CSCF)F 62a_100015361967_100010161318 [0,2,0,0,0,0|1,0,0]=3 19587 B12R1.374 Oc1ccc(cc1NCCF)Br 34a_100000752626_100011217306 [0,2,0,0,0,0|1,0,0]=3 19588 B12R1.374 Oc1ccc(cc1NCCF)Cl 34a_100000210500_100011217306 [0,2,0,0,0,0|1,0,0]=3 19589 B12R1.374 Oc1ccc(cc1NCCF)F 34a_100000759472_100011217306 [0,2,0,0,0,0|1,0,0]=3 19590 B12R1.374 Oc1ccc(cc1SCCF)Br 62a_100011217306_100012355227 [0,2,0,0,0,0|1,0,0]=3 19591 B12R1.374 Oc1ccc(cc1SCCF)Br 62a_100012355227_100011217306 [0,2,0,0,0,0|1,0,0]=3 19592 B12R1.374 Oc1ccc(cc1SCCF)Cl 62a_100011217306_100011356953 [0,2,0,0,0,0|1,0,0]=3 19593 B12R1.374 Oc1ccc(cc1SCCF)Cl 62a_100011356953_100011217306 [0,2,0,0,0,0|1,0,0]=3 19594 B12R1.374 Oc1ccc(cc1SCCF)F 62a_100000211999_100011217306 [0,2,0,0,0,0|1,0,0]=3 19595 B12R1.374 Oc1ccc(cc1SCCF)F 62a_100011217306_100000211999 [0,2,0,0,0,0|1,0,0]=3 19596 B12R1.374 Oc1ccc(nc1SCCF)Br 62a_100010253912_100011217306 [0,2,0,0,0,0|2,0,0]=4 19597 B12R1.374 Oc1ccc(nc1SCCF)Br 62a_100011217306_100010253912 [0,2,0,0,0,0|2,0,0]=4 19598 B12R1.374 Oc1ccc(nc1SCCF)Cl 62a_100011217306_100000696390 [0,2,0,0,0,0|2,0,0]=4 19599 B12R1.374 Oc1ccc(nc1SCCF)F 62a_100010382442_100011217306 [0,2,0,0,0,0|2,0,0]=4 19600 B12R1.374 Oc1ccc(nc1SCCF)F 62a_100011217306_100010382442 [0,2,0,0,0,0|2,0,0]=4 19601 B12R1.374 Oc1cnc(cc1SCCF)Cl 62a_100000698892_100011217306 [0,2,0,0,0,0|2,0,0]=4 19602 B12R1.374 Oc1cnc(cc1SCCF)Cl 62a_100011217306_100000698892 [0,2,0,0,0,0|2,0,0]=4 19603 B12R1.374 Oc1ncc(cc1SCCF)Br 62a_100010197142_100011217306 [0,2,0,0,0,0|2,0,0]=4 19604 B12R1.374 Oc1ncc(cc1SCCF)Br 62a_100011217306_100010197142 [0,2,0,0,0,0|2,0,0]=4 19605 B12R1.374 Oc1ncc(cc1SCCF)Cl 62a_100010188700_100011217306 [0,2,0,0,0,0|2,0,0]=4 19606 B12R1.374 Oc1ncc(cc1SCCF)Cl 62a_100011217306_100010188700 [0,2,0,0,0,0|2,0,0]=4 19607 B12R1.374 [13CH3]NCCc1cc(ccc1Cl)Cl 2230a_100000705354_200025704644 [0,2,0,0,0,0|1,0,0]=3 19608 B12R1.374 [13CH3]NCCc1cc(ccc1Cl)Cl 34a_100000705354_200025704644 [0,2,0,0,0,0|1,0,0]=3 19609 B12R1.374 [13CH3]NCCc1cc(ccc1F)Cl 2230a_200011997525_200025704644 [0,2,0,0,0,0|1,0,0]=3 19610 B12R1.374 [13CH3]NCCc1cc(ccc1F)Cl 34a_200011997525_200025704644 [0,2,0,0,0,0|1,0,0]=3 19611 B12R1.374 [13CH3]OCCc1cc(ccc1Br)Cl 34a_100012426913_200025704644 [0,2,0,0,0,0|1,0,0]=3 19612 B12R1.374 [13CH3]OCCc1cc(ccc1Br)Cl 7a_100012426913_200025704644 [0,2,0,0,0,0|1,0,0]=3 19613 B12R1.374 [13CH3]OCCc1cc(ccc1Cl)Cl 34a_100011754359_200025704644 [0,2,0,0,0,0|1,0,0]=3 19614 B12R1.374 [13CH3]OCCc1cc(ccc1Cl)Cl 7a_100011754359_200025704644 [0,2,0,0,0,0|1,0,0]=3 19615 B12R1.374 [13CH3]OCCc1cc(ccc1F)F 34a_100011755048_200025704644 [0,2,0,0,0,0|1,0,0]=3 19616 B12R1.374 [13CH3]OCCc1cc(ccc1F)F 7a_100011755048_200025704644 [0,2,0,0,0,0|1,0,0]=3 19617 B12R1.374 [13CH3]SCCc1cc(ccc1F)F 62a_100011755056_200025704644 [0,2,0,0,0,0|1,0,0]=3 19618 B12R1.374 [13CH3]SCCc1cc(ccc1F)F 62a_200025704644_100011755056 [0,2,0,0,0,0|1,0,0]=3 19619 B12R1.1631 C#CCNc1c(cccc1Br)O 34a_100011934926_100000184674 [0,2,0,0,0,0|0,0,2]=4 19620 B12R1.1631 C#CCNc1c(cccc1Cl)O 34a_100012022510_100000184674 [0,2,0,0,0,0|0,0,2]=4 19621 B12R1.1631 C#CCNc1c(cccc1F)O 34a_100020591140_100000184674 [0,2,0,0,0,0|0,0,2]=4 19622 B12R1.1631 C#CCNc1c(cccc1O)C 34a_100000743429_100000184674 [0,2,0,0,0,0|0,0,2]=4 19623 B12R1.1631 C#CCSc1c(cccc1Br)O 62a_100000038162_100010187912 [0,2,0,0,0,0|0,0,2]=4 19624 B12R1.1631 C#CCSc1c(cccc1Cl)O 62a_100000038162_100000050174 [0,2,0,0,0,0|0,0,2]=4 19625 B12R1.1631 C#CCSc1c(cccc1F)O 62a_100000038162_100009820682 [0,2,0,0,0,0|0,0,2]=4 19626 B12R1.1631 C#CCSc1c(cccc1O)C 62a_100000038162_100000686692 [0,2,0,0,0,0|0,0,2]=4 19627 B12R1.1631 C#CCSc1c(cccc1O)N 62a_100000038162_100012183704 [0,2,0,0,0,0|0,0,2]=4 19628 B12R1.1631 C#CCSc1c(cccc1O)O 62a_100000038162_100010205330 [0,2,0,0,0,0|0,0,2]=4 19629 B12R1.1631 C=CCNc1c(cccc1Br)O 34a_100011934926_100015514636 [0,2,0,0,0,0|0,0,2]=4 19630 B12R1.1631 C=CCNc1c(cccc1Cl)O 34a_100012022510_100015514636 [0,2,0,0,0,0|0,0,2]=4 19631 B12R1.1631 C=CCNc1c(cccc1F)O 34a_100020591140_100015514636 [0,2,0,0,0,0|0,0,2]=4 19632 B12R1.1631 C=CCNc1c(cccc1O)C 34a_100000743429_100015514636 [0,2,0,0,0,0|0,0,2]=4 19633 B12R1.1631 C=CCSc1c(cccc1Br)O 62a_100000210623_100010187912 [0,2,0,0,0,0|0,0,2]=4 19634 B12R1.1631 C=CCSc1c(cccc1Br)O 62a_100010187912_100000210623 [0,2,0,0,0,0|0,0,2]=4 19635 B12R1.1631 C=CCSc1c(cccc1Cl)O 62a_100000210623_100000050174 [0,2,0,0,0,0|0,0,2]=4 19636 B12R1.1631 C=CCSc1c(cccc1F)O 62a_100000210623_100009820682 [0,2,0,0,0,0|0,0,2]=4 19637 B12R1.1631 C=CCSc1c(cccc1F)O 62a_100009820682_100000210623 [0,2,0,0,0,0|0,0,2]=4 19638 B12R1.1631 C=CCSc1c(cccc1O)C 62a_100000210623_100000686692 [0,2,0,0,0,0|0,0,2]=4 19639 B12R1.1631 C=CCSc1c(cccc1O)C 62a_100000686692_100000210623 [0,2,0,0,0,0|0,0,2]=4 19640 B12R1.1631 C=CCSc1c(cccc1O)N 62a_100000210623_100012183704 [0,2,0,0,0,0|0,0,2]=4 19641 B12R1.1631 C=CCSc1c(cccc1O)N 62a_100012183704_100000210623 [0,2,0,0,0,0|0,0,2]=4 19642 B12R1.1631 C=CCSc1c(cccc1O)O 62a_100000210623_100010205330 [0,2,0,0,0,0|0,0,2]=4 19643 B12R1.1631 CCCCc1c(ccc[n+]1[O-])C 271570a_100020621405_100116209805 [0,2,0,0,0,0|1,0,1]=4 19644 B12R1.1631 CCCCc1c(cccc1Br)Br 271570a_100020621405_100009994525 [0,2,0,0,0,0|1,0,0]=3 19645 B12R1.1631 CCCCc1c(cccc1Br)Cl 271570a_100020621405_100010214488 [0,2,0,0,0,0|1,0,0]=3 19646 B12R1.1631 CCCCc1c(cccc1Br)F 271570a_100020621405_100011219512 [0,2,0,0,0,0|1,0,0]=3 19647 B12R1.1631 CCCCc1c(cccc1Br)N 271570a_100020621405_100020590159 [0,2,0,0,0,0|1,0,0]=3 19648 B12R1.1631 CCCCc1c(cccc1Br)O 271570a_100020621405_100010187912 [0,2,0,0,0,0|0,0,0]=2 19649 B12R1.1631 CCCCc1c(cccc1C)C 271570a_100020621405_100000033847 [0,2,0,0,0,0|1,0,0]=3 19650 B12R1.1631 CCCCc1c(cccc1Cl)C 271570a_100020621405_100000043165 [0,2,0,0,0,0|1,0,0]=3 19651 B12R1.1631 CCCCc1c(cccc1Cl)Cl 271570a_100020621405_100000034237 [0,2,0,0,0,0|1,0,0]=3 19652 B12R1.1631 CCCCc1c(cccc1Cl)F 271570a_100020621405_100000050007 [0,2,0,0,0,0|1,0,0]=3 19653 B12R1.1631 CCCCc1c(cccc1Cl)N 271570a_100020621405_100000049713 [0,2,0,0,0,0|1,0,0]=3 19654 B12R1.1631 CCCCc1c(cccc1Cl)O 271570a_100020621405_100000050174 [0,2,0,0,0,0|0,0,0]=2 19655 B12R1.1631 CCCCc1c(cccc1F)C 271570a_100020621405_100012349962 [0,2,0,0,0,0|1,0,0]=3 19656 B12R1.1631 CCCCc1c(cccc1F)F 271570a_100020621405_100000693133 [0,2,0,0,0,0|1,0,0]=3 19657 B12R1.1631 CCCCc1c(cccc1F)N 271570a_100020621405_100011934729 [0,2,0,0,0,0|1,0,0]=3 19658 B12R1.1631 CCCCc1c(cccc1F)O 271570a_100020621405_100009820682 [0,2,0,0,0,0|0,0,0]=2 19659 B12R1.1631 CCCCc1c(cccc1N)C 271570a_100020621405_100000684715 [0,2,0,0,0,0|1,0,0]=3 19660 B12R1.1631 CCCCc1c(cccc1O)C 271570a_100020621405_100000686692 [0,2,0,0,0,0|0,0,0]=2 19661 B12R1.1631 CCCCc1c(cccc1O)N 271570a_100020621405_100012183704 [0,2,0,0,0,0|0,0,0]=2 19662 B12R1.1631 CCCCc1c(cccc1O)O 271570a_100020621405_100010205330 [0,2,0,0,0,0|0,0,0]=2 19663 B12R1.1631 CCCCc1c(ccnc1C)C 271570a_100020621405_100012000501 [0,2,0,0,0,0|2,0,0]=4 19664 B12R1.1631 CCCCc1c(ccnc1C)N 271570a_100020621405_100010243816 [0,2,0,0,0,0|2,0,0]=4 19665 B12R1.1631 CCCCc1c(ccnc1F)C 271570a_100020621405_100009818256 [0,2,0,0,0,0|2,0,0]=4 19666 B12R1.1631 CCCCc1c(ccnc1F)F 271570a_100020621405_100009874084 [0,2,0,0,0,0|2,0,0]=4 19667 B12R1.1631 CCCCc1c(ccnc1F)N 271570a_100020621405_100010381272 [0,2,0,0,0,0|2,0,0]=4 19668 B12R1.1631 CCCCc1c(ccnc1N)C 271570a_100020621405_100011998619 [0,2,0,0,0,0|2,0,0]=4 19669 B12R1.1631 CCCCc1c(ccnc1N)Cl 271570a_100020621405_100010199028 [0,2,0,0,0,0|2,0,0]=4 19670 B12R1.1631 CCCCc1c(ccnc1O)C 271570a_100020621405_100012000493 [0,2,0,0,0,0|1,0,0]=3 19671 B12R1.1631 CCCCc1c(ccnc1O)O 271570a_100020621405_200009817435 [0,2,0,0,0,0|1,0,0]=3 19672 B12R1.1631 CCCCc1c(cn[nH]c1=O)O 271570a_100020621405_100000116976 [0,2,0,0,0,0|2,0,0]=4 19673 B12R1.1631 CCCCc1c(cncc1Br)Br 271570a_100020621405_100010172828 [0,2,0,0,0,0|2,0,0]=4 19674 B12R1.1631 CCCCc1c(cncc1C)C 271570a_100020621405_100009817138 [0,2,0,0,0,0|2,0,0]=4 19675 B12R1.1631 CCCCc1c(cncc1Cl)Cl 271570a_100020621405_100000036193 [0,2,0,0,0,0|2,0,0]=4 19676 B12R1.1631 CCCCc1c(cncc1F)F 271570a_100020621405_100000760538 [0,2,0,0,0,0|2,0,0]=4 19677 B12R1.1631 CCCNc1c(cccc1Br)Br 34a_100000690995_100000210303 [0,2,0,0,0,0|1,0,0]=3 19678 B12R1.1631 CCCNc1c(cccc1Br)C 34a_100011834072_100000210303 [0,2,0,0,0,0|1,0,0]=3 19679 B12R1.1631 CCCNc1c(cccc1Br)Cl 34a_100102946385_100000210303 [0,2,0,0,0,0|1,0,0]=3 19680 B12R1.1631 CCCNc1c(cccc1Br)F 34a_100000684712_100000210303 [0,2,0,0,0,0|1,0,0]=3 19681 B12R1.1631 CCCNc1c(cccc1Br)O 34a_100011934926_100000210303 [0,2,0,0,0,0|0,0,0]=2 19682 B12R1.1631 CCCNc1c(cccc1C)C 34a_100000185769_100000210303 [0,2,0,0,0,0|1,0,0]=3 19683 B12R1.1631 CCCNc1c(cccc1Cl)C 34a_100000756524_100000210303 [0,2,0,0,0,0|1,0,0]=3 19684 B12R1.1631 CCCNc1c(cccc1Cl)Cl 34a_100000210028_100000210303 [0,2,0,0,0,0|1,0,0]=3 19685 B12R1.1631 CCCNc1c(cccc1Cl)F 34a_100000760031_100000210303 [0,2,0,0,0,0|1,0,0]=3 19686 B12R1.1631 CCCNc1c(cccc1Cl)O 34a_100012022510_100000210303 [0,2,0,0,0,0|0,0,0]=2 19687 B12R1.1631 CCCNc1c(cccc1F)C 34a_100000766463_100000210303 [0,2,0,0,0,0|1,0,0]=3 19688 B12R1.1631 CCCNc1c(cccc1F)F 2230a_100000210704_100000210303 [0,2,0,0,0,0|1,0,0]=3 19689 B12R1.1631 CCCNc1c(cccc1F)F 34a_100000210704_100000210303 [0,2,0,0,0,0|1,0,0]=3 19690 B12R1.1631 CCCNc1c(cccc1F)O 34a_100020591140_100000210303 [0,2,0,0,0,0|0,0,0]=2 19691 B12R1.1631 CCCNc1c(cccc1I)F 34a_100000042321_100000210303 [0,2,0,0,0,0|1,0,0]=3 19692 B12R1.1631 CCCNc1c(cccc1O)C 34a_100000743429_100000210303 [0,2,0,0,0,0|0,0,0]=2 19693 B12R1.1631 CCCOc1c(cccc1Br)Br 34a_100000736428_100000210303 [0,2,0,0,0,0|1,0,0]=3 19694 B12R1.1631 CCCOc1c(cccc1Br)Br 7a_100000736428_100000210303 [0,2,0,0,0,0|1,0,0]=3 19695 B12R1.1631 CCCOc1c(cccc1Br)C 34a_100009817157_100000210303 [0,2,0,0,0,0|1,0,0]=3 19696 B12R1.1631 CCCOc1c(cccc1Br)C 7a_100009817157_100000210303 [0,2,0,0,0,0|1,0,0]=3 19697 B12R1.1631 CCCOc1c(cccc1Br)Cl 34a_100010214474_100000210303 [0,2,0,0,0,0|1,0,0]=3 19698 B12R1.1631 CCCOc1c(cccc1Br)Cl 7a_100010214474_100000210303 [0,2,0,0,0,0|1,0,0]=3 19699 B12R1.1631 CCCOc1c(cccc1Br)F 34a_100009813666_100000210303 [0,2,0,0,0,0|1,0,0]=3 19700 B12R1.1631 CCCOc1c(cccc1Br)F 7a_100009813666_100000210303 [0,2,0,0,0,0|1,0,0]=3 19701 B12R1.1631 CCCOc1c(cccc1Br)N 34a_100011934915_100000210303 [0,2,0,0,0,0|1,0,0]=3 19702 B12R1.1631 CCCOc1c(cccc1C)C 34a_100000210341_100000210303 [0,2,0,0,0,0|1,0,0]=3 19703 B12R1.1631 CCCOc1c(cccc1C)C 7a_100000210341_100000210303 [0,2,0,0,0,0|1,0,0]=3 19704 B12R1.1631 CCCOc1c(cccc1Cl)C 34a_100000033731_100000210303 [0,2,0,0,0,0|1,0,0]=3 19705 B12R1.1631 CCCOc1c(cccc1Cl)C 7a_100000033731_100000210303 [0,2,0,0,0,0|1,0,0]=3 19706 B12R1.1631 CCCOc1c(cccc1Cl)Cl 34a_100000211709_100000210303 [0,2,0,0,0,0|1,0,0]=3 19707 B12R1.1631 CCCOc1c(cccc1Cl)Cl 7a_100000211709_100000210303 [0,2,0,0,0,0|1,0,0]=3 19708 B12R1.1631 CCCOc1c(cccc1Cl)F 34a_100000694953_100000210303 [0,2,0,0,0,0|1,0,0]=3 19709 B12R1.1631 CCCOc1c(cccc1Cl)F 7a_100000694953_100000210303 [0,2,0,0,0,0|1,0,0]=3 19710 B12R1.1631 CCCOc1c(cccc1Cl)N 34a_100000754742_100000210303 [0,2,0,0,0,0|1,0,0]=3 19711 B12R1.1631 CCCOc1c(cccc1F)C 34a_100011659162_100000210303 [0,2,0,0,0,0|1,0,0]=3 19712 B12R1.1631 CCCOc1c(cccc1F)C 7a_100011659162_100000210303 [0,2,0,0,0,0|1,0,0]=3 19713 B12R1.1631 CCCOc1c(cccc1F)F 34a_100000230165_100000210303 [0,2,0,0,0,0|1,0,0]=3 19714 B12R1.1631 CCCOc1c(cccc1F)F 7a_100000230165_100000210303 [0,2,0,0,0,0|1,0,0]=3 19715 B12R1.1631 CCCOc1c(cccc1F)N 34a_100011934987_100000210303 [0,2,0,0,0,0|1,0,0]=3 19716 B12R1.1631 CCCOc1c(cccc1I)Br 34a_100010084509_100000210303 [0,2,0,0,0,0|1,0,0]=3 19717 B12R1.1631 CCCOc1c(cccc1I)Br 7a_100010084509_100000210303 [0,2,0,0,0,0|1,0,0]=3 19718 B12R1.1631 CCCOc1c(cccc1I)Cl 34a_100010202889_100000210303 [0,2,0,0,0,0|1,0,0]=3 19719 B12R1.1631 CCCOc1c(cccc1I)Cl 7a_100010202889_100000210303 [0,2,0,0,0,0|1,0,0]=3 19720 B12R1.1631 CCCOc1c(cccc1I)F 34a_100010186298_100000210303 [0,2,0,0,0,0|1,0,0]=3 19721 B12R1.1631 CCCOc1c(cccc1I)F 7a_100010186298_100000210303 [0,2,0,0,0,0|1,0,0]=3 19722 B12R1.1631 CCCOc1c(cccc1I)N 34a_100010084371_100000210303 [0,2,0,0,0,0|1,0,0]=3 19723 B12R1.1631 CCCOc1c(cccc1N)C 34a_100000756359_100000210303 [0,2,0,0,0,0|1,0,0]=3 19724 B12R1.1631 CCCOc1c(cccc1N)C 7a_100000756359_100000210303 [0,2,0,0,0,0|1,0,0]=3 19725 B12R1.1631 CCCOc1c(cccc1N)N 34a_200016994477_100000210303 [0,2,0,0,0,0|1,0,0]=3 19726 B12R1.1631 CCCOc1c(ccnc1C)C 34a_100011934651_100000210303 [0,2,0,0,0,0|2,0,0]=4 19727 B12R1.1631 CCCOc1c(ccnc1C)C 7a_100011934651_100000210303 [0,2,0,0,0,0|2,0,0]=4 19728 B12R1.1631 CCCOc1c(ccnc1Cl)C 34a_100000696282_100000210303 [0,2,0,0,0,0|2,0,0]=4 19729 B12R1.1631 CCCOc1c(ccnc1Cl)C 7a_100000696282_100000210303 [0,2,0,0,0,0|2,0,0]=4 19730 B12R1.1631 CCCOc1c(ccnc1Cl)Cl 34a_100000118450_100000210303 [0,2,0,0,0,0|2,0,0]=4 19731 B12R1.1631 CCCOc1c(ccnc1Cl)Cl 7a_100000118450_100000210303 [0,2,0,0,0,0|2,0,0]=4 19732 B12R1.1631 CCCOc1c(ccnc1Cl)F 34a_100009867227_100000210303 [0,2,0,0,0,0|2,0,0]=4 19733 B12R1.1631 CCCOc1c(ccnc1Cl)F 7a_100009867227_100000210303 [0,2,0,0,0,0|2,0,0]=4 19734 B12R1.1631 CCCOc1c(ccnc1Cl)I 34a_100010067911_100000210303 [0,2,0,0,0,0|2,0,0]=4 19735 B12R1.1631 CCCOc1c(ccnc1Cl)I 7a_100010067911_100000210303 [0,2,0,0,0,0|2,0,0]=4 19736 B12R1.1631 CCCOc1c(ccnc1Cl)N 34a_100009844647_100000210303 [0,2,0,0,0,0|2,0,0]=4 19737 B12R1.1631 CCCOc1c(ccnc1Cl)N 7a_100009844647_100000210303 [0,2,0,0,0,0|2,0,0]=4 19738 B12R1.1631 CCCOc1c(occc1=O)C 34a_100000031901_100000210303 [0,2,0,0,0,0|1,0,1]=4 19739 B12R1.1631 CCCSc1c(ccc[n+]1[O-])C 62a_100000210303_100116209805 [0,2,0,0,0,0|1,0,1]=4 19740 B12R1.1631 CCCSc1c(cccc1Br)Br 62a_100000210303_100009994525 [0,2,0,0,0,0|1,0,0]=3 19741 B12R1.1631 CCCSc1c(cccc1Br)Br 62a_100009994525_100000210303 [0,2,0,0,0,0|1,0,0]=3 19742 B12R1.1631 CCCSc1c(cccc1Br)C 62a_100000210303_100010141302 [0,2,0,0,0,0|1,0,0]=3 19743 B12R1.1631 CCCSc1c(cccc1Br)C 62a_100010141302_100000210303 [0,2,0,0,0,0|1,0,0]=3 19744 B12R1.1631 CCCSc1c(cccc1Br)Cl 62a_100000210303_100010214488 [0,2,0,0,0,0|1,0,0]=3 19745 B12R1.1631 CCCSc1c(cccc1Br)Cl 62a_100010214488_100000210303 [0,2,0,0,0,0|1,0,0]=3 19746 B12R1.1631 CCCSc1c(cccc1Br)F 62a_100000210303_100011219512 [0,2,0,0,0,0|1,0,0]=3 19747 B12R1.1631 CCCSc1c(cccc1Br)F 62a_100011219512_100000210303 [0,2,0,0,0,0|1,0,0]=3 19748 B12R1.1631 CCCSc1c(cccc1Br)N 62a_100000210303_100020590159 [0,2,0,0,0,0|1,0,0]=3 19749 B12R1.1631 CCCSc1c(cccc1Br)N 62a_100020590159_100000210303 [0,2,0,0,0,0|1,0,0]=3 19750 B12R1.1631 CCCSc1c(cccc1Br)O 62a_100000210303_100010187912 [0,2,0,0,0,0|0,0,0]=2 19751 B12R1.1631 CCCSc1c(cccc1Br)O 62a_100010187912_100000210303 [0,2,0,0,0,0|0,0,0]=2 19752 B12R1.1631 CCCSc1c(cccc1C)C 62a_100000033847_100000210303 [0,2,0,0,0,0|1,0,0]=3 19753 B12R1.1631 CCCSc1c(cccc1C)C 62a_100000210303_100000033847 [0,2,0,0,0,0|1,0,0]=3 19754 B12R1.1631 CCCSc1c(cccc1Cl)C 62a_100000043165_100000210303 [0,2,0,0,0,0|1,0,0]=3 19755 B12R1.1631 CCCSc1c(cccc1Cl)C 62a_100000210303_100000043165 [0,2,0,0,0,0|1,0,0]=3 19756 B12R1.1631 CCCSc1c(cccc1Cl)Cl 62a_100000034237_100000210303 [0,2,0,0,0,0|1,0,0]=3 19757 B12R1.1631 CCCSc1c(cccc1Cl)Cl 62a_100000210303_100000034237 [0,2,0,0,0,0|1,0,0]=3 19758 B12R1.1631 CCCSc1c(cccc1Cl)F 62a_100000050007_100000210303 [0,2,0,0,0,0|1,0,0]=3 19759 B12R1.1631 CCCSc1c(cccc1Cl)F 62a_100000210303_100000050007 [0,2,0,0,0,0|1,0,0]=3 19760 B12R1.1631 CCCSc1c(cccc1Cl)N 62a_100000049713_100000210303 [0,2,0,0,0,0|1,0,0]=3 19761 B12R1.1631 CCCSc1c(cccc1Cl)N 62a_100000210303_100000049713 [0,2,0,0,0,0|1,0,0]=3 19762 B12R1.1631 CCCSc1c(cccc1Cl)O 62a_100000210303_100000050174 [0,2,0,0,0,0|0,0,0]=2 19763 B12R1.1631 CCCSc1c(cccc1F)C 62a_100000210303_100011218421 [0,2,0,0,0,0|1,0,0]=3 19764 B12R1.1631 CCCSc1c(cccc1F)C 62a_100011218421_100000210303 [0,2,0,0,0,0|1,0,0]=3 19765 B12R1.1631 CCCSc1c(cccc1F)F 62a_100000210303_100000693133 [0,2,0,0,0,0|1,0,0]=3 19766 B12R1.1631 CCCSc1c(cccc1F)F 62a_100000693133_100000210303 [0,2,0,0,0,0|1,0,0]=3 19767 B12R1.1631 CCCSc1c(cccc1F)N 62a_100000210303_100000690935 [0,2,0,0,0,0|1,0,0]=3 19768 B12R1.1631 CCCSc1c(cccc1F)N 62a_100000690935_100000210303 [0,2,0,0,0,0|1,0,0]=3 19769 B12R1.1631 CCCSc1c(cccc1F)O 62a_100000210303_100009820682 [0,2,0,0,0,0|0,0,0]=2 19770 B12R1.1631 CCCSc1c(cccc1F)O 62a_100009820682_100000210303 [0,2,0,0,0,0|0,0,0]=2 19771 B12R1.1631 CCCSc1c(cccc1N)C 62a_100000210303_100000684715 [0,2,0,0,0,0|1,0,0]=3 19772 B12R1.1631 CCCSc1c(cccc1N)C 62a_100000684715_100000210303 [0,2,0,0,0,0|1,0,0]=3 19773 B12R1.1631 CCCSc1c(cccc1O)C 62a_100000210303_100000686692 [0,2,0,0,0,0|0,0,0]=2 19774 B12R1.1631 CCCSc1c(cccc1O)C 62a_100000686692_100000210303 [0,2,0,0,0,0|0,0,0]=2 19775 B12R1.1631 CCCSc1c(cccc1O)N 62a_100000210303_100012183704 [0,2,0,0,0,0|0,0,0]=2 19776 B12R1.1631 CCCSc1c(cccc1O)N 62a_100012183704_100000210303 [0,2,0,0,0,0|0,0,0]=2 19777 B12R1.1631 CCCSc1c(cccc1O)O 62a_100000210303_100010205330 [0,2,0,0,0,0|0,0,0]=2 19778 B12R1.1631 CCCSc1c(ccnc1C)C 62a_100000210303_100012000501 [0,2,0,0,0,0|2,0,0]=4 19779 B12R1.1631 CCCSc1c(ccnc1C)C 62a_100012000501_100000210303 [0,2,0,0,0,0|2,0,0]=4 19780 B12R1.1631 CCCSc1c(ccnc1C)N 62a_100000210303_100010243816 [0,2,0,0,0,0|2,0,0]=4 19781 B12R1.1631 CCCSc1c(ccnc1C)N 62a_100010243816_100000210303 [0,2,0,0,0,0|2,0,0]=4 19782 B12R1.1631 CCCSc1c(ccnc1Cl)Br 62a_100000210303_100009814607 [0,2,0,0,0,0|2,0,0]=4 19783 B12R1.1631 CCCSc1c(ccnc1Cl)Br 62a_100009814607_100000210303 [0,2,0,0,0,0|2,0,0]=4 19784 B12R1.1631 CCCSc1c(ccnc1Cl)C 62a_100000210303_100010248874 [0,2,0,0,0,0|2,0,0]=4 19785 B12R1.1631 CCCSc1c(ccnc1Cl)C 62a_100010248874_100000210303 [0,2,0,0,0,0|2,0,0]=4 19786 B12R1.1631 CCCSc1c(ccnc1Cl)Cl 62a_100000050019_100000210303 [0,2,0,0,0,0|2,0,0]=4 19787 B12R1.1631 CCCSc1c(ccnc1Cl)Cl 62a_100000210303_100000050019 [0,2,0,0,0,0|2,0,0]=4 19788 B12R1.1631 CCCSc1c(ccnc1Cl)F 62a_100000210303_100000716511 [0,2,0,0,0,0|2,0,0]=4 19789 B12R1.1631 CCCSc1c(ccnc1Cl)F 62a_100000716511_100000210303 [0,2,0,0,0,0|2,0,0]=4 19790 B12R1.1631 CCCSc1c(ccnc1Cl)N 62a_100000210303_100010208016 [0,2,0,0,0,0|2,0,0]=4 19791 B12R1.1631 CCCSc1c(ccnc1Cl)N 62a_100010208016_100000210303 [0,2,0,0,0,0|2,0,0]=4 19792 B12R1.1631 CCCSc1c(ccnc1F)C 62a_100000210303_100009818256 [0,2,0,0,0,0|2,0,0]=4 19793 B12R1.1631 CCCSc1c(ccnc1F)C 62a_100009818256_100000210303 [0,2,0,0,0,0|2,0,0]=4 19794 B12R1.1631 CCCSc1c(ccnc1F)F 62a_100000210303_100009874084 [0,2,0,0,0,0|2,0,0]=4 19795 B12R1.1631 CCCSc1c(ccnc1F)F 62a_100009874084_100000210303 [0,2,0,0,0,0|2,0,0]=4 19796 B12R1.1631 CCCSc1c(ccnc1F)N 62a_100000210303_100010381272 [0,2,0,0,0,0|2,0,0]=4 19797 B12R1.1631 CCCSc1c(ccnc1F)N 62a_100010381272_100000210303 [0,2,0,0,0,0|2,0,0]=4 19798 B12R1.1631 CCCSc1c(ccnc1N)C 62a_100000210303_100011998619 [0,2,0,0,0,0|2,0,0]=4 19799 B12R1.1631 CCCSc1c(ccnc1N)C 62a_100011998619_100000210303 [0,2,0,0,0,0|2,0,0]=4 19800 B12R1.1631 CCCSc1c(ccnc1N)Cl 62a_100000210303_100010199028 [0,2,0,0,0,0|2,0,0]=4 19801 B12R1.1631 CCCSc1c(ccnc1N)Cl 62a_100010199028_100000210303 [0,2,0,0,0,0|2,0,0]=4 19802 B12R1.1631 CCCSc1c(ccnc1O)C 62a_100000210303_100012000493 [0,2,0,0,0,0|1,0,0]=3 19803 B12R1.1631 CCCSc1c(ccnc1O)C 62a_100012000493_100000210303 [0,2,0,0,0,0|1,0,0]=3 19804 B12R1.1631 CCCSc1c(ccnc1O)O 62a_100000210303_200009817435 [0,2,0,0,0,0|1,0,0]=3 19805 B12R1.1631 CCCSc1c(cn[nH]c1=O)O 62a_100000210303_100000116976 [0,2,0,0,0,0|2,0,0]=4 19806 B12R1.1631 CCCSc1c(cncc1Br)Br 62a_100000210303_100010172828 [0,2,0,0,0,0|2,0,0]=4 19807 B12R1.1631 CCCSc1c(cncc1Br)Br 62a_100010172828_100000210303 [0,2,0,0,0,0|2,0,0]=4 19808 B12R1.1631 CCCSc1c(cncc1C)C 62a_100000210303_100009817138 [0,2,0,0,0,0|2,0,0]=4 19809 B12R1.1631 CCCSc1c(cncc1C)C 62a_100009817138_100000210303 [0,2,0,0,0,0|2,0,0]=4 19810 B12R1.1631 CCCSc1c(cncc1Cl)Cl 62a_100000036193_100000210303 [0,2,0,0,0,0|2,0,0]=4 19811 B12R1.1631 CCCSc1c(cncc1Cl)Cl 62a_100000210303_100000036193 [0,2,0,0,0,0|2,0,0]=4 19812 B12R1.1631 CCCSc1c(cncc1F)F 62a_100000210303_100000760538 [0,2,0,0,0,0|2,0,0]=4 19813 B12R1.1631 CCCSc1c(cncc1F)F 62a_100000760538_100000210303 [0,2,0,0,0,0|2,0,0]=4 19814 B12R1.1631 CCCSc1c(ncnc1O)O 62a_100000210303_100000006518 [0,2,0,0,0,0|2,0,0]=4 19815 B12R1.1631 CCNCc1c(cccc1Br)Br 207a_100015525214_100010233043 [0,2,0,0,0,0|1,0,0]=3 19816 B12R1.1631 CCNCc1c(cccc1Br)Br 270004a_100015525214_100010233043 [0,2,0,0,0,0|1,0,0]=3 19817 B12R1.1631 CCNCc1c(cccc1Br)C 207a_100015525214_100009881667 [0,2,0,0,0,0|1,0,0]=3 19818 B12R1.1631 CCNCc1c(cccc1Br)C 2230a_100015525214_100010146847 [0,2,0,0,0,0|1,0,0]=3 19819 B12R1.1631 CCNCc1c(cccc1Br)C 270004a_100015525214_100009881667 [0,2,0,0,0,0|1,0,0]=3 19820 B12R1.1631 CCNCc1c(cccc1Br)Cl 207a_100015525214_100011249081 [0,2,0,0,0,0|1,0,0]=3 19821 B12R1.1631 CCNCc1c(cccc1Br)Cl 2230a_100015525214_100010138402 [0,2,0,0,0,0|1,0,0]=3 19822 B12R1.1631 CCNCc1c(cccc1Br)Cl 270004a_100015525214_100011249081 [0,2,0,0,0,0|1,0,0]=3 19823 B12R1.1631 CCNCc1c(cccc1Br)F 207a_100015525214_100000752695 [0,2,0,0,0,0|1,0,0]=3 19824 B12R1.1631 CCNCc1c(cccc1Br)F 2230a_100015525214_100012145669 [0,2,0,0,0,0|1,0,0]=3 19825 B12R1.1631 CCNCc1c(cccc1Br)F 270004a_100015525214_100000752695 [0,2,0,0,0,0|1,0,0]=3 19826 B12R1.1631 CCNCc1c(cccc1Br)F 34a_100012349121_100000210202 [0,2,0,0,0,0|1,0,0]=3 19827 B12R1.1631 CCNCc1c(cccc1C)C 207a_100015525214_100000758299 [0,2,0,0,0,0|1,0,0]=3 19828 B12R1.1631 CCNCc1c(cccc1C)C 2230a_100015525214_100000758300 [0,2,0,0,0,0|1,0,0]=3 19829 B12R1.1631 CCNCc1c(cccc1C)C 270004a_100015525214_100000758299 [0,2,0,0,0,0|1,0,0]=3 19830 B12R1.1631 CCNCc1c(cccc1C)C 34a_100000689800_100000210202 [0,2,0,0,0,0|1,0,0]=3 19831 B12R1.1631 CCNCc1c(cccc1Cl)C 207a_100015525214_100000041122 [0,2,0,0,0,0|1,0,0]=3 19832 B12R1.1631 CCNCc1c(cccc1Cl)C 270004a_100015525214_100000041122 [0,2,0,0,0,0|1,0,0]=3 19833 B12R1.1631 CCNCc1c(cccc1Cl)Cl 207a_100015525214_100000189306 [0,2,0,0,0,0|1,0,0]=3 19834 B12R1.1631 CCNCc1c(cccc1Cl)Cl 2230a_100000174884_100000210202 [0,2,0,0,0,0|1,0,0]=3 19835 B12R1.1631 CCNCc1c(cccc1Cl)Cl 2230a_100015525214_100000187851 [0,2,0,0,0,0|1,0,0]=3 19836 B12R1.1631 CCNCc1c(cccc1Cl)Cl 270004a_100015525214_100000189306 [0,2,0,0,0,0|1,0,0]=3 19837 B12R1.1631 CCNCc1c(cccc1Cl)Cl 34a_100000174884_100000210202 [0,2,0,0,0,0|1,0,0]=3 19838 B12R1.1631 CCNCc1c(cccc1Cl)F 207a_100015525214_100000210083 [0,2,0,0,0,0|1,0,0]=3 19839 B12R1.1631 CCNCc1c(cccc1Cl)F 2230a_100015525214_100000187852 [0,2,0,0,0,0|1,0,0]=3 19840 B12R1.1631 CCNCc1c(cccc1Cl)F 270004a_100015525214_100000210083 [0,2,0,0,0,0|1,0,0]=3 19841 B12R1.1631 CCNCc1c(cccc1Cl)F 34a_100000174883_100000210202 [0,2,0,0,0,0|1,0,0]=3 19842 B12R1.1631 CCNCc1c(cccc1F)C 207a_100015525214_100000069827 [0,2,0,0,0,0|1,0,0]=3 19843 B12R1.1631 CCNCc1c(cccc1F)C 2230a_100015525214_100009814554 [0,2,0,0,0,0|1,0,0]=3 19844 B12R1.1631 CCNCc1c(cccc1F)C 270004a_100015525214_100000069827 [0,2,0,0,0,0|1,0,0]=3 19845 B12R1.1631 CCNCc1c(cccc1F)C 34a_100000762012_100000210202 [0,2,0,0,0,0|1,0,0]=3 19846 B12R1.1631 CCNCc1c(cccc1F)F 207a_100015525214_100000211061 [0,2,0,0,0,0|1,0,0]=3 19847 B12R1.1631 CCNCc1c(cccc1F)F 2230a_100015525214_100000698325 [0,2,0,0,0,0|1,0,0]=3 19848 B12R1.1631 CCNCc1c(cccc1F)F 270004a_100015525214_100000211061 [0,2,0,0,0,0|1,0,0]=3 19849 B12R1.1631 CCNCc1c(cccc1F)F 34a_100000688400_100000210202 [0,2,0,0,0,0|1,0,0]=3 19850 B12R1.1631 CCNCc1c(cccc1I)Br 2230a_100015525214_100010146611 [0,2,0,0,0,0|1,0,0]=3 19851 B12R1.1631 CCNCc1c(cccc1I)C 2230a_100015525214_100010150146 [0,2,0,0,0,0|1,0,0]=3 19852 B12R1.1631 CCNCc1c(cccc1I)Cl 207a_100015525214_100010147682 [0,2,0,0,0,0|1,0,0]=3 19853 B12R1.1631 CCNCc1c(cccc1I)Cl 270004a_100015525214_100010147682 [0,2,0,0,0,0|1,0,0]=3 19854 B12R1.1631 CCNCc1c(cccc1I)F 207a_100015525214_100010178011 [0,2,0,0,0,0|1,0,0]=3 19855 B12R1.1631 CCNCc1c(cccc1I)F 2230a_100015525214_100010149602 [0,2,0,0,0,0|1,0,0]=3 19856 B12R1.1631 CCNCc1c(cccc1I)F 270004a_100015525214_100010178011 [0,2,0,0,0,0|1,0,0]=3 19857 B12R1.1631 CCNCc1c(ccnc1F)C 207a_100015525214_100000087869 [0,2,0,0,0,0|2,0,0]=4 19858 B12R1.1631 CCNCc1c(cncc1Br)Br 207a_100015525214_100000689152 [0,2,0,0,0,0|2,0,0]=4 19859 B12R1.1631 CCNCc1c(cncc1Br)Br 270004a_100015525214_100000689152 [0,2,0,0,0,0|2,0,0]=4 19860 B12R1.1631 CCNCc1c(cncc1Br)Cl 207a_100015525214_100010064873 [0,2,0,0,0,0|2,0,0]=4 19861 B12R1.1631 CCNCc1c(cncc1Br)Cl 270004a_100015525214_100010064873 [0,2,0,0,0,0|2,0,0]=4 19862 B12R1.1631 CCNCc1c(cncc1Br)F 207a_100015525214_100010064882 [0,2,0,0,0,0|2,0,0]=4 19863 B12R1.1631 CCNCc1c(cncc1Br)F 270004a_100015525214_100010064882 [0,2,0,0,0,0|2,0,0]=4 19864 B12R1.1631 CCNCc1c(cncc1Cl)Cl 207a_100015525214_100000067493 [0,2,0,0,0,0|2,0,0]=4 19865 B12R1.1631 CCNCc1c(cncc1Cl)Cl 2230a_100015525214_200009872113 [0,2,0,0,0,0|2,0,0]=4 19866 B12R1.1631 CCNCc1c(cncc1Cl)Cl 270004a_100015525214_100000067493 [0,2,0,0,0,0|2,0,0]=4 19867 B12R1.1631 CCNCc1c(cncc1F)F 207a_100015525214_100000068831 [0,2,0,0,0,0|2,0,0]=4 19868 B12R1.1631 CCOCc1c(cccc1Br)Br 34a_100010172814_100000210202 [0,2,0,0,0,0|1,0,0]=3 19869 B12R1.1631 CCOCc1c(cccc1Br)Br 7a_100010172814_100000210202 [0,2,0,0,0,0|1,0,0]=3 19870 B12R1.1631 CCOCc1c(cccc1Br)C 34a_100121572206_100010146847 [0,2,0,0,0,0|1,0,0]=3 19871 B12R1.1631 CCOCc1c(cccc1Br)Cl 34a_100121572206_100010138402 [0,2,0,0,0,0|1,0,0]=3 19872 B12R1.1631 CCOCc1c(cccc1Br)F 34a_100012355691_100000210202 [0,2,0,0,0,0|1,0,0]=3 19873 B12R1.1631 CCOCc1c(cccc1Br)F 34a_100121572206_100012145669 [0,2,0,0,0,0|1,0,0]=3 19874 B12R1.1631 CCOCc1c(cccc1Br)F 7a_100012355691_100000210202 [0,2,0,0,0,0|1,0,0]=3 19875 B12R1.1631 CCOCc1c(cccc1Br)N 34a_100000747656_100000210202 [0,2,0,0,0,0|1,0,0]=3 19876 B12R1.1631 CCOCc1c(cccc1C)C 34a_100011933981_100000210202 [0,2,0,0,0,0|1,0,0]=3 19877 B12R1.1631 CCOCc1c(cccc1C)C 34a_100121572206_100000758300 [0,2,0,0,0,0|1,0,0]=3 19878 B12R1.1631 CCOCc1c(cccc1C)C 7a_100011933981_100000210202 [0,2,0,0,0,0|1,0,0]=3 19879 B12R1.1631 CCOCc1c(cccc1Cl)C 34a_100000082531_100000210202 [0,2,0,0,0,0|1,0,0]=3 19880 B12R1.1631 CCOCc1c(cccc1Cl)C 7a_100000082531_100000210202 [0,2,0,0,0,0|1,0,0]=3 19881 B12R1.1631 CCOCc1c(cccc1Cl)Cl 34a_100000215722_100000210202 [0,2,0,0,0,0|1,0,0]=3 19882 B12R1.1631 CCOCc1c(cccc1Cl)Cl 34a_100121572206_100000187851 [0,2,0,0,0,0|1,0,0]=3 19883 B12R1.1631 CCOCc1c(cccc1Cl)Cl 7a_100000215722_100000210202 [0,2,0,0,0,0|1,0,0]=3 19884 B12R1.1631 CCOCc1c(cccc1Cl)F 34a_100000215723_100000210202 [0,2,0,0,0,0|1,0,0]=3 19885 B12R1.1631 CCOCc1c(cccc1Cl)F 34a_100121572206_100000187852 [0,2,0,0,0,0|1,0,0]=3 19886 B12R1.1631 CCOCc1c(cccc1Cl)F 7a_100000215723_100000210202 [0,2,0,0,0,0|1,0,0]=3 19887 B12R1.1631 CCOCc1c(cccc1Cl)N 34a_100011916388_100000210202 [0,2,0,0,0,0|1,0,0]=3 19888 B12R1.1631 CCOCc1c(cccc1F)C 34a_100000057874_100000210202 [0,2,0,0,0,0|1,0,0]=3 19889 B12R1.1631 CCOCc1c(cccc1F)C 34a_100121572206_100009814554 [0,2,0,0,0,0|1,0,0]=3 19890 B12R1.1631 CCOCc1c(cccc1F)C 7a_100000057874_100000210202 [0,2,0,0,0,0|1,0,0]=3 19891 B12R1.1631 CCOCc1c(cccc1F)F 34a_100000698215_100000210202 [0,2,0,0,0,0|1,0,0]=3 19892 B12R1.1631 CCOCc1c(cccc1F)F 34a_100121572206_100000698325 [0,2,0,0,0,0|1,0,0]=3 19893 B12R1.1631 CCOCc1c(cccc1F)F 7a_100000698215_100000210202 [0,2,0,0,0,0|1,0,0]=3 19894 B12R1.1631 CCOCc1c(cccc1F)N 34a_100011846719_100000210202 [0,2,0,0,0,0|1,0,0]=3 19895 B12R1.1631 CCOCc1c(cccc1I)Br 34a_100121572206_100010146611 [0,2,0,0,0,0|1,0,0]=3 19896 B12R1.1631 CCOCc1c(cccc1I)C 34a_100121572206_100010150146 [0,2,0,0,0,0|1,0,0]=3 19897 B12R1.1631 CCOCc1c(cccc1I)F 34a_100010214973_100000210202 [0,2,0,0,0,0|1,0,0]=3 19898 B12R1.1631 CCOCc1c(cccc1I)F 34a_100121572206_100010149602 [0,2,0,0,0,0|1,0,0]=3 19899 B12R1.1631 CCOCc1c(cccc1I)F 7a_100010214973_100000210202 [0,2,0,0,0,0|1,0,0]=3 19900 B12R1.1631 CCOCc1c(ccnc1Br)Br 34a_200015784018_100000210202 [0,2,0,0,0,0|2,0,0]=4 19901 B12R1.1631 CCOCc1c(ccnc1Br)Br 7a_200015784018_100000210202 [0,2,0,0,0,0|2,0,0]=4 19902 B12R1.1631 CCOCc1c(ccnc1Cl)Cl 34a_200009882739_100000210202 [0,2,0,0,0,0|2,0,0]=4 19903 B12R1.1631 CCOCc1c(ccnc1Cl)Cl 7a_200009882739_100000210202 [0,2,0,0,0,0|2,0,0]=4 19904 B12R1.1631 CCOCc1c(ccnc1Cl)I 7a_100000047008_100000210202 [0,2,0,0,0,0|2,0,0]=4 19905 B12R1.1631 CCOCc1c(ccnc1F)I 34a_100000050056_100000210202 [0,2,0,0,0,0|2,0,0]=4 19906 B12R1.1631 CCOCc1c(ccnc1F)I 7a_100000050056_100000210202 [0,2,0,0,0,0|2,0,0]=4 19907 B12R1.1631 CCOCc1c(cncc1Cl)Cl 34a_100121572206_200009872113 [0,2,0,0,0,0|2,0,0]=4 19908 B12R1.1631 CCSCc1c(cccc1Br)C 62a_100000210202_100010146847 [0,2,0,0,0,0|1,0,0]=3 19909 B12R1.1631 CCSCc1c(cccc1Br)C 62a_100010146847_100000210202 [0,2,0,0,0,0|1,0,0]=3 19910 B12R1.1631 CCSCc1c(cccc1Br)Cl 62a_100000210202_100010138402 [0,2,0,0,0,0|1,0,0]=3 19911 B12R1.1631 CCSCc1c(cccc1Br)Cl 62a_100010138402_100000210202 [0,2,0,0,0,0|1,0,0]=3 19912 B12R1.1631 CCSCc1c(cccc1Br)F 62a_100000210202_100012145669 [0,2,0,0,0,0|1,0,0]=3 19913 B12R1.1631 CCSCc1c(cccc1Br)F 62a_100012145669_100000210202 [0,2,0,0,0,0|1,0,0]=3 19914 B12R1.1631 CCSCc1c(cccc1C)C 62a_100000210202_100000758300 [0,2,0,0,0,0|1,0,0]=3 19915 B12R1.1631 CCSCc1c(cccc1C)C 62a_100000758300_100000210202 [0,2,0,0,0,0|1,0,0]=3 19916 B12R1.1631 CCSCc1c(cccc1Cl)Cl 62a_100000187851_100000210202 [0,2,0,0,0,0|1,0,0]=3 19917 B12R1.1631 CCSCc1c(cccc1Cl)Cl 62a_100000210202_100000187851 [0,2,0,0,0,0|1,0,0]=3 19918 B12R1.1631 CCSCc1c(cccc1Cl)F 62a_100000187852_100000210202 [0,2,0,0,0,0|1,0,0]=3 19919 B12R1.1631 CCSCc1c(cccc1Cl)F 62a_100000210202_100000187852 [0,2,0,0,0,0|1,0,0]=3 19920 B12R1.1631 CCSCc1c(cccc1F)C 62a_100000210202_100009814554 [0,2,0,0,0,0|1,0,0]=3 19921 B12R1.1631 CCSCc1c(cccc1F)C 62a_100009814554_100000210202 [0,2,0,0,0,0|1,0,0]=3 19922 B12R1.1631 CCSCc1c(cccc1F)F 62a_100000210202_100000698325 [0,2,0,0,0,0|1,0,0]=3 19923 B12R1.1631 CCSCc1c(cccc1F)F 62a_100000709179_100000210202 [0,2,0,0,0,0|1,0,0]=3 19924 B12R1.1631 CCSCc1c(cccc1I)Br 62a_100000210202_100010146611 [0,2,0,0,0,0|1,0,0]=3 19925 B12R1.1631 CCSCc1c(cccc1I)Br 62a_100010146611_100000210202 [0,2,0,0,0,0|1,0,0]=3 19926 B12R1.1631 CCSCc1c(cccc1I)C 62a_100000210202_100010150146 [0,2,0,0,0,0|1,0,0]=3 19927 B12R1.1631 CCSCc1c(cccc1I)C 62a_100010150146_100000210202 [0,2,0,0,0,0|1,0,0]=3 19928 B12R1.1631 CCSCc1c(cccc1I)F 62a_100000210202_100010149602 [0,2,0,0,0,0|1,0,0]=3 19929 B12R1.1631 CCSCc1c(cccc1I)F 62a_100010149602_100000210202 [0,2,0,0,0,0|1,0,0]=3 19930 B12R1.1631 CCSCc1c(cncc1Cl)Cl 62a_100000210202_200009872113 [0,2,0,0,0,0|2,0,0]=4 19931 B12R1.1631 CCSCc1c(cncc1Cl)Cl 62a_200009872113_100000210202 [0,2,0,0,0,0|2,0,0]=4 19932 B12R1.1631 CNCCc1c(cccc1Cl)Cl 2230a_100032004868_200000210301 [0,2,0,0,0,0|1,0,0]=3 19933 B12R1.1631 CNCCc1c(cccc1Cl)Cl 2230a_106832991635_100012161200 [0,2,0,0,0,0|1,0,0]=3 19934 B12R1.1631 CNCCc1c(cccc1Cl)Cl 34a_100032004868_200000210301 [0,2,0,0,0,0|1,0,0]=3 19935 B12R1.1631 CNCCc1c(cccc1Cl)Cl 34a_100102657272_100012161200 [0,2,0,0,0,0|1,0,0]=3 19936 B12R1.1631 CNCCc1c(cccc1Cl)Cl 7a_106832991635_100012161200 [0,2,0,0,0,0|1,0,0]=3 19937 B12R1.1631 CNCCc1c(cccc1Cl)F 2230a_100000688150_200000210301 [0,2,0,0,0,0|1,0,0]=3 19938 B12R1.1631 CNCCc1c(cccc1Cl)F 34a_100000688150_200000210301 [0,2,0,0,0,0|1,0,0]=3 19939 B12R1.1631 COCCc1c(cccc1Cl)Cl 34a_100011934077_200000210301 [0,2,0,0,0,0|1,0,0]=3 19940 B12R1.1631 COCCc1c(cccc1Cl)Cl 34a_100138415774_100012161200 [0,2,0,0,0,0|1,0,0]=3 19941 B12R1.1631 COCCc1c(cccc1Cl)Cl 7a_100011934077_200000210301 [0,2,0,0,0,0|1,0,0]=3 19942 B12R1.1631 COCCc1c(cccc1Cl)F 34a_100011273940_200000210301 [0,2,0,0,0,0|1,0,0]=3 19943 B12R1.1631 COCCc1c(cccc1Cl)F 7a_100011273940_200000210301 [0,2,0,0,0,0|1,0,0]=3 19944 B12R1.1631 COCCc1c(cccc1F)F 34a_100011975733_200000210301 [0,2,0,0,0,0|1,0,0]=3 19945 B12R1.1631 COCCc1c(cccc1F)F 7a_100011975733_200000210301 [0,2,0,0,0,0|1,0,0]=3 19946 B12R1.1631 COCNc1c(cccc1F)F 2230a_100000210704_100000766300 [0,2,0,0,0,0|2,0,0]=4 19947 B12R1.1631 COCSc1c(cccc1Br)Br 62a_100000766300_100009994525 [0,2,0,0,0,0|2,0,0]=4 19948 B12R1.1631 COCSc1c(cccc1Br)Br 62a_100009994525_100000766300 [0,2,0,0,0,0|2,0,0]=4 19949 B12R1.1631 COCSc1c(cccc1Br)C 62a_100000766300_100010141302 [0,2,0,0,0,0|2,0,0]=4 19950 B12R1.1631 COCSc1c(cccc1Br)C 62a_100010141302_100000766300 [0,2,0,0,0,0|2,0,0]=4 19951 B12R1.1631 COCSc1c(cccc1Br)Cl 62a_100000766300_100010214488 [0,2,0,0,0,0|2,0,0]=4 19952 B12R1.1631 COCSc1c(cccc1Br)Cl 62a_100010214488_100000766300 [0,2,0,0,0,0|2,0,0]=4 19953 B12R1.1631 COCSc1c(cccc1Br)F 62a_100000766300_100011219512 [0,2,0,0,0,0|2,0,0]=4 19954 B12R1.1631 COCSc1c(cccc1Br)F 62a_100011219512_100000766300 [0,2,0,0,0,0|2,0,0]=4 19955 B12R1.1631 COCSc1c(cccc1Br)N 62a_100000766300_100020590159 [0,2,0,0,0,0|2,0,0]=4 19956 B12R1.1631 COCSc1c(cccc1Br)N 62a_100020590159_100000766300 [0,2,0,0,0,0|2,0,0]=4 19957 B12R1.1631 COCSc1c(cccc1Br)O 62a_100000766300_100010187912 [0,2,0,0,0,0|1,0,0]=3 19958 B12R1.1631 COCSc1c(cccc1Br)O 62a_100010187912_100000766300 [0,2,0,0,0,0|1,0,0]=3 19959 B12R1.1631 COCSc1c(cccc1C)C 62a_100000033847_100000766300 [0,2,0,0,0,0|2,0,0]=4 19960 B12R1.1631 COCSc1c(cccc1C)C 62a_100000766300_100000033847 [0,2,0,0,0,0|2,0,0]=4 19961 B12R1.1631 COCSc1c(cccc1Cl)C 62a_100000043165_100000766300 [0,2,0,0,0,0|2,0,0]=4 19962 B12R1.1631 COCSc1c(cccc1Cl)C 62a_100000766300_100000043165 [0,2,0,0,0,0|2,0,0]=4 19963 B12R1.1631 COCSc1c(cccc1Cl)Cl 62a_100000034237_100000766300 [0,2,0,0,0,0|2,0,0]=4 19964 B12R1.1631 COCSc1c(cccc1Cl)Cl 62a_100000766300_100000034237 [0,2,0,0,0,0|2,0,0]=4 19965 B12R1.1631 COCSc1c(cccc1Cl)F 62a_100000050007_100000766300 [0,2,0,0,0,0|2,0,0]=4 19966 B12R1.1631 COCSc1c(cccc1Cl)F 62a_100000766300_100000050007 [0,2,0,0,0,0|2,0,0]=4 19967 B12R1.1631 COCSc1c(cccc1Cl)N 62a_100000049713_100000766300 [0,2,0,0,0,0|2,0,0]=4 19968 B12R1.1631 COCSc1c(cccc1Cl)N 62a_100000766300_100000049713 [0,2,0,0,0,0|2,0,0]=4 19969 B12R1.1631 COCSc1c(cccc1Cl)O 62a_100000766300_100000050174 [0,2,0,0,0,0|1,0,0]=3 19970 B12R1.1631 COCSc1c(cccc1F)C 62a_100000766300_100011218421 [0,2,0,0,0,0|2,0,0]=4 19971 B12R1.1631 COCSc1c(cccc1F)C 62a_100011218421_100000766300 [0,2,0,0,0,0|2,0,0]=4 19972 B12R1.1631 COCSc1c(cccc1F)F 62a_100000693133_100000766300 [0,2,0,0,0,0|2,0,0]=4 19973 B12R1.1631 COCSc1c(cccc1F)F 62a_100000766300_100000693133 [0,2,0,0,0,0|2,0,0]=4 19974 B12R1.1631 COCSc1c(cccc1F)N 62a_100000690935_100000766300 [0,2,0,0,0,0|2,0,0]=4 19975 B12R1.1631 COCSc1c(cccc1F)N 62a_100000766300_100000690935 [0,2,0,0,0,0|2,0,0]=4 19976 B12R1.1631 COCSc1c(cccc1F)O 62a_100000766300_100009820682 [0,2,0,0,0,0|1,0,0]=3 19977 B12R1.1631 COCSc1c(cccc1F)O 62a_100009820682_100000766300 [0,2,0,0,0,0|1,0,0]=3 19978 B12R1.1631 COCSc1c(cccc1N)C 62a_100000684715_100000766300 [0,2,0,0,0,0|2,0,0]=4 19979 B12R1.1631 COCSc1c(cccc1N)C 62a_100000766300_100000684715 [0,2,0,0,0,0|2,0,0]=4 19980 B12R1.1631 COCSc1c(cccc1O)C 62a_100000686692_100000766300 [0,2,0,0,0,0|1,0,0]=3 19981 B12R1.1631 COCSc1c(cccc1O)C 62a_100000766300_100000686692 [0,2,0,0,0,0|1,0,0]=3 19982 B12R1.1631 COCSc1c(cccc1O)N 62a_100000766300_100012183704 [0,2,0,0,0,0|1,0,0]=3 19983 B12R1.1631 COCSc1c(cccc1O)N 62a_100012183704_100000766300 [0,2,0,0,0,0|1,0,0]=3 19984 B12R1.1631 COCSc1c(cccc1O)O 62a_100000766300_100010205330 [0,2,0,0,0,0|1,0,0]=3 19985 B12R1.1631 COCSc1c(ccnc1O)C 62a_100000766300_100012000493 [0,2,0,0,0,0|2,0,0]=4 19986 B12R1.1631 COCSc1c(ccnc1O)C 62a_100012000493_100000766300 [0,2,0,0,0,0|2,0,0]=4 19987 B12R1.1631 COCSc1c(ccnc1O)O 62a_100000766300_200009817435 [0,2,0,0,0,0|2,0,0]=4 19988 B12R1.1631 CSCCc1c(cccc1Cl)Cl 62a_100012161200_200000210301 [0,2,0,0,0,0|1,0,0]=3 19989 B12R1.1631 CSCCc1c(cccc1Cl)Cl 62a_200000210301_100012161200 [0,2,0,0,0,0|1,0,0]=3 19990 B12R1.1631 CSCNc1c(cccc1Br)Br 34a_100000690995_100011218213 [0,2,0,0,0,0|2,0,0]=4 19991 B12R1.1631 CSCNc1c(cccc1Br)C 34a_100011834072_100011218213 [0,2,0,0,0,0|2,0,0]=4 19992 B12R1.1631 CSCNc1c(cccc1Br)Cl 34a_100102946385_100011218213 [0,2,0,0,0,0|2,0,0]=4 19993 B12R1.1631 CSCNc1c(cccc1Br)F 34a_100000684712_100011218213 [0,2,0,0,0,0|2,0,0]=4 19994 B12R1.1631 CSCNc1c(cccc1Br)O 34a_100011934926_100011218213 [0,2,0,0,0,0|1,0,0]=3 19995 B12R1.1631 CSCNc1c(cccc1C)C 34a_100000185769_100011218213 [0,2,0,0,0,0|2,0,0]=4 19996 B12R1.1631 CSCNc1c(cccc1Cl)C 34a_100000756524_100011218213 [0,2,0,0,0,0|2,0,0]=4 19997 B12R1.1631 CSCNc1c(cccc1Cl)Cl 34a_100000210028_100011218213 [0,2,0,0,0,0|2,0,0]=4 19998 B12R1.1631 CSCNc1c(cccc1Cl)F 34a_100000760031_100011218213 [0,2,0,0,0,0|2,0,0]=4 19999 B12R1.1631 CSCNc1c(cccc1Cl)O 34a_100012022510_100011218213 [0,2,0,0,0,0|1,0,0]=3 20000 B12R1.1631 CSCNc1c(cccc1F)C 34a_100000766463_100011218213 [0,2,0,0,0,0|2,0,0]=4 20001 B12R1.1631 CSCNc1c(cccc1F)F 2230a_100000210704_100011218213 [0,2,0,0,0,0|2,0,0]=4 20002 B12R1.1631 CSCNc1c(cccc1F)F 34a_100000210704_100011218213 [0,2,0,0,0,0|2,0,0]=4 20003 B12R1.1631 CSCNc1c(cccc1F)O 34a_100020591140_100011218213 [0,2,0,0,0,0|1,0,0]=3 20004 B12R1.1631 CSCNc1c(cccc1I)F 34a_100000042321_100011218213 [0,2,0,0,0,0|2,0,0]=4 20005 B12R1.1631 CSCNc1c(cccc1O)C 34a_100000743429_100011218213 [0,2,0,0,0,0|1,0,0]=3 20006 B12R1.1631 CSCOc1c(cccc1Br)Br 34a_100000736428_100011218213 [0,2,0,0,0,0|2,0,0]=4 20007 B12R1.1631 CSCOc1c(cccc1Br)C 34a_100009817157_100011218213 [0,2,0,0,0,0|2,0,0]=4 20008 B12R1.1631 CSCOc1c(cccc1Br)Cl 34a_100010214474_100011218213 [0,2,0,0,0,0|2,0,0]=4 20009 B12R1.1631 CSCOc1c(cccc1Br)F 34a_100009813666_100011218213 [0,2,0,0,0,0|2,0,0]=4 20010 B12R1.1631 CSCOc1c(cccc1Br)N 34a_100011934915_100011218213 [0,2,0,0,0,0|2,0,0]=4 20011 B12R1.1631 CSCOc1c(cccc1C)C 34a_100000210341_100011218213 [0,2,0,0,0,0|2,0,0]=4 20012 B12R1.1631 CSCOc1c(cccc1Cl)C 34a_100000033731_100011218213 [0,2,0,0,0,0|2,0,0]=4 20013 B12R1.1631 CSCOc1c(cccc1Cl)Cl 34a_100000211709_100011218213 [0,2,0,0,0,0|2,0,0]=4 20014 B12R1.1631 CSCOc1c(cccc1Cl)F 34a_100000694953_100011218213 [0,2,0,0,0,0|2,0,0]=4 20015 B12R1.1631 CSCOc1c(cccc1Cl)N 34a_100000754742_100011218213 [0,2,0,0,0,0|2,0,0]=4 20016 B12R1.1631 CSCOc1c(cccc1F)C 34a_100011659162_100011218213 [0,2,0,0,0,0|2,0,0]=4 20017 B12R1.1631 CSCOc1c(cccc1F)F 34a_100000230165_100011218213 [0,2,0,0,0,0|2,0,0]=4 20018 B12R1.1631 CSCOc1c(cccc1F)N 34a_100011934987_100011218213 [0,2,0,0,0,0|2,0,0]=4 20019 B12R1.1631 CSCOc1c(cccc1I)Br 34a_100010084509_100011218213 [0,2,0,0,0,0|2,0,0]=4 20020 B12R1.1631 CSCOc1c(cccc1I)Cl 34a_100010202889_100011218213 [0,2,0,0,0,0|2,0,0]=4 20021 B12R1.1631 CSCOc1c(cccc1I)F 34a_100010186298_100011218213 [0,2,0,0,0,0|2,0,0]=4 20022 B12R1.1631 CSCOc1c(cccc1I)N 34a_100010084371_100011218213 [0,2,0,0,0,0|2,0,0]=4 20023 B12R1.1631 CSCOc1c(cccc1N)C 34a_100000756359_100011218213 [0,2,0,0,0,0|2,0,0]=4 20024 B12R1.1631 CSCOc1c(cccc1N)N 34a_200016994477_100011218213 [0,2,0,0,0,0|2,0,0]=4 20025 B12R1.1631 CSCSc1c(cccc1Br)Br 62a_100009994525_100011218213 [0,2,0,0,0,0|2,0,0]=4 20026 B12R1.1631 CSCSc1c(cccc1Br)Br 62a_100011218213_100009994525 [0,2,0,0,0,0|2,0,0]=4 20027 B12R1.1631 CSCSc1c(cccc1Br)C 62a_100010141302_100011218213 [0,2,0,0,0,0|2,0,0]=4 20028 B12R1.1631 CSCSc1c(cccc1Br)C 62a_100011218213_100010141302 [0,2,0,0,0,0|2,0,0]=4 20029 B12R1.1631 CSCSc1c(cccc1Br)Cl 62a_100010214488_100011218213 [0,2,0,0,0,0|2,0,0]=4 20030 B12R1.1631 CSCSc1c(cccc1Br)Cl 62a_100011218213_100010214488 [0,2,0,0,0,0|2,0,0]=4 20031 B12R1.1631 CSCSc1c(cccc1Br)F 62a_100011218213_100011219512 [0,2,0,0,0,0|2,0,0]=4 20032 B12R1.1631 CSCSc1c(cccc1Br)F 62a_100011219512_100011218213 [0,2,0,0,0,0|2,0,0]=4 20033 B12R1.1631 CSCSc1c(cccc1Br)N 62a_100011218213_100020590159 [0,2,0,0,0,0|2,0,0]=4 20034 B12R1.1631 CSCSc1c(cccc1Br)N 62a_100020590159_100011218213 [0,2,0,0,0,0|2,0,0]=4 20035 B12R1.1631 CSCSc1c(cccc1Br)O 62a_100010187912_100011218213 [0,2,0,0,0,0|1,0,0]=3 20036 B12R1.1631 CSCSc1c(cccc1Br)O 62a_100011218213_100010187912 [0,2,0,0,0,0|1,0,0]=3 20037 B12R1.1631 CSCSc1c(cccc1C)C 62a_100000033847_100011218213 [0,2,0,0,0,0|2,0,0]=4 20038 B12R1.1631 CSCSc1c(cccc1C)C 62a_100011218213_100000033847 [0,2,0,0,0,0|2,0,0]=4 20039 B12R1.1631 CSCSc1c(cccc1Cl)C 62a_100000043165_100011218213 [0,2,0,0,0,0|2,0,0]=4 20040 B12R1.1631 CSCSc1c(cccc1Cl)C 62a_100011218213_100000043165 [0,2,0,0,0,0|2,0,0]=4 20041 B12R1.1631 CSCSc1c(cccc1Cl)Cl 62a_100000034237_100011218213 [0,2,0,0,0,0|2,0,0]=4 20042 B12R1.1631 CSCSc1c(cccc1Cl)Cl 62a_100011218213_100000034237 [0,2,0,0,0,0|2,0,0]=4 20043 B12R1.1631 CSCSc1c(cccc1Cl)F 62a_100000050007_100011218213 [0,2,0,0,0,0|2,0,0]=4 20044 B12R1.1631 CSCSc1c(cccc1Cl)F 62a_100011218213_100000050007 [0,2,0,0,0,0|2,0,0]=4 20045 B12R1.1631 CSCSc1c(cccc1Cl)N 62a_100000049713_100011218213 [0,2,0,0,0,0|2,0,0]=4 20046 B12R1.1631 CSCSc1c(cccc1Cl)N 62a_100011218213_100000049713 [0,2,0,0,0,0|2,0,0]=4 20047 B12R1.1631 CSCSc1c(cccc1Cl)O 62a_100011218213_100000050174 [0,2,0,0,0,0|1,0,0]=3 20048 B12R1.1631 CSCSc1c(cccc1F)C 62a_100011218213_100011218421 [0,2,0,0,0,0|2,0,0]=4 20049 B12R1.1631 CSCSc1c(cccc1F)C 62a_100011218421_100011218213 [0,2,0,0,0,0|2,0,0]=4 20050 B12R1.1631 CSCSc1c(cccc1F)F 62a_100000693133_100011218213 [0,2,0,0,0,0|2,0,0]=4 20051 B12R1.1631 CSCSc1c(cccc1F)F 62a_100011218213_100000693133 [0,2,0,0,0,0|2,0,0]=4 20052 B12R1.1631 CSCSc1c(cccc1F)N 62a_100000690935_100011218213 [0,2,0,0,0,0|2,0,0]=4 20053 B12R1.1631 CSCSc1c(cccc1F)N 62a_100011218213_100000690935 [0,2,0,0,0,0|2,0,0]=4 20054 B12R1.1631 CSCSc1c(cccc1F)O 62a_100009820682_100011218213 [0,2,0,0,0,0|1,0,0]=3 20055 B12R1.1631 CSCSc1c(cccc1F)O 62a_100011218213_100009820682 [0,2,0,0,0,0|1,0,0]=3 20056 B12R1.1631 CSCSc1c(cccc1N)C 62a_100000684715_100011218213 [0,2,0,0,0,0|2,0,0]=4 20057 B12R1.1631 CSCSc1c(cccc1N)C 62a_100011218213_100000684715 [0,2,0,0,0,0|2,0,0]=4 20058 B12R1.1631 CSCSc1c(cccc1O)C 62a_100000686692_100011218213 [0,2,0,0,0,0|1,0,0]=3 20059 B12R1.1631 CSCSc1c(cccc1O)C 62a_100011218213_100000686692 [0,2,0,0,0,0|1,0,0]=3 20060 B12R1.1631 CSCSc1c(cccc1O)N 62a_100011218213_100012183704 [0,2,0,0,0,0|1,0,0]=3 20061 B12R1.1631 CSCSc1c(cccc1O)N 62a_100012183704_100011218213 [0,2,0,0,0,0|1,0,0]=3 20062 B12R1.1631 CSCSc1c(cccc1O)O 62a_100011218213_100010205330 [0,2,0,0,0,0|1,0,0]=3 20063 B12R1.1631 CSCSc1c(ccnc1O)C 62a_100011218213_100012000493 [0,2,0,0,0,0|2,0,0]=4 20064 B12R1.1631 CSCSc1c(ccnc1O)C 62a_100012000493_100011218213 [0,2,0,0,0,0|2,0,0]=4 20065 B12R1.1631 CSCSc1c(ccnc1O)O 62a_100011218213_200009817435 [0,2,0,0,0,0|2,0,0]=4 20066 B12R1.1631 Cc1cccc(c1CNCF)C 34a_100000689800_100015361967 [0,2,0,0,0,0|2,0,0]=4 20067 B12R1.1631 Cc1cccc(c1CNCF)F 34a_100000762012_100015361967 [0,2,0,0,0,0|2,0,0]=4 20068 B12R1.1631 Cc1cccc(c1COCF)C 34a_100011933981_100015361967 [0,2,0,0,0,0|2,0,0]=4 20069 B12R1.1631 Cc1cccc(c1COCF)C 7a_100011933981_100015361967 [0,2,0,0,0,0|2,0,0]=4 20070 B12R1.1631 Cc1cccc(c1COCF)Cl 34a_100000082531_100015361967 [0,2,0,0,0,0|2,0,0]=4 20071 B12R1.1631 Cc1cccc(c1COCF)Cl 7a_100000082531_100015361967 [0,2,0,0,0,0|2,0,0]=4 20072 B12R1.1631 Cc1cccc(c1COCF)F 34a_100000057874_100015361967 [0,2,0,0,0,0|2,0,0]=4 20073 B12R1.1631 Cc1cccc(c1COCF)F 7a_100000057874_100015361967 [0,2,0,0,0,0|2,0,0]=4 20074 B12R1.1631 Cc1cccc(c1CSCF)Br 62a_100010146847_100015361967 [0,2,0,0,0,0|2,0,0]=4 20075 B12R1.1631 Cc1cccc(c1CSCF)Br 62a_100015361967_100010146847 [0,2,0,0,0,0|2,0,0]=4 20076 B12R1.1631 Cc1cccc(c1CSCF)C 62a_100000758300_100015361967 [0,2,0,0,0,0|2,0,0]=4 20077 B12R1.1631 Cc1cccc(c1CSCF)C 62a_100015361967_100000758300 [0,2,0,0,0,0|2,0,0]=4 20078 B12R1.1631 Cc1cccc(c1CSCF)F 62a_100009814554_100015361967 [0,2,0,0,0,0|2,0,0]=4 20079 B12R1.1631 Cc1cccc(c1CSCF)F 62a_100015361967_100009814554 [0,2,0,0,0,0|2,0,0]=4 20080 B12R1.1631 Cc1cccc(c1CSCF)I 62a_100010150146_100015361967 [0,2,0,0,0,0|2,0,0]=4 20081 B12R1.1631 Cc1cccc(c1CSCF)I 62a_100015361967_100010150146 [0,2,0,0,0,0|2,0,0]=4 20082 B12R1.1631 Cc1cccc(c1NCC=O)O 34a_100000743429_200009817547 [0,2,0,0,0,0|1,0,1]=4 20083 B12R1.1631 Cc1cccc(c1NCCF)Br 34a_100011834072_100011217306 [0,2,0,0,0,0|2,0,0]=4 20084 B12R1.1631 Cc1cccc(c1NCCF)C 34a_100000185769_100011217306 [0,2,0,0,0,0|2,0,0]=4 20085 B12R1.1631 Cc1cccc(c1NCCF)Cl 34a_100000756524_100011217306 [0,2,0,0,0,0|2,0,0]=4 20086 B12R1.1631 Cc1cccc(c1NCCF)F 34a_100000766463_100011217306 [0,2,0,0,0,0|2,0,0]=4 20087 B12R1.1631 Cc1cccc(c1NCCF)O 34a_100000743429_100011217306 [0,2,0,0,0,0|1,0,0]=3 20088 B12R1.1631 Cc1cccc(c1NCCO)Br 34a_100011834072_100000211926 [0,2,0,0,0,0|2,0,0]=4 20089 B12R1.1631 Cc1cccc(c1NCCO)C 34a_100000185769_100000211926 [0,2,0,0,0,0|2,0,0]=4 20090 B12R1.1631 Cc1cccc(c1NCCO)Cl 34a_100000756524_100000211926 [0,2,0,0,0,0|2,0,0]=4 20091 B12R1.1631 Cc1cccc(c1NCCO)F 34a_100000766463_100000211926 [0,2,0,0,0,0|2,0,0]=4 20092 B12R1.1631 Cc1cccc(c1NCCO)O 34a_100000743429_100000211926 [0,2,0,0,0,0|1,0,0]=3 20093 B12R1.1631 Cc1cccc(c1OCCF)Br 34a_100009817157_100011217306 [0,2,0,0,0,0|2,0,0]=4 20094 B12R1.1631 Cc1cccc(c1OCCF)Br 7a_100009817157_100011217306 [0,2,0,0,0,0|2,0,0]=4 20095 B12R1.1631 Cc1cccc(c1OCCF)C 34a_100000210341_100011217306 [0,2,0,0,0,0|2,0,0]=4 20096 B12R1.1631 Cc1cccc(c1OCCF)C 7a_100000210341_100011217306 [0,2,0,0,0,0|2,0,0]=4 20097 B12R1.1631 Cc1cccc(c1OCCF)Cl 34a_100000033731_100011217306 [0,2,0,0,0,0|2,0,0]=4 20098 B12R1.1631 Cc1cccc(c1OCCF)Cl 7a_100000033731_100011217306 [0,2,0,0,0,0|2,0,0]=4 20099 B12R1.1631 Cc1cccc(c1OCCF)F 34a_100011659162_100011217306 [0,2,0,0,0,0|2,0,0]=4 20100 B12R1.1631 Cc1cccc(c1OCCF)F 7a_100011659162_100011217306 [0,2,0,0,0,0|2,0,0]=4 20101 B12R1.1631 Cc1cccc(c1OCCF)N 34a_100000756359_100011217306 [0,2,0,0,0,0|2,0,0]=4 20102 B12R1.1631 Cc1cccc(c1OCCF)N 7a_100000756359_100011217306 [0,2,0,0,0,0|2,0,0]=4 20103 B12R1.1631 Cc1cccc(c1OCCO)Br 34a_100009817157_100000211926 [0,2,0,0,0,0|2,0,0]=4 20104 B12R1.1631 Cc1cccc(c1OCCO)Br 7a_100009817157_100000211926 [0,2,0,0,0,0|2,0,0]=4 20105 B12R1.1631 Cc1cccc(c1OCCO)C 34a_100000210341_100000211926 [0,2,0,0,0,0|2,0,0]=4 20106 B12R1.1631 Cc1cccc(c1OCCO)C 7a_100000210341_100000211926 [0,2,0,0,0,0|2,0,0]=4 20107 B12R1.1631 Cc1cccc(c1OCCO)Cl 34a_100000033731_100000211926 [0,2,0,0,0,0|2,0,0]=4 20108 B12R1.1631 Cc1cccc(c1OCCO)Cl 7a_100000033731_100000211926 [0,2,0,0,0,0|2,0,0]=4 20109 B12R1.1631 Cc1cccc(c1OCCO)F 34a_100011659162_100000211926 [0,2,0,0,0,0|2,0,0]=4 20110 B12R1.1631 Cc1cccc(c1OCCO)F 7a_100011659162_100000211926 [0,2,0,0,0,0|2,0,0]=4 20111 B12R1.1631 Cc1cccc(c1OCCO)N 34a_100000756359_100000211926 [0,2,0,0,0,0|2,0,0]=4 20112 B12R1.1631 Cc1cccc(c1OCCO)N 7a_100000756359_100000211926 [0,2,0,0,0,0|2,0,0]=4 20113 B12R1.1631 Cc1cccc(c1SCC#N)O 62a_100000686692_100011215382 [0,2,0,0,0,0|1,0,1]=4 20114 B12R1.1631 Cc1cccc(c1SCC#N)O 62a_100011215382_100000686692 [0,2,0,0,0,0|1,0,1]=4 20115 B12R1.1631 Cc1cccc(c1SCC=O)O 62a_100000686692_200015260668 [0,2,0,0,0,0|1,0,1]=4 20116 B12R1.1631 Cc1cccc(c1SCC=O)O 62a_200015260668_100000686692 [0,2,0,0,0,0|1,0,1]=4 20117 B12R1.1631 Cc1cccc(c1SCCF)Br 62a_100010141302_100011217306 [0,2,0,0,0,0|2,0,0]=4 20118 B12R1.1631 Cc1cccc(c1SCCF)Br 62a_100011217306_100010141302 [0,2,0,0,0,0|2,0,0]=4 20119 B12R1.1631 Cc1cccc(c1SCCF)C 62a_100000033847_100011217306 [0,2,0,0,0,0|2,0,0]=4 20120 B12R1.1631 Cc1cccc(c1SCCF)C 62a_100011217306_100000033847 [0,2,0,0,0,0|2,0,0]=4 20121 B12R1.1631 Cc1cccc(c1SCCF)Cl 62a_100000043165_100011217306 [0,2,0,0,0,0|2,0,0]=4 20122 B12R1.1631 Cc1cccc(c1SCCF)Cl 62a_100011217306_100000043165 [0,2,0,0,0,0|2,0,0]=4 20123 B12R1.1631 Cc1cccc(c1SCCF)F 62a_100011217306_100011218421 [0,2,0,0,0,0|2,0,0]=4 20124 B12R1.1631 Cc1cccc(c1SCCF)F 62a_100011218421_100011217306 [0,2,0,0,0,0|2,0,0]=4 20125 B12R1.1631 Cc1cccc(c1SCCF)N 62a_100000684715_100011217306 [0,2,0,0,0,0|2,0,0]=4 20126 B12R1.1631 Cc1cccc(c1SCCF)N 62a_100011217306_100000684715 [0,2,0,0,0,0|2,0,0]=4 20127 B12R1.1631 Cc1cccc(c1SCCF)O 62a_100000686692_100011217306 [0,2,0,0,0,0|1,0,0]=3 20128 B12R1.1631 Cc1cccc(c1SCCF)O 62a_100011217306_100000686692 [0,2,0,0,0,0|1,0,0]=3 20129 B12R1.1631 Cc1cccc(c1SCCO)Br 62a_100000211926_100010141302 [0,2,0,0,0,0|2,0,0]=4 20130 B12R1.1631 Cc1cccc(c1SCCO)Br 62a_100010141302_100000211926 [0,2,0,0,0,0|2,0,0]=4 20131 B12R1.1631 Cc1cccc(c1SCCO)C 62a_100000033847_100000211926 [0,2,0,0,0,0|2,0,0]=4 20132 B12R1.1631 Cc1cccc(c1SCCO)C 62a_100000211926_100000033847 [0,2,0,0,0,0|2,0,0]=4 20133 B12R1.1631 Cc1cccc(c1SCCO)Cl 62a_100000043165_100000211926 [0,2,0,0,0,0|2,0,0]=4 20134 B12R1.1631 Cc1cccc(c1SCCO)Cl 62a_100000211926_100000043165 [0,2,0,0,0,0|2,0,0]=4 20135 B12R1.1631 Cc1cccc(c1SCCO)F 62a_100000211926_100011218421 [0,2,0,0,0,0|2,0,0]=4 20136 B12R1.1631 Cc1cccc(c1SCCO)F 62a_100011218421_100000211926 [0,2,0,0,0,0|2,0,0]=4 20137 B12R1.1631 Cc1cccc(c1SCCO)N 62a_100000211926_100000684715 [0,2,0,0,0,0|2,0,0]=4 20138 B12R1.1631 Cc1cccc(c1SCCO)N 62a_100000684715_100000211926 [0,2,0,0,0,0|2,0,0]=4 20139 B12R1.1631 Cc1cccc(c1SCCO)O 62a_100000211926_100000686692 [0,2,0,0,0,0|1,0,0]=3 20140 B12R1.1631 Cc1cccc(c1SCCO)O 62a_100000686692_100000211926 [0,2,0,0,0,0|1,0,0]=3 20141 B12R1.1631 Cc1ccnc(c1SCCF)O 62a_100011217306_100012000493 [0,2,0,0,0,0|2,0,0]=4 20142 B12R1.1631 Cc1ccnc(c1SCCF)O 62a_100012000493_100011217306 [0,2,0,0,0,0|2,0,0]=4 20143 B12R1.1631 Cc1ccnc(c1SCCO)O 62a_100000211926_100012000493 [0,2,0,0,0,0|2,0,0]=4 20144 B12R1.1631 Cc1ccnc(c1SCCO)O 62a_100012000493_100000211926 [0,2,0,0,0,0|2,0,0]=4 20145 B12R1.1631 FCCNc1c(cccc1Br)Br 34a_100000690995_100011217306 [0,2,0,0,0,0|2,0,0]=4 20146 B12R1.1631 FCCNc1c(cccc1Br)Cl 34a_100102946385_100011217306 [0,2,0,0,0,0|2,0,0]=4 20147 B12R1.1631 FCCNc1c(cccc1Br)F 34a_100000684712_100011217306 [0,2,0,0,0,0|2,0,0]=4 20148 B12R1.1631 FCCNc1c(cccc1Cl)Cl 34a_100000210028_100011217306 [0,2,0,0,0,0|2,0,0]=4 20149 B12R1.1631 FCCNc1c(cccc1Cl)F 34a_100000760031_100011217306 [0,2,0,0,0,0|2,0,0]=4 20150 B12R1.1631 FCCNc1c(cccc1F)F 2230a_100000210704_100011217306 [0,2,0,0,0,0|2,0,0]=4 20151 B12R1.1631 FCCNc1c(cccc1F)F 34a_100000210704_100011217306 [0,2,0,0,0,0|2,0,0]=4 20152 B12R1.1631 FCCNc1c(cccc1I)F 34a_100000042321_100011217306 [0,2,0,0,0,0|2,0,0]=4 20153 B12R1.1631 FCCOc1c(cccc1Br)Br 34a_100000736428_100011217306 [0,2,0,0,0,0|2,0,0]=4 20154 B12R1.1631 FCCOc1c(cccc1Br)Br 7a_100000736428_100011217306 [0,2,0,0,0,0|2,0,0]=4 20155 B12R1.1631 FCCOc1c(cccc1Br)Cl 34a_100010214474_100011217306 [0,2,0,0,0,0|2,0,0]=4 20156 B12R1.1631 FCCOc1c(cccc1Br)Cl 7a_100010214474_100011217306 [0,2,0,0,0,0|2,0,0]=4 20157 B12R1.1631 FCCOc1c(cccc1Br)F 34a_100009813666_100011217306 [0,2,0,0,0,0|2,0,0]=4 20158 B12R1.1631 FCCOc1c(cccc1Br)F 7a_100009813666_100011217306 [0,2,0,0,0,0|2,0,0]=4 20159 B12R1.1631 FCCOc1c(cccc1Cl)Cl 34a_100000211709_100011217306 [0,2,0,0,0,0|2,0,0]=4 20160 B12R1.1631 FCCOc1c(cccc1Cl)Cl 7a_100000211709_100011217306 [0,2,0,0,0,0|2,0,0]=4 20161 B12R1.1631 FCCOc1c(cccc1Cl)F 34a_100000694953_100011217306 [0,2,0,0,0,0|2,0,0]=4 20162 B12R1.1631 FCCOc1c(cccc1Cl)F 7a_100000694953_100011217306 [0,2,0,0,0,0|2,0,0]=4 20163 B12R1.1631 FCCOc1c(cccc1F)F 34a_100000230165_100011217306 [0,2,0,0,0,0|2,0,0]=4 20164 B12R1.1631 FCCOc1c(cccc1F)F 7a_100000230165_100011217306 [0,2,0,0,0,0|2,0,0]=4 20165 B12R1.1631 FCCOc1c(cccc1I)Br 34a_100010084509_100011217306 [0,2,0,0,0,0|2,0,0]=4 20166 B12R1.1631 FCCOc1c(cccc1I)Br 7a_100010084509_100011217306 [0,2,0,0,0,0|2,0,0]=4 20167 B12R1.1631 FCCOc1c(cccc1I)Cl 34a_100010202889_100011217306 [0,2,0,0,0,0|2,0,0]=4 20168 B12R1.1631 FCCOc1c(cccc1I)Cl 7a_100010202889_100011217306 [0,2,0,0,0,0|2,0,0]=4 20169 B12R1.1631 FCCOc1c(cccc1I)F 34a_100010186298_100011217306 [0,2,0,0,0,0|2,0,0]=4 20170 B12R1.1631 FCCOc1c(cccc1I)F 7a_100010186298_100011217306 [0,2,0,0,0,0|2,0,0]=4 20171 B12R1.1631 FCCSc1c(cccc1Br)Br 62a_100009994525_100011217306 [0,2,0,0,0,0|2,0,0]=4 20172 B12R1.1631 FCCSc1c(cccc1Br)Br 62a_100011217306_100009994525 [0,2,0,0,0,0|2,0,0]=4 20173 B12R1.1631 FCCSc1c(cccc1Br)Cl 62a_100010214488_100011217306 [0,2,0,0,0,0|2,0,0]=4 20174 B12R1.1631 FCCSc1c(cccc1Br)Cl 62a_100011217306_100010214488 [0,2,0,0,0,0|2,0,0]=4 20175 B12R1.1631 FCCSc1c(cccc1Br)F 62a_100011217306_100011219512 [0,2,0,0,0,0|2,0,0]=4 20176 B12R1.1631 FCCSc1c(cccc1Br)F 62a_100011219512_100011217306 [0,2,0,0,0,0|2,0,0]=4 20177 B12R1.1631 FCCSc1c(cccc1Cl)Cl 62a_100000034237_100011217306 [0,2,0,0,0,0|2,0,0]=4 20178 B12R1.1631 FCCSc1c(cccc1Cl)Cl 62a_100011217306_100000034237 [0,2,0,0,0,0|2,0,0]=4 20179 B12R1.1631 FCCSc1c(cccc1Cl)F 62a_100000050007_100011217306 [0,2,0,0,0,0|2,0,0]=4 20180 B12R1.1631 FCCSc1c(cccc1Cl)F 62a_100011217306_100000050007 [0,2,0,0,0,0|2,0,0]=4 20181 B12R1.1631 FCCSc1c(cccc1F)F 62a_100000693133_100011217306 [0,2,0,0,0,0|2,0,0]=4 20182 B12R1.1631 FCCSc1c(cccc1F)F 62a_100011217306_100000693133 [0,2,0,0,0,0|2,0,0]=4 20183 B12R1.1631 FCNCc1c(cccc1Br)F 34a_100012349121_100015361967 [0,2,0,0,0,0|2,0,0]=4 20184 B12R1.1631 FCNCc1c(cccc1Cl)Cl 34a_100000174884_100015361967 [0,2,0,0,0,0|2,0,0]=4 20185 B12R1.1631 FCNCc1c(cccc1Cl)F 34a_100000174883_100015361967 [0,2,0,0,0,0|2,0,0]=4 20186 B12R1.1631 FCNCc1c(cccc1F)F 34a_100000688400_100015361967 [0,2,0,0,0,0|2,0,0]=4 20187 B12R1.1631 FCOCc1c(cccc1Br)Br 34a_100010172814_100015361967 [0,2,0,0,0,0|2,0,0]=4 20188 B12R1.1631 FCOCc1c(cccc1Br)Br 7a_100010172814_100015361967 [0,2,0,0,0,0|2,0,0]=4 20189 B12R1.1631 FCOCc1c(cccc1Br)F 34a_100012355691_100015361967 [0,2,0,0,0,0|2,0,0]=4 20190 B12R1.1631 FCOCc1c(cccc1Br)F 7a_100012355691_100015361967 [0,2,0,0,0,0|2,0,0]=4 20191 B12R1.1631 FCOCc1c(cccc1Cl)Cl 34a_100000215722_100015361967 [0,2,0,0,0,0|2,0,0]=4 20192 B12R1.1631 FCOCc1c(cccc1Cl)Cl 7a_100000215722_100015361967 [0,2,0,0,0,0|2,0,0]=4 20193 B12R1.1631 FCOCc1c(cccc1Cl)F 34a_100000215723_100015361967 [0,2,0,0,0,0|2,0,0]=4 20194 B12R1.1631 FCOCc1c(cccc1Cl)F 7a_100000215723_100015361967 [0,2,0,0,0,0|2,0,0]=4 20195 B12R1.1631 FCOCc1c(cccc1F)F 34a_100000698215_100015361967 [0,2,0,0,0,0|2,0,0]=4 20196 B12R1.1631 FCOCc1c(cccc1F)F 7a_100000698215_100015361967 [0,2,0,0,0,0|2,0,0]=4 20197 B12R1.1631 FCOCc1c(cccc1I)F 34a_100010214973_100015361967 [0,2,0,0,0,0|2,0,0]=4 20198 B12R1.1631 FCOCc1c(cccc1I)F 7a_100010214973_100015361967 [0,2,0,0,0,0|2,0,0]=4 20199 B12R1.1631 FCSCc1c(cccc1Br)Cl 62a_100010138402_100015361967 [0,2,0,0,0,0|2,0,0]=4 20200 B12R1.1631 FCSCc1c(cccc1Br)Cl 62a_100015361967_100010138402 [0,2,0,0,0,0|2,0,0]=4 20201 B12R1.1631 FCSCc1c(cccc1Br)F 62a_100012145669_100015361967 [0,2,0,0,0,0|2,0,0]=4 20202 B12R1.1631 FCSCc1c(cccc1Br)F 62a_100015361967_100012145669 [0,2,0,0,0,0|2,0,0]=4 20203 B12R1.1631 FCSCc1c(cccc1Cl)Cl 62a_100000187851_100015361967 [0,2,0,0,0,0|2,0,0]=4 20204 B12R1.1631 FCSCc1c(cccc1Cl)Cl 62a_100015361967_100000187851 [0,2,0,0,0,0|2,0,0]=4 20205 B12R1.1631 FCSCc1c(cccc1Cl)F 62a_100000187852_100015361967 [0,2,0,0,0,0|2,0,0]=4 20206 B12R1.1631 FCSCc1c(cccc1Cl)F 62a_100015361967_100000187852 [0,2,0,0,0,0|2,0,0]=4 20207 B12R1.1631 FCSCc1c(cccc1F)F 62a_100000709179_100015361967 [0,2,0,0,0,0|2,0,0]=4 20208 B12R1.1631 FCSCc1c(cccc1F)F 62a_100015361967_100000698325 [0,2,0,0,0,0|2,0,0]=4 20209 B12R1.1631 FCSCc1c(cccc1I)Br 62a_100010146611_100015361967 [0,2,0,0,0,0|2,0,0]=4 20210 B12R1.1631 FCSCc1c(cccc1I)Br 62a_100015361967_100010146611 [0,2,0,0,0,0|2,0,0]=4 20211 B12R1.1631 FCSCc1c(cccc1I)F 62a_100010149602_100015361967 [0,2,0,0,0,0|2,0,0]=4 20212 B12R1.1631 FCSCc1c(cccc1I)F 62a_100015361967_100010149602 [0,2,0,0,0,0|2,0,0]=4 20213 B12R1.1631 N#CCSc1c(cccc1Br)O 62a_100010187912_100011215382 [0,2,0,0,0,0|1,0,1]=4 20214 B12R1.1631 N#CCSc1c(cccc1Br)O 62a_100011215382_100010187912 [0,2,0,0,0,0|1,0,1]=4 20215 B12R1.1631 N#CCSc1c(cccc1Cl)O 62a_100011215382_100000050174 [0,2,0,0,0,0|1,0,1]=4 20216 B12R1.1631 N#CCSc1c(cccc1F)O 62a_100009820682_100011215382 [0,2,0,0,0,0|1,0,1]=4 20217 B12R1.1631 N#CCSc1c(cccc1F)O 62a_100011215382_100009820682 [0,2,0,0,0,0|1,0,1]=4 20218 B12R1.1631 N#CCSc1c(cccc1O)N 62a_100011215382_100012183704 [0,2,0,0,0,0|1,0,1]=4 20219 B12R1.1631 N#CCSc1c(cccc1O)N 62a_100012183704_100011215382 [0,2,0,0,0,0|1,0,1]=4 20220 B12R1.1631 N#CCSc1c(cccc1O)O 62a_100011215382_100010205330 [0,2,0,0,0,0|1,0,1]=4 20221 B12R1.1631 Nc1cccc(c1COCF)Br 34a_100000747656_100015361967 [0,2,0,0,0,0|2,0,0]=4 20222 B12R1.1631 Nc1cccc(c1COCF)Cl 34a_100011916388_100015361967 [0,2,0,0,0,0|2,0,0]=4 20223 B12R1.1631 Nc1cccc(c1COCF)F 34a_100011846719_100015361967 [0,2,0,0,0,0|2,0,0]=4 20224 B12R1.1631 Nc1cccc(c1OCCF)Br 34a_100011934915_100011217306 [0,2,0,0,0,0|2,0,0]=4 20225 B12R1.1631 Nc1cccc(c1OCCF)Cl 34a_100000754742_100011217306 [0,2,0,0,0,0|2,0,0]=4 20226 B12R1.1631 Nc1cccc(c1OCCF)F 34a_100011934987_100011217306 [0,2,0,0,0,0|2,0,0]=4 20227 B12R1.1631 Nc1cccc(c1OCCF)I 34a_100010084371_100011217306 [0,2,0,0,0,0|2,0,0]=4 20228 B12R1.1631 Nc1cccc(c1OCCF)N 34a_200016994477_100011217306 [0,2,0,0,0,0|2,0,0]=4 20229 B12R1.1631 Nc1cccc(c1OCCO)Br 34a_100011934915_100000211926 [0,2,0,0,0,0|2,0,0]=4 20230 B12R1.1631 Nc1cccc(c1OCCO)Cl 34a_100000754742_100000211926 [0,2,0,0,0,0|2,0,0]=4 20231 B12R1.1631 Nc1cccc(c1OCCO)F 34a_100011934987_100000211926 [0,2,0,0,0,0|2,0,0]=4 20232 B12R1.1631 Nc1cccc(c1OCCO)I 34a_100010084371_100000211926 [0,2,0,0,0,0|2,0,0]=4 20233 B12R1.1631 Nc1cccc(c1OCCO)N 34a_200016994477_100000211926 [0,2,0,0,0,0|2,0,0]=4 20234 B12R1.1631 Nc1cccc(c1SCC=O)O 62a_100012183704_200015260668 [0,2,0,0,0,0|1,0,1]=4 20235 B12R1.1631 Nc1cccc(c1SCC=O)O 62a_200015260668_100012183704 [0,2,0,0,0,0|1,0,1]=4 20236 B12R1.1631 Nc1cccc(c1SCCF)Br 62a_100011217306_100020590159 [0,2,0,0,0,0|2,0,0]=4 20237 B12R1.1631 Nc1cccc(c1SCCF)Br 62a_100020590159_100011217306 [0,2,0,0,0,0|2,0,0]=4 20238 B12R1.1631 Nc1cccc(c1SCCF)Cl 62a_100000049713_100011217306 [0,2,0,0,0,0|2,0,0]=4 20239 B12R1.1631 Nc1cccc(c1SCCF)Cl 62a_100011217306_100000049713 [0,2,0,0,0,0|2,0,0]=4 20240 B12R1.1631 Nc1cccc(c1SCCF)F 62a_100000690935_100011217306 [0,2,0,0,0,0|2,0,0]=4 20241 B12R1.1631 Nc1cccc(c1SCCF)F 62a_100011217306_100000690935 [0,2,0,0,0,0|2,0,0]=4 20242 B12R1.1631 Nc1cccc(c1SCCF)O 62a_100011217306_100012183704 [0,2,0,0,0,0|1,0,0]=3 20243 B12R1.1631 Nc1cccc(c1SCCF)O 62a_100012183704_100011217306 [0,2,0,0,0,0|1,0,0]=3 20244 B12R1.1631 Nc1cccc(c1SCCO)Br 62a_100000211926_100020590159 [0,2,0,0,0,0|2,0,0]=4 20245 B12R1.1631 Nc1cccc(c1SCCO)Br 62a_100020590159_100000211926 [0,2,0,0,0,0|2,0,0]=4 20246 B12R1.1631 Nc1cccc(c1SCCO)Cl 62a_100000049713_100000211926 [0,2,0,0,0,0|2,0,0]=4 20247 B12R1.1631 Nc1cccc(c1SCCO)Cl 62a_100000211926_100000049713 [0,2,0,0,0,0|2,0,0]=4 20248 B12R1.1631 Nc1cccc(c1SCCO)F 62a_100000211926_100000690935 [0,2,0,0,0,0|2,0,0]=4 20249 B12R1.1631 Nc1cccc(c1SCCO)F 62a_100000690935_100000211926 [0,2,0,0,0,0|2,0,0]=4 20250 B12R1.1631 Nc1cccc(c1SCCO)O 62a_100000211926_100012183704 [0,2,0,0,0,0|1,0,0]=3 20251 B12R1.1631 Nc1cccc(c1SCCO)O 62a_100012183704_100000211926 [0,2,0,0,0,0|1,0,0]=3 20252 B12R1.1631 O=CCNc1c(cccc1Br)O 34a_100011934926_200009817547 [0,2,0,0,0,0|1,0,1]=4 20253 B12R1.1631 O=CCNc1c(cccc1Cl)O 34a_100012022510_200009817547 [0,2,0,0,0,0|1,0,1]=4 20254 B12R1.1631 O=CCNc1c(cccc1F)O 34a_100020591140_200009817547 [0,2,0,0,0,0|1,0,1]=4 20255 B12R1.1631 O=CCSc1c(cccc1Br)O 62a_100010187912_200015260668 [0,2,0,0,0,0|1,0,1]=4 20256 B12R1.1631 O=CCSc1c(cccc1Br)O 62a_200015260668_100010187912 [0,2,0,0,0,0|1,0,1]=4 20257 B12R1.1631 O=CCSc1c(cccc1Cl)O 62a_200015260668_100000050174 [0,2,0,0,0,0|1,0,1]=4 20258 B12R1.1631 O=CCSc1c(cccc1F)O 62a_100009820682_200015260668 [0,2,0,0,0,0|1,0,1]=4 20259 B12R1.1631 O=CCSc1c(cccc1F)O 62a_200015260668_100009820682 [0,2,0,0,0,0|1,0,1]=4 20260 B12R1.1631 O=CCSc1c(cccc1O)O 62a_200015260668_100010205330 [0,2,0,0,0,0|1,0,1]=4 20261 B12R1.1631 OCCCc1c(cccc1F)O 271570a_203496583355_100021413403 [0,2,0,0,0,0|0,0,0]=2 20262 B12R1.1631 OCCNc1c(cccc1Br)Br 34a_100000690995_100000211926 [0,2,0,0,0,0|2,0,0]=4 20263 B12R1.1631 OCCNc1c(cccc1Br)Cl 34a_100102946385_100000211926 [0,2,0,0,0,0|2,0,0]=4 20264 B12R1.1631 OCCNc1c(cccc1Br)F 34a_100000684712_100000211926 [0,2,0,0,0,0|2,0,0]=4 20265 B12R1.1631 OCCNc1c(cccc1Br)O 34a_100011934926_100000211926 [0,2,0,0,0,0|1,0,0]=3 20266 B12R1.1631 OCCNc1c(cccc1Cl)Cl 34a_100000210028_100000211926 [0,2,0,0,0,0|2,0,0]=4 20267 B12R1.1631 OCCNc1c(cccc1Cl)F 34a_100000760031_100000211926 [0,2,0,0,0,0|2,0,0]=4 20268 B12R1.1631 OCCNc1c(cccc1Cl)O 34a_100012022510_100000211926 [0,2,0,0,0,0|1,0,0]=3 20269 B12R1.1631 OCCNc1c(cccc1F)F 2230a_100000210704_100000211926 [0,2,0,0,0,0|2,0,0]=4 20270 B12R1.1631 OCCNc1c(cccc1F)F 34a_100000210704_100000211926 [0,2,0,0,0,0|2,0,0]=4 20271 B12R1.1631 OCCNc1c(cccc1F)O 34a_100020591140_100000211926 [0,2,0,0,0,0|1,0,0]=3 20272 B12R1.1631 OCCNc1c(cccc1I)F 34a_100000042321_100000211926 [0,2,0,0,0,0|2,0,0]=4 20273 B12R1.1631 OCCOc1c(cccc1Br)Br 34a_100000736428_100000211926 [0,2,0,0,0,0|2,0,0]=4 20274 B12R1.1631 OCCOc1c(cccc1Br)Br 7a_100000736428_100000211926 [0,2,0,0,0,0|2,0,0]=4 20275 B12R1.1631 OCCOc1c(cccc1Br)Cl 34a_100010214474_100000211926 [0,2,0,0,0,0|2,0,0]=4 20276 B12R1.1631 OCCOc1c(cccc1Br)Cl 7a_100010214474_100000211926 [0,2,0,0,0,0|2,0,0]=4 20277 B12R1.1631 OCCOc1c(cccc1Br)F 34a_100009813666_100000211926 [0,2,0,0,0,0|2,0,0]=4 20278 B12R1.1631 OCCOc1c(cccc1Br)F 7a_100009813666_100000211926 [0,2,0,0,0,0|2,0,0]=4 20279 B12R1.1631 OCCOc1c(cccc1Cl)Cl 34a_100000211709_100000211926 [0,2,0,0,0,0|2,0,0]=4 20280 B12R1.1631 OCCOc1c(cccc1Cl)Cl 7a_100000211709_100000211926 [0,2,0,0,0,0|2,0,0]=4 20281 B12R1.1631 OCCOc1c(cccc1Cl)F 34a_100000694953_100000211926 [0,2,0,0,0,0|2,0,0]=4 20282 B12R1.1631 OCCOc1c(cccc1Cl)F 7a_100000694953_100000211926 [0,2,0,0,0,0|2,0,0]=4 20283 B12R1.1631 OCCOc1c(cccc1F)F 34a_100000230165_100000211926 [0,2,0,0,0,0|2,0,0]=4 20284 B12R1.1631 OCCOc1c(cccc1F)F 7a_100000230165_100000211926 [0,2,0,0,0,0|2,0,0]=4 20285 B12R1.1631 OCCOc1c(cccc1I)Br 34a_100010084509_100000211926 [0,2,0,0,0,0|2,0,0]=4 20286 B12R1.1631 OCCOc1c(cccc1I)Br 7a_100010084509_100000211926 [0,2,0,0,0,0|2,0,0]=4 20287 B12R1.1631 OCCOc1c(cccc1I)Cl 34a_100010202889_100000211926 [0,2,0,0,0,0|2,0,0]=4 20288 B12R1.1631 OCCOc1c(cccc1I)Cl 7a_100010202889_100000211926 [0,2,0,0,0,0|2,0,0]=4 20289 B12R1.1631 OCCOc1c(cccc1I)F 34a_100010186298_100000211926 [0,2,0,0,0,0|2,0,0]=4 20290 B12R1.1631 OCCOc1c(cccc1I)F 7a_100010186298_100000211926 [0,2,0,0,0,0|2,0,0]=4 20291 B12R1.1631 OCCSc1c(cccc1Br)Br 62a_100000211926_100009994525 [0,2,0,0,0,0|2,0,0]=4 20292 B12R1.1631 OCCSc1c(cccc1Br)Br 62a_100009994525_100000211926 [0,2,0,0,0,0|2,0,0]=4 20293 B12R1.1631 OCCSc1c(cccc1Br)Cl 62a_100000211926_100010214488 [0,2,0,0,0,0|2,0,0]=4 20294 B12R1.1631 OCCSc1c(cccc1Br)Cl 62a_100010214488_100000211926 [0,2,0,0,0,0|2,0,0]=4 20295 B12R1.1631 OCCSc1c(cccc1Br)F 62a_100000211926_100011219512 [0,2,0,0,0,0|2,0,0]=4 20296 B12R1.1631 OCCSc1c(cccc1Br)F 62a_100011219512_100000211926 [0,2,0,0,0,0|2,0,0]=4 20297 B12R1.1631 OCCSc1c(cccc1Br)O 62a_100000211926_100010187912 [0,2,0,0,0,0|1,0,0]=3 20298 B12R1.1631 OCCSc1c(cccc1Br)O 62a_100010187912_100000211926 [0,2,0,0,0,0|1,0,0]=3 20299 B12R1.1631 OCCSc1c(cccc1Cl)Cl 62a_100000034237_100000211926 [0,2,0,0,0,0|2,0,0]=4 20300 B12R1.1631 OCCSc1c(cccc1Cl)Cl 62a_100000211926_100000034237 [0,2,0,0,0,0|2,0,0]=4 20301 B12R1.1631 OCCSc1c(cccc1Cl)F 62a_100000050007_100000211926 [0,2,0,0,0,0|2,0,0]=4 20302 B12R1.1631 OCCSc1c(cccc1Cl)F 62a_100000211926_100000050007 [0,2,0,0,0,0|2,0,0]=4 20303 B12R1.1631 OCCSc1c(cccc1Cl)O 62a_100000211926_100000050174 [0,2,0,0,0,0|1,0,0]=3 20304 B12R1.1631 OCCSc1c(cccc1F)F 62a_100000211926_100000693133 [0,2,0,0,0,0|2,0,0]=4 20305 B12R1.1631 OCCSc1c(cccc1F)F 62a_100000693133_100000211926 [0,2,0,0,0,0|2,0,0]=4 20306 B12R1.1631 OCCSc1c(cccc1F)O 62a_100000211926_100009820682 [0,2,0,0,0,0|1,0,0]=3 20307 B12R1.1631 OCCSc1c(cccc1F)O 62a_100009820682_100000211926 [0,2,0,0,0,0|1,0,0]=3 20308 B12R1.1631 OCCSc1c(cccc1O)O 62a_100000211926_100010205330 [0,2,0,0,0,0|1,0,0]=3 20309 B12R1.1631 OCCSc1c(ccnc1O)O 62a_100000211926_200009817435 [0,2,0,0,0,0|2,0,0]=4 20310 B12R1.1631 Oc1cccc(c1NCCF)Br 34a_100011934926_100011217306 [0,2,0,0,0,0|1,0,0]=3 20311 B12R1.1631 Oc1cccc(c1NCCF)Cl 34a_100012022510_100011217306 [0,2,0,0,0,0|1,0,0]=3 20312 B12R1.1631 Oc1cccc(c1NCCF)F 34a_100020591140_100011217306 [0,2,0,0,0,0|1,0,0]=3 20313 B12R1.1631 Oc1cccc(c1SCCF)Br 62a_100010187912_100011217306 [0,2,0,0,0,0|1,0,0]=3 20314 B12R1.1631 Oc1cccc(c1SCCF)Br 62a_100011217306_100010187912 [0,2,0,0,0,0|1,0,0]=3 20315 B12R1.1631 Oc1cccc(c1SCCF)Cl 62a_100011217306_100000050174 [0,2,0,0,0,0|1,0,0]=3 20316 B12R1.1631 Oc1cccc(c1SCCF)F 62a_100009820682_100011217306 [0,2,0,0,0,0|1,0,0]=3 20317 B12R1.1631 Oc1cccc(c1SCCF)F 62a_100011217306_100009820682 [0,2,0,0,0,0|1,0,0]=3 20318 B12R1.1631 Oc1cccc(c1SCCF)O 62a_100011217306_100010205330 [0,2,0,0,0,0|1,0,0]=3 20319 B12R1.1631 Oc1ccnc(c1SCCF)O 62a_100011217306_200009817435 [0,2,0,0,0,0|2,0,0]=4 20320 B12R1.1631 [13CH3]NCCc1c(cccc1Cl)Cl 2230a_100032004868_200025704644 [0,2,0,0,0,0|1,0,0]=3 20321 B12R1.1631 [13CH3]NCCc1c(cccc1Cl)Cl 34a_100032004868_200025704644 [0,2,0,0,0,0|1,0,0]=3 20322 B12R1.1631 [13CH3]NCCc1c(cccc1Cl)F 2230a_100000688150_200025704644 [0,2,0,0,0,0|1,0,0]=3 20323 B12R1.1631 [13CH3]NCCc1c(cccc1Cl)F 34a_100000688150_200025704644 [0,2,0,0,0,0|1,0,0]=3 20324 B12R1.1631 [13CH3]OCCc1c(cccc1Cl)Cl 34a_100011934077_200025704644 [0,2,0,0,0,0|1,0,0]=3 20325 B12R1.1631 [13CH3]OCCc1c(cccc1Cl)Cl 7a_100011934077_200025704644 [0,2,0,0,0,0|1,0,0]=3 20326 B12R1.1631 [13CH3]OCCc1c(cccc1Cl)F 34a_100011273940_200025704644 [0,2,0,0,0,0|1,0,0]=3 20327 B12R1.1631 [13CH3]OCCc1c(cccc1Cl)F 7a_100011273940_200025704644 [0,2,0,0,0,0|1,0,0]=3 20328 B12R1.1631 [13CH3]OCCc1c(cccc1F)F 34a_100011975733_200025704644 [0,2,0,0,0,0|1,0,0]=3 20329 B12R1.1631 [13CH3]OCCc1c(cccc1F)F 7a_100011975733_200025704644 [0,2,0,0,0,0|1,0,0]=3 20330 B12R1.1631 [13CH3]SCCc1c(cccc1Cl)Cl 62a_100012161200_200025704644 [0,2,0,0,0,0|1,0,0]=3 20331 B12R1.1631 [13CH3]SCCc1c(cccc1Cl)Cl 62a_200025704644_100012161200 [0,2,0,0,0,0|1,0,0]=3 20332 B12R1.75 C#Cc1ccccc1NC(C)C 34a_100011470550_100000210206 [0,2,0,0,0,0|2,0,0]=4 20333 B12R1.75 C#Cc1ccccc1OC(C)C 34a_200011470546_100000210206 [0,2,0,0,0,0|2,0,0]=4 20334 B12R1.75 C#Cc1ccccc1OC(C)C 7a_200011470546_100000210206 [0,2,0,0,0,0|2,0,0]=4 20335 B12R1.75 C=Cc1ccccc1CC(=O)C 271570a_100011290941_100011350739 [0,2,0,0,0,0|1,0,1]=4 20336 B12R1.75 C=Cc1ccccc1CN(C)C 271570a_100011290941_100000174758 [0,2,0,0,0,0|2,0,0]=4 20337 B12R1.75 C=Cc1ccccc1NC(C)C 271570a_100011290941_100000219599 [0,2,0,0,0,0|2,0,0]=4 20338 B12R1.75 C=Cc1ccccc1NC(C)C 34a_100012022501_100000210206 [0,2,0,0,0,0|2,0,0]=4 20339 B12R1.75 C=Cc1ccccc1OC(C)C 271570a_100011290941_100000173919 [0,2,0,0,0,0|2,0,0]=4 20340 B12R1.75 C=Cc1ccccc1SC(C)C 62a_100000210206_100011218376 [0,2,0,0,0,0|2,0,0]=4 20341 B12R1.75 C=Cc1ccccc1SC(C)C 62a_100011218376_100000210206 [0,2,0,0,0,0|2,0,0]=4 20342 B12R1.75 CC(=Cc1ccccc1CO)C 271570a_100102525489_100000187465 [0,2,0,0,0,0|0,0,2]=4 20343 B12R1.75 CC(=O)Cc1ccccc1C#N 1458a_100000070787_100000181865 [0,2,0,0,0,0|1,0,1]=4 20344 B12R1.75 CC(=O)Cc1ccccc1C#N 1458a_100000238613_200000210301 [0,2,0,0,0,0|1,0,1]=4 20345 B12R1.75 CC(=O)Cc1ccccc1C=O 1458a_100000070787_200009853537 [0,2,0,0,0,0|0,0,2]=4 20346 B12R1.75 CC(=O)Cc1ccccc1CO 1458a_100000070787_100009816955 [0,2,0,0,0,0|0,0,1]=3 20347 B12R1.75 CC(=O)Cc1ccccc1S[13CH3] 62a_100011350739_200025704644 [0,2,0,0,0,0|0,1,1]=4 20348 B12R1.75 CC(=O)Cc1ccccc1S[13CH3] 62a_200025704644_100011350739 [0,2,0,0,0,0|0,1,1]=4 20349 B12R1.75 CC(=O)Nc1ccccc1CO 22a_100000212039_100000070787 [0,2,0,0,0,0|1,0,1]=4 20350 B12R1.75 CC(=O)Nc1ccccc1O[13CH3] 34a_100000185124_200025704644 [0,2,0,0,0,0|1,0,1]=4 20351 B12R1.75 CC(=O)Nc1ccccc1O[13CH3] 7a_100000185124_200025704644 [0,2,0,0,0,0|1,0,1]=4 20352 B12R1.75 CC(C)Nc1ccccc1C#N 34a_100000211148_100000210206 [0,2,0,0,0,0|2,0,0]=4 20353 B12R1.75 CC(C)Nc1ccccc1CO 34a_100000212039_100000210206 [0,2,0,0,0,0|1,0,0]=3 20354 B12R1.75 CC(C)Nc1ccccc1S[13CH3] 62a_100000219599_200025704644 [0,2,0,0,0,0|1,1,0]=4 20355 B12R1.75 CC(C)Nc1ccccc1S[13CH3] 62a_200025704644_100000219599 [0,2,0,0,0,0|1,1,0]=4 20356 B12R1.75 CC(C)Nc1ccncc1CO 27a_100138425928_100000117392 [0,2,0,0,0,0|2,0,0]=4 20357 B12R1.75 CC(C)Oc1ccccc1C#N 34a_100000211048_100000210206 [0,2,0,0,0,0|2,0,0]=4 20358 B12R1.75 CC(C)Oc1ccccc1C#N 7a_100000211048_100000210206 [0,2,0,0,0,0|2,0,0]=4 20359 B12R1.75 CC(C)Oc1ccccc1CN 34a_100000185550_100000210206 [0,2,0,0,0,0|2,0,0]=4 20360 B12R1.75 CC(C)Oc1ccccc1CO 34a_100011216872_100000210206 [0,2,0,0,0,0|1,0,0]=3 20361 B12R1.75 CC(C)Oc1ccccc1N[13CH3] 2230a_100000739276_200025704644 [0,2,0,0,0,0|2,0,0]=4 20362 B12R1.75 CC(C)Oc1ccccc1N[13CH3] 34a_100000739276_200025704644 [0,2,0,0,0,0|2,0,0]=4 20363 B12R1.75 CC(C)Oc1ccccc1O[13CH3] 34a_100011218612_200025704644 [0,2,0,0,0,0|1,0,0]=3 20364 B12R1.75 CC(C)Oc1ccccc1O[13CH3] 7a_100011218612_200025704644 [0,2,0,0,0,0|1,0,0]=3 20365 B12R1.75 CC(C)Oc1ccccc1S[13CH3] 62a_100000173919_200025704644 [0,2,0,0,0,0|1,1,0]=4 20366 B12R1.75 CC(C)Oc1ccccc1S[13CH3] 62a_200025704644_100000173919 [0,2,0,0,0,0|1,1,0]=4 20367 B12R1.75 CC(C)Oc1cccnc1CO 34a_100000731849_100000210206 [0,2,0,0,0,0|2,0,0]=4 20368 B12R1.75 CC(C)Oc1cnccc1CO 34a_100000078615_100000210206 [0,2,0,0,0,0|2,0,0]=4 20369 B12R1.75 CC(C)Sc1ccccc1C#N 62a_100000210206_100000188569 [0,2,0,0,0,0|2,0,0]=4 20370 B12R1.75 CC(C)Sc1ccccc1C=O 62a_100000210073_100000210206 [0,2,0,0,0,0|1,0,1]=4 20371 B12R1.75 CC(C)Sc1ccccc1C=O 62a_100000210206_100000210073 [0,2,0,0,0,0|1,0,1]=4 20372 B12R1.75 CC(C)Sc1ccccc1CN 62a_100000210206_100000689332 [0,2,0,0,0,0|2,0,0]=4 20373 B12R1.75 CC(C)Sc1ccccc1CN 62a_100000689332_100000210206 [0,2,0,0,0,0|2,0,0]=4 20374 B12R1.75 CC(C)Sc1ccccc1CO 62a_100000187465_100000210206 [0,2,0,0,0,0|1,0,0]=3 20375 B12R1.75 CC(C)Sc1ccccc1CO 62a_100000210206_100000187465 [0,2,0,0,0,0|1,0,0]=3 20376 B12R1.75 CC(C)Sc1ccccc1NN 62a_100000210206_100000241748 [0,2,0,0,0,0|2,0,0]=4 20377 B12R1.75 CC(C)Sc1ccccc1NN 62a_100000241748_100000210206 [0,2,0,0,0,0|2,0,0]=4 20378 B12R1.75 CC(C)Sc1ccccc1N[13CH3] 2230a_100000688217_200025704644 [0,2,0,0,0,0|2,0,0]=4 20379 B12R1.75 CC(C)Sc1ccccc1N[13CH3] 34a_100000688217_200025704644 [0,2,0,0,0,0|2,0,0]=4 20380 B12R1.75 CC(C)Sc1cccnc1CO 62a_100000210206_100011996772 [0,2,0,0,0,0|2,0,0]=4 20381 B12R1.75 CC(C)Sc1cccnc1CO 62a_100011996772_100000210206 [0,2,0,0,0,0|2,0,0]=4 20382 B12R1.75 CC(C)Sc1ccncc1CO 62a_100000117392_100000210206 [0,2,0,0,0,0|2,0,0]=4 20383 B12R1.75 CC(C)Sc1ccncc1CO 62a_100000210206_100000117392 [0,2,0,0,0,0|2,0,0]=4 20384 B12R1.75 CC(C)Sc1cnccc1CO 62a_100000210206_100009873359 [0,2,0,0,0,0|2,0,0]=4 20385 B12R1.75 CC(C)Sc1cnccc1CO 62a_100009873359_100000210206 [0,2,0,0,0,0|2,0,0]=4 20386 B12R1.75 CC(C)Sc1ncccc1CO 62a_100000210206_100000748726 [0,2,0,0,0,0|2,0,0]=4 20387 B12R1.75 CC(C)Sc1ncccc1CO 62a_100000748726_100000210206 [0,2,0,0,0,0|2,0,0]=4 20388 B12R1.75 CCc1ccccc1CN(C)C 270004a_100102631434_100011219594 [0,2,0,0,0,0|2,0,0]=4 20389 B12R1.75 CCc1ccccc1NC(C)C 2230a_100000212081_100000210206 [0,2,0,0,0,0|2,0,0]=4 20390 B12R1.75 CCc1ccccc1NC(C)C 34a_100000212081_100000210206 [0,2,0,0,0,0|2,0,0]=4 20391 B12R1.75 CCc1ccccc1NC(C)C 7a_100000212081_100000210206 [0,2,0,0,0,0|2,0,0]=4 20392 B12R1.75 CCc1ccccc1OC(C)C 34a_100000210936_100000210206 [0,2,0,0,0,0|2,0,0]=4 20393 B12R1.75 CCc1ccccc1OC(C)C 7a_100000210936_100000210206 [0,2,0,0,0,0|2,0,0]=4 20394 B12R1.75 CCc1ccccc1SC(C)C 62a_100000210206_100011215823 [0,2,0,0,0,0|2,0,0]=4 20395 B12R1.75 CCc1ccccc1SC(C)C 62a_100011215823_100000210206 [0,2,0,0,0,0|2,0,0]=4 20396 B12R1.75 CN(C)Cc1ccccc1C#N 2230a_100000225633_200000210301 [0,2,0,0,0,0|2,0,0]=4 20397 B12R1.75 CN(C)Cc1ccccc1C#N 2230a_100102631434_100000181865 [0,2,0,0,0,0|2,0,0]=4 20398 B12R1.75 CN(C)Cc1ccccc1C#N 269982a_100000225633_200000210301 [0,2,0,0,0,0|2,0,0]=4 20399 B12R1.75 CN(C)Cc1ccccc1C#N 269982a_100102631434_100000181865 [0,2,0,0,0,0|2,0,0]=4 20400 B12R1.75 CN(C)Cc1ccccc1C=O 2230a_100102631434_200009853537 [0,2,0,0,0,0|1,0,1]=4 20401 B12R1.75 CN(C)Cc1ccccc1C=O 269982a_100102631434_200009853537 [0,2,0,0,0,0|1,0,1]=4 20402 B12R1.75 CN(C)Cc1ccccc1CO 2230a_100000044721_200000210301 [0,2,0,0,0,0|1,0,0]=3 20403 B12R1.75 CN(C)Cc1ccccc1CO 2230a_100102631434_100009816955 [0,2,0,0,0,0|1,0,0]=3 20404 B12R1.75 CN(C)Cc1ccccc1CO 269982a_100000044721_200000210301 [0,2,0,0,0,0|1,0,0]=3 20405 B12R1.75 CN(C)Cc1ccccc1CO 269982a_100102631434_100009816955 [0,2,0,0,0,0|1,0,0]=3 20406 B12R1.75 CN(C)Cc1ccccc1S[13CH3] 62a_100000174758_200025704644 [0,2,0,0,0,0|1,1,0]=4 20407 B12R1.75 CN(C)Cc1ccccc1S[13CH3] 62a_200025704644_100000174758 [0,2,0,0,0,0|1,1,0]=4 20408 B12R1.75 CN([13CH3])Cc1ccccc1C#N 2230a_100000225633_200025704644 [0,2,0,0,0,0|2,0,0]=4 20409 B12R1.75 CN([13CH3])Cc1ccccc1C#N 269982a_100000225633_200025704644 [0,2,0,0,0,0|2,0,0]=4 20410 B12R1.75 CN([13CH3])Cc1ccccc1CO 2230a_100000044721_200025704644 [0,2,0,0,0,0|1,0,0]=3 20411 B12R1.75 CN([13CH3])Cc1ccccc1CO 269982a_100000044721_200025704644 [0,2,0,0,0,0|1,0,0]=3 20412 B12R1.75 CNc1ccccc1OC(C)C 2230a_100000739276_200000210301 [0,2,0,0,0,0|2,0,0]=4 20413 B12R1.75 CNc1ccccc1OC(C)C 34a_100000033821_100000210206 [0,2,0,0,0,0|2,0,0]=4 20414 B12R1.75 CNc1ccccc1OC(C)C 34a_100000739276_200000210301 [0,2,0,0,0,0|2,0,0]=4 20415 B12R1.75 CNc1ccccc1SC(C)C 2230a_100000688217_200000210301 [0,2,0,0,0,0|2,0,0]=4 20416 B12R1.75 CNc1ccccc1SC(C)C 34a_100000688217_200000210301 [0,2,0,0,0,0|2,0,0]=4 20417 B12R1.75 CNc1ccccc1SC(C)C 62a_100000210206_100020606079 [0,2,0,0,0,0|2,0,0]=4 20418 B12R1.75 CNc1ccccc1SC(C)C 62a_100020606079_100000210206 [0,2,0,0,0,0|2,0,0]=4 20419 B12R1.75 COc1ccccc1C=C(C)C 271570a_100102525489_100000174000 [0,2,0,0,0,0|0,0,2]=4 20420 B12R1.75 COc1ccccc1CC(=O)C 1458a_100000070787_100000210004 [0,2,0,0,0,0|0,0,1]=3 20421 B12R1.75 COc1ccccc1CC(=O)C 1458a_100000211604_200000210301 [0,2,0,0,0,0|0,0,1]=3 20422 B12R1.75 COc1ccccc1CC(=O)[13CH3] 1458a_100000211604_200025704644 [0,2,0,0,0,0|0,0,1]=3 20423 B12R1.75 COc1ccccc1CN(C)C 2230a_100000184376_200000210301 [0,2,0,0,0,0|1,0,0]=3 20424 B12R1.75 COc1ccccc1CN(C)C 2230a_100102631434_100000210004 [0,2,0,0,0,0|1,0,0]=3 20425 B12R1.75 COc1ccccc1CN(C)C 269982a_100000184376_200000210301 [0,2,0,0,0,0|1,0,0]=3 20426 B12R1.75 COc1ccccc1CN(C)C 269982a_100102631434_100000210004 [0,2,0,0,0,0|1,0,0]=3 20427 B12R1.75 COc1ccccc1CN(C)C 270004a_100102631434_100000169842 [0,2,0,0,0,0|1,0,0]=3 20428 B12R1.75 COc1ccccc1CN(C)[13CH3] 2230a_100000184376_200025704644 [0,2,0,0,0,0|1,0,0]=3 20429 B12R1.75 COc1ccccc1CN(C)[13CH3] 269982a_100000184376_200025704644 [0,2,0,0,0,0|1,0,0]=3 20430 B12R1.75 COc1ccccc1NC(=O)C 11a_100000210025_100015343762 [0,2,0,0,0,0|1,0,1]=4 20431 B12R1.75 COc1ccccc1NC(=O)C 1626a_100000210025_100015343762 [0,2,0,0,0,0|1,0,1]=4 20432 B12R1.75 COc1ccccc1NC(=O)C 22a_100000210025_100000070787 [0,2,0,0,0,0|1,0,1]=4 20433 B12R1.75 COc1ccccc1NC(=O)C 34a_100000185124_200000210301 [0,2,0,0,0,0|1,0,1]=4 20434 B12R1.75 COc1ccccc1NC(=O)C 527a_100000210025_100103153847 [0,2,0,0,0,0|1,0,1]=4 20435 B12R1.75 COc1ccccc1NC(=O)C 7a_100000185124_200000210301 [0,2,0,0,0,0|1,0,1]=4 20436 B12R1.75 COc1ccccc1NC(C)C 34a_100000210025_100000210206 [0,2,0,0,0,0|1,0,0]=3 20437 B12R1.75 COc1ccccc1OC(C)C 34a_100000210385_100000210206 [0,2,0,0,0,0|1,0,0]=3 20438 B12R1.75 COc1ccccc1OC(C)C 34a_100011218612_200000210301 [0,2,0,0,0,0|1,0,0]=3 20439 B12R1.75 COc1ccccc1OC(C)C 7a_100011218612_200000210301 [0,2,0,0,0,0|1,0,0]=3 20440 B12R1.75 COc1ccccc1OC(F)F 34a_100000752575_200000210301 [0,2,0,0,0,0|2,0,0]=4 20441 B12R1.75 COc1ccccc1OC(F)F 7a_100000752575_200000210301 [0,2,0,0,0,0|2,0,0]=4 20442 B12R1.75 COc1ccccc1SC(C)C 62a_100000210206_100000210334 [0,2,0,0,0,0|1,0,0]=3 20443 B12R1.75 COc1ccccc1SC(C)C 62a_100000210334_100000210206 [0,2,0,0,0,0|1,0,0]=3 20444 B12R1.75 COc1cccnc1CN(C)C 270004a_100102631434_100011912573 [0,2,0,0,0,0|2,0,0]=4 20445 B12R1.75 COc1cccnc1OC(C)C 34a_100025773188_100000210206 [0,2,0,0,0,0|2,0,0]=4 20446 B12R1.75 COc1cccnc1SC(C)C 62a_100000210206_100000690851 [0,2,0,0,0,0|2,0,0]=4 20447 B12R1.75 COc1cccnc1SC(C)C 62a_100000767102_100000210206 [0,2,0,0,0,0|2,0,0]=4 20448 B12R1.75 COc1ccncc1CN(C)C 270004a_100102631434_200011997045 [0,2,0,0,0,0|2,0,0]=4 20449 B12R1.75 COc1ccncc1OC(C)C 34a_100000101186_100000210206 [0,2,0,0,0,0|2,0,0]=4 20450 B12R1.75 COc1ccncc1SC(C)C 62a_100000210206_100011997281 [0,2,0,0,0,0|2,0,0]=4 20451 B12R1.75 COc1ccncc1SC(C)C 62a_100011997281_100000210206 [0,2,0,0,0,0|2,0,0]=4 20452 B12R1.75 COc1cnccc1CC(=O)C 1458a_100000070787_100020635607 [0,2,0,0,0,0|1,0,1]=4 20453 B12R1.75 COc1cnccc1CN(C)C 2230a_100102631434_100020635607 [0,2,0,0,0,0|2,0,0]=4 20454 B12R1.75 COc1cnccc1CN(C)C 270004a_100102631434_100011361505 [0,2,0,0,0,0|2,0,0]=4 20455 B12R1.75 COc1cnccc1SC(C)C 62a_100000210206_100016988167 [0,2,0,0,0,0|2,0,0]=4 20456 B12R1.75 COc1cnccc1SC(C)C 62a_100016988167_100000210206 [0,2,0,0,0,0|2,0,0]=4 20457 B12R1.75 COc1ncccc1CC(=O)C 1458a_100000070787_100020631285 [0,2,0,0,0,0|1,0,1]=4 20458 B12R1.75 COc1ncccc1CN(C)C 2230a_100102631434_100020631285 [0,2,0,0,0,0|2,0,0]=4 20459 B12R1.75 COc1ncccc1CN(C)C 270004a_100102631434_100011290804 [0,2,0,0,0,0|2,0,0]=4 20460 B12R1.75 COc1ncccc1OC(C)C 34a_100000698397_100000210206 [0,2,0,0,0,0|2,0,0]=4 20461 B12R1.75 COc1ncccc1OC(C)C 7a_100000698397_100000210206 [0,2,0,0,0,0|2,0,0]=4 20462 B12R1.75 COc1ncccc1SC(C)C 62a_100000047025_100000210206 [0,2,0,0,0,0|2,0,0]=4 20463 B12R1.75 COc1ncccc1SC(C)C 62a_100000210206_100000047025 [0,2,0,0,0,0|2,0,0]=4 20464 B12R1.75 CSc1ccccc1CC(=O)C 1458a_100000070787_100000699184 [0,2,0,0,0,0|0,1,1]=4 20465 B12R1.75 CSc1ccccc1CC(=O)C 62a_100011350739_200000210301 [0,2,0,0,0,0|0,1,1]=4 20466 B12R1.75 CSc1ccccc1CC(=O)C 62a_200000210301_100011350739 [0,2,0,0,0,0|0,1,1]=4 20467 B12R1.75 CSc1ccccc1CN(C)C 2230a_100102631434_100000699184 [0,2,0,0,0,0|1,1,0]=4 20468 B12R1.75 CSc1ccccc1CN(C)C 269982a_100102631434_100000699184 [0,2,0,0,0,0|1,1,0]=4 20469 B12R1.75 CSc1ccccc1CN(C)C 270004a_100102631434_100011217347 [0,2,0,0,0,0|1,1,0]=4 20470 B12R1.75 CSc1ccccc1CN(C)C 62a_100000174758_200000210301 [0,2,0,0,0,0|1,1,0]=4 20471 B12R1.75 CSc1ccccc1CN(C)C 62a_200000210301_100000174758 [0,2,0,0,0,0|1,1,0]=4 20472 B12R1.75 CSc1ccccc1NC(C)C 34a_100000211160_100000210206 [0,2,0,0,0,0|1,1,0]=4 20473 B12R1.75 CSc1ccccc1NC(C)C 62a_100000219599_200000210301 [0,2,0,0,0,0|1,1,0]=4 20474 B12R1.75 CSc1ccccc1NC(C)C 62a_200000210301_100000219599 [0,2,0,0,0,0|1,1,0]=4 20475 B12R1.75 CSc1ccccc1OC(C)C 34a_100011216402_100000210206 [0,2,0,0,0,0|1,1,0]=4 20476 B12R1.75 CSc1ccccc1OC(C)C 62a_100000173919_200000210301 [0,2,0,0,0,0|1,1,0]=4 20477 B12R1.75 CSc1ccccc1OC(C)C 62a_200000210301_100000173919 [0,2,0,0,0,0|1,1,0]=4 20478 B12R1.75 CSc1ccccc1SC(C)C 62a_100000210206_100011217816 [0,2,0,0,0,0|1,1,0]=4 20479 B12R1.75 CSc1ccccc1SC(C)C 62a_100011217816_100000210206 [0,2,0,0,0,0|1,1,0]=4 20480 B12R1.75 [13CH3]C(=O)Cc1ccccc1C#N 1458a_100000238613_200025704644 [0,2,0,0,0,0|1,0,1]=4 20481 B12R1.75 [13CH3]Oc1ccccc1OC(F)F 34a_100000752575_200025704644 [0,2,0,0,0,0|2,0,0]=4 20482 B12R1.75 [13CH3]Oc1ccccc1OC(F)F 7a_100000752575_200025704644 [0,2,0,0,0,0|2,0,0]=4 20483 B12R1.77 C#Cc1ccccc1C(=O)CC 1458a_100011243808_100000210202 [0,2,0,0,0,0|1,0,1]=4 20484 B12R1.77 C=Cc1ccccc1C(=O)CC 1458a_100011830265_100000210202 [0,2,0,0,0,0|1,0,1]=4 20485 B12R1.77 C=Cc1ccccc1C(C)NC 271570a_100011290941_100000692418 [0,2,0,0,0,0|2,0,0]=4 20486 B12R1.77 C=Cc1ccccc1C(O)CN 271570a_100011290941_100011236429 [0,2,0,0,0,0|2,0,0]=4 20487 B12R1.77 C=Cc1ccccc1[C@H](N)CO 271570a_100011290941_100161155918 [0,2,0,0,0,0|2,0,0]=4 20488 B12R1.77 CC(N[13CH3])c1ccccc1C#N 2230a_100160469468_200025704644 [0,2,0,0,0,0|2,0,0]=4 20489 B12R1.77 CCC(=O)c1ccccc1C#N 1458a_100000742908_100000210202 [0,2,0,0,0,0|1,0,1]=4 20490 B12R1.77 CCC(=O)c1ccccc1CC 1458a_100000689120_100000210202 [0,2,0,0,0,0|1,0,1]=4 20491 B12R1.77 CCC(=O)c1ccccc1CO 1458a_100011301526_100000210202 [0,2,0,0,0,0|0,0,1]=3 20492 B12R1.77 CCC(=O)c1ccccc1I=O 1458a_100000032414_100000210202 [0,2,0,0,0,0|0,0,2]=4 20493 B12R1.77 CCC(=O)c1ccccc1OC 1458a_100000185835_100000210202 [0,2,0,0,0,0|0,0,1]=3 20494 B12R1.77 CCC(=O)c1ccccc1OC 7a_100000184720_200000210301 [0,2,0,0,0,0|0,0,1]=3 20495 B12R1.77 CCC(=O)c1ccccc1O[13CH3] 7a_100000184720_200025704644 [0,2,0,0,0,0|0,0,1]=3 20496 B12R1.77 CCC(=O)c1ccccc1SC 1458a_100000183967_100000210202 [0,2,0,0,0,0|0,1,1]=4 20497 B12R1.77 CCC(C)c1ccccc1NC 2230a_200000211393_200000210301 [0,2,0,0,0,0|1,0,0]=3 20498 B12R1.77 CCC(C)c1ccccc1NC 7a_200000211393_200000210301 [0,2,0,0,0,0|1,0,0]=3 20499 B12R1.77 CCC(C)c1ccccc1N[13CH3] 2230a_200000211393_200025704644 [0,2,0,0,0,0|1,0,0]=3 20500 B12R1.77 CCC(C)c1ccccc1N[13CH3] 7a_200000211393_200025704644 [0,2,0,0,0,0|1,0,0]=3 20501 B12R1.77 CCC(C)c1ccccc1OC 7a_100000211618_200000210301 [0,2,0,0,0,0|0,0,0]=2 20502 B12R1.77 CCC(C)c1ccccc1O[13CH3] 7a_100000211618_200025704644 [0,2,0,0,0,0|0,0,0]=2 20503 B12R1.77 CCN(C)c1ccccc1C#N 2230a_100000744078_100000210202 [0,2,0,0,0,0|2,0,0]=4 20504 B12R1.77 CCN(C)c1ccccc1C#N 2230a_200000218880_200000210301 [0,2,0,0,0,0|2,0,0]=4 20505 B12R1.77 CCN(C)c1ccccc1C#N 269982a_100000744078_100000204670 [0,2,0,0,0,0|2,0,0]=4 20506 B12R1.77 CCN(C)c1ccccc1C#N 269982a_200000218880_200000210301 [0,2,0,0,0,0|2,0,0]=4 20507 B12R1.77 CCN(C)c1ccccc1OC 2230a_100000219746_100000210202 [0,2,0,0,0,0|1,0,0]=3 20508 B12R1.77 CCN(C)c1ccccc1OC 2230a_100020603010_200000210301 [0,2,0,0,0,0|1,0,0]=3 20509 B12R1.77 CCN(C)c1ccccc1OC 269982a_100000219746_100000204670 [0,2,0,0,0,0|1,0,0]=3 20510 B12R1.77 CCN(C)c1ccccc1OC 269982a_100020603010_200000210301 [0,2,0,0,0,0|1,0,0]=3 20511 B12R1.77 CCN(C)c1ccccc1OC 34a_100000219746_100000210202 [0,2,0,0,0,0|1,0,0]=3 20512 B12R1.77 CCN([13CH3])c1ccccc1C#N 2230a_200000218880_200025704644 [0,2,0,0,0,0|2,0,0]=4 20513 B12R1.77 CCN([13CH3])c1ccccc1C#N 269982a_200000218880_200025704644 [0,2,0,0,0,0|2,0,0]=4 20514 B12R1.77 CCN([13CH3])c1ccccc1OC 2230a_100020603010_200025704644 [0,2,0,0,0,0|1,0,0]=3 20515 B12R1.77 CCN([13CH3])c1ccccc1OC 269982a_100020603010_200025704644 [0,2,0,0,0,0|1,0,0]=3 20516 B12R1.77 CNC(=O)c1ccccc1OC 11a_106832991635_100000185835 [0,2,0,0,0,0|1,0,1]=4 20517 B12R1.77 CNC(=O)c1ccccc1OC 1626a_100102657272_100000185835 [0,2,0,0,0,0|1,0,1]=4 20518 B12R1.77 CNC(=O)c1ccccc1OC 240690a_100102657272_100000185835 [0,2,0,0,0,0|1,0,1]=4 20519 B12R1.77 CNC(=O)c1ccccc1OC 34a_100000185920_200000210301 [0,2,0,0,0,0|1,0,1]=4 20520 B12R1.77 CNC(=O)c1ccccc1OC 527a_100102657272_100000185835 [0,2,0,0,0,0|1,0,1]=4 20521 B12R1.77 CNC(=O)c1ccccc1OC 7a_100000185920_200000210301 [0,2,0,0,0,0|1,0,1]=4 20522 B12R1.77 CNC(=O)c1ccccc1O[13CH3] 34a_100000185920_200025704644 [0,2,0,0,0,0|1,0,1]=4 20523 B12R1.77 CNC(=O)c1ccccc1O[13CH3] 7a_100000185920_200025704644 [0,2,0,0,0,0|1,0,1]=4 20524 B12R1.77 CNC(C)c1ccccc1C#N 2230a_100160469468_200000210301 [0,2,0,0,0,0|2,0,0]=4 20525 B12R1.77 CNC(C)c1ccccc1OC 2230a_100000185323_200000210301 [0,2,0,0,0,0|1,0,0]=3 20526 B12R1.77 CNC(C)c1ccccc1OC 269862a_106832991636_100000173324 [0,2,0,0,0,0|1,0,0]=3 20527 B12R1.77 CNC(C)c1ccccc1SC 62a_100000692418_200000210301 [0,2,0,0,0,0|1,1,0]=4 20528 B12R1.77 CNC(C)c1ccccc1SC 62a_200000210301_100000692418 [0,2,0,0,0,0|1,1,0]=4 20529 B12R1.77 CNC(C)c1ccccc1S[13CH3] 62a_100000692418_200025704644 [0,2,0,0,0,0|1,1,0]=4 20530 B12R1.77 CNC(C)c1ccccc1S[13CH3] 62a_200025704644_100000692418 [0,2,0,0,0,0|1,1,0]=4 20531 B12R1.77 CNC(C)c1cccnc1OC 269862a_106832991636_100012184464 [0,2,0,0,0,0|2,0,0]=4 20532 B12R1.77 CNC(C)c1ncccc1OC 269862a_106832991636_100012185210 [0,2,0,0,0,0|2,0,0]=4 20533 B12R1.77 COC(=O)c1ccccc1OC 7a_100000150335_200000210301 [0,2,0,0,0,0|1,0,1]=4 20534 B12R1.77 COC(=O)c1ccccc1O[13CH3] 7a_100000150335_200025704644 [0,2,0,0,0,0|1,0,1]=4 20535 B12R1.77 COc1ccccc1C(=O)CBr 7a_100000188908_200000210301 [0,2,0,0,0,0|1,0,1]=4 20536 B12R1.77 COc1ccccc1C(=O)CF 1458a_100000185835_100015361967 [0,2,0,0,0,0|1,0,1]=4 20537 B12R1.77 COc1ccccc1C(C)N[13CH3] 2230a_100000185323_200025704644 [0,2,0,0,0,0|1,0,0]=3 20538 B12R1.77 COc1ccccc1C(C)OC 7a_100000742714_200000210301 [0,2,0,0,0,0|1,0,0]=3 20539 B12R1.77 COc1ccccc1C(C)O[13CH3] 7a_100000742714_200025704644 [0,2,0,0,0,0|1,0,0]=3 20540 B12R1.77 COc1ccccc1N(C)CF 269982a_100000219746_100015361967 [0,2,0,0,0,0|2,0,0]=4 20541 B12R1.77 COc1ccccc1N(C)CF 34a_100000219746_100015361967 [0,2,0,0,0,0|2,0,0]=4 20542 B12R1.77 CSc1ccccc1C(O)CN 62a_100011236429_200000210301 [0,2,0,0,0,0|1,1,0]=4 20543 B12R1.77 CSc1ccccc1C(O)CN 62a_200000210301_100011236429 [0,2,0,0,0,0|1,1,0]=4 20544 B12R1.77 CSc1ccccc1[C@H](N)CO 62a_100161155918_200000210301 [0,2,0,0,0,0|1,1,0]=4 20545 B12R1.77 CSc1ccccc1[C@H](N)CO 62a_200000210301_100161155918 [0,2,0,0,0,0|1,1,0]=4 20546 B12R1.77 O=C(CF)c1ccccc1CO 1458a_100011301526_100015361967 [0,2,0,0,0,0|1,0,1]=4 20547 B12R1.77 [13CH3]Oc1ccccc1C(=O)CBr 7a_100000188908_200025704644 [0,2,0,0,0,0|1,0,1]=4 20548 B12R1.77 [13CH3]Sc1ccccc1C(O)CN 62a_100011236429_200025704644 [0,2,0,0,0,0|1,1,0]=4 20549 B12R1.77 [13CH3]Sc1ccccc1C(O)CN 62a_200025704644_100011236429 [0,2,0,0,0,0|1,1,0]=4 20550 B12R1.77 [13CH3]Sc1ccccc1[C@H](N)CO 62a_100161155918_200025704644 [0,2,0,0,0,0|1,1,0]=4 20551 B12R1.77 [13CH3]Sc1ccccc1[C@H](N)CO 62a_200025704644_100161155918 [0,2,0,0,0,0|1,1,0]=4 20552 B12R1.112 C#Cc1cc(ccc1NCC)C 34a_200012001881_100000210202 [0,2,0,0,0,0|2,0,0]=4 20553 B12R1.112 C=Cc1cc(ccc1CNC)F 271570a_100011290941_200011192132 [0,2,0,0,0,0|2,0,0]=4 20554 B12R1.112 C=Cc1cc(ccc1OCC)C 271570a_100011290941_200000230997 [0,2,0,0,0,0|2,0,0]=4 20555 B12R1.112 C=Cc1cc(ccc1OCC)F 271570a_100011290941_100000171695 [0,2,0,0,0,0|2,0,0]=4 20556 B12R1.112 C=Cc1cc(ccc1SCC)F 62a_100000210202_100012356183 [0,2,0,0,0,0|2,0,0]=4 20557 B12R1.112 C=Cc1cc(ccc1SCC)F 62a_100012356183_100000210202 [0,2,0,0,0,0|2,0,0]=4 20558 B12R1.112 CC=Cc1ccc(cc1CO)Br 271570a_100016259895_100011356890 [0,2,0,0,0,0|0,0,2]=4 20559 B12R1.112 CC=Cc1ccc(cc1CO)C 271570a_100016259895_100012361352 [0,2,0,0,0,0|0,0,2]=4 20560 B12R1.112 CC=Cc1ccc(cc1CO)F 271570a_100016259895_100011217561 [0,2,0,0,0,0|0,0,2]=4 20561 B12R1.112 CC=Cc1ccc(cc1CO)N 271570a_100016259895_100012347228 [0,2,0,0,0,0|0,0,2]=4 20562 B12R1.112 CC=Cc1ccc(cc1CO)O 271570a_100016259895_100012351483 [0,2,0,0,0,0|0,0,2]=4 20563 B12R1.112 CC=Cc1ccc(cc1OC)Br 271570a_100016259895_100010245111 [0,2,0,0,0,0|0,0,2]=4 20564 B12R1.112 CC=Cc1ccc(cc1OC)C 271570a_100016259895_100010200004 [0,2,0,0,0,0|0,0,2]=4 20565 B12R1.112 CC=Cc1ccc(cc1OC)Cl 271570a_100016259895_100000050115 [0,2,0,0,0,0|0,0,2]=4 20566 B12R1.112 CC=Cc1ccc(cc1OC)F 271570a_100016259895_100000757151 [0,2,0,0,0,0|0,0,2]=4 20567 B12R1.112 CC=Cc1ccc(cc1OC)N 271570a_100016259895_100000765947 [0,2,0,0,0,0|0,0,2]=4 20568 B12R1.112 CC=Cc1ccc(cc1OC)O 271570a_100016259895_100011827694 [0,2,0,0,0,0|0,0,2]=4 20569 B12R1.112 CCNc1ccc(cc1C#N)Br 27a_100015525214_100011219714 [0,2,0,0,0,0|2,0,0]=4 20570 B12R1.112 CCNc1ccc(cc1C#N)Br 7a_100000688460_100000210202 [0,2,0,0,0,0|2,0,0]=4 20571 B12R1.112 CCNc1ccc(cc1C#N)C 7a_100011934023_100000210202 [0,2,0,0,0,0|2,0,0]=4 20572 B12R1.112 CCNc1ccc(cc1C#N)Cl 7a_100011219925_100000210202 [0,2,0,0,0,0|2,0,0]=4 20573 B12R1.112 CCNc1ccc(cc1C#N)F 34a_100000685569_100000210202 [0,2,0,0,0,0|2,0,0]=4 20574 B12R1.112 CCNc1ccc(cc1C#N)F 7a_100000685569_100000210202 [0,2,0,0,0,0|2,0,0]=4 20575 B12R1.112 CCNc1ccc(cc1C#N)I 7a_100000049818_100000210202 [0,2,0,0,0,0|2,0,0]=4 20576 B12R1.112 CCNc1ccc(cc1CC)Br 2230a_100000686106_100000210202 [0,2,0,0,0,0|2,0,0]=4 20577 B12R1.112 CCNc1ccc(cc1CC)Br 34a_100000686106_100000210202 [0,2,0,0,0,0|2,0,0]=4 20578 B12R1.112 CCNc1ccc(cc1CC)Br 7a_100000686106_100000210202 [0,2,0,0,0,0|2,0,0]=4 20579 B12R1.112 CCNc1ccc(cc1CC)Cl 2230a_100012017146_100000210202 [0,2,0,0,0,0|2,0,0]=4 20580 B12R1.112 CCNc1ccc(cc1CC)Cl 34a_100012017146_100000210202 [0,2,0,0,0,0|2,0,0]=4 20581 B12R1.112 CCNc1ccc(cc1CC)Cl 7a_100012017146_100000210202 [0,2,0,0,0,0|2,0,0]=4 20582 B12R1.112 CCNc1ccc(cc1CC)I 2230a_100000014069_100000210202 [0,2,0,0,0,0|2,0,0]=4 20583 B12R1.112 CCNc1ccc(cc1CC)I 34a_100000014069_100000210202 [0,2,0,0,0,0|2,0,0]=4 20584 B12R1.112 CCNc1ccc(cc1CC)I 7a_100000014069_100000210202 [0,2,0,0,0,0|2,0,0]=4 20585 B12R1.112 CCNc1ccc(cc1CO)Br 34a_100012353972_100000210202 [0,2,0,0,0,0|1,0,0]=3 20586 B12R1.112 CCNc1ccc(cc1CO)C 34a_100011215565_100000210202 [0,2,0,0,0,0|1,0,0]=3 20587 B12R1.112 CCNc1ccc(cc1CO)Cl 34a_100011214999_100000210202 [0,2,0,0,0,0|1,0,0]=3 20588 B12R1.112 CCNc1ccc(cc1CO)F 34a_100011296978_100000210202 [0,2,0,0,0,0|1,0,0]=3 20589 B12R1.112 CCNc1ccc(cc1OC)Br 34a_100011279103_100000210202 [0,2,0,0,0,0|1,0,0]=3 20590 B12R1.112 CCNc1ccc(cc1OC)C 2230a_100000746441_100000210202 [0,2,0,0,0,0|1,0,0]=3 20591 B12R1.112 CCNc1ccc(cc1OC)C 34a_100000746441_100000210202 [0,2,0,0,0,0|1,0,0]=3 20592 B12R1.112 CCNc1ccc(cc1OC)Cl 34a_100000707585_100000210202 [0,2,0,0,0,0|1,0,0]=3 20593 B12R1.112 CCNc1ccc(cc1OC)F 34a_100000737216_100000210202 [0,2,0,0,0,0|1,0,0]=3 20594 B12R1.112 CCNc1ccc(cc1OC)I 34a_100015196925_100000210202 [0,2,0,0,0,0|1,0,0]=3 20595 B12R1.112 CCNc1ccc(cc1OC)O 34a_100015326901_100000210202 [0,2,0,0,0,0|1,0,0]=3 20596 B12R1.112 CCOc1ccc(cc1C#N)Br 34a_100000687585_100000210202 [0,2,0,0,0,0|2,0,0]=4 20597 B12R1.112 CCOc1ccc(cc1C#N)Br 7a_100000687585_100000210202 [0,2,0,0,0,0|2,0,0]=4 20598 B12R1.112 CCOc1ccc(cc1C#N)C 34a_200012180384_100000210202 [0,2,0,0,0,0|2,0,0]=4 20599 B12R1.112 CCOc1ccc(cc1C#N)C 7a_200012180384_100000210202 [0,2,0,0,0,0|2,0,0]=4 20600 B12R1.112 CCOc1ccc(cc1C#N)Cl 34a_100011219380_100000210202 [0,2,0,0,0,0|2,0,0]=4 20601 B12R1.112 CCOc1ccc(cc1C#N)Cl 7a_100011219380_100000210202 [0,2,0,0,0,0|2,0,0]=4 20602 B12R1.112 CCOc1ccc(cc1C#N)F 34a_100011900173_100000210202 [0,2,0,0,0,0|2,0,0]=4 20603 B12R1.112 CCOc1ccc(cc1C#N)F 7a_100011900173_100000210202 [0,2,0,0,0,0|2,0,0]=4 20604 B12R1.112 CCOc1ccc(cc1C#N)I 34a_200000049958_100000210202 [0,2,0,0,0,0|2,0,0]=4 20605 B12R1.112 CCOc1ccc(cc1C#N)I 7a_200000049958_100000210202 [0,2,0,0,0,0|2,0,0]=4 20606 B12R1.112 CCOc1ccc(cc1C#N)N 34a_100011249283_100000210202 [0,2,0,0,0,0|2,0,0]=4 20607 B12R1.112 CCOc1ccc(cc1C#N)N 7a_100011249283_100000210202 [0,2,0,0,0,0|2,0,0]=4 20608 B12R1.112 CCOc1ccc(cc1C#N)O 271570a_203496583355_100000188824 [0,2,0,0,0,0|2,0,0]=4 20609 B12R1.112 CCOc1ccc(cc1C=O)O 271570a_203496583355_100000170027 [0,2,0,0,0,0|1,0,1]=4 20610 B12R1.112 CCOc1ccc(cc1CBr)F 34a_100010161318_100000210202 [0,2,0,0,0,0|2,0,0]=4 20611 B12R1.112 CCOc1ccc(cc1CBr)F 7a_100010161318_100000210202 [0,2,0,0,0,0|2,0,0]=4 20612 B12R1.112 CCOc1ccc(cc1CC)Br 34a_100012338938_100000210202 [0,2,0,0,0,0|2,0,0]=4 20613 B12R1.112 CCOc1ccc(cc1CC)Br 7a_100012338938_100000210202 [0,2,0,0,0,0|2,0,0]=4 20614 B12R1.112 CCOc1ccc(cc1CC)C 34a_100009844793_100000210202 [0,2,0,0,0,0|2,0,0]=4 20615 B12R1.112 CCOc1ccc(cc1CC)C 7a_100009844793_100000210202 [0,2,0,0,0,0|2,0,0]=4 20616 B12R1.112 CCOc1ccc(cc1CC)F 34a_200000035566_100000210202 [0,2,0,0,0,0|2,0,0]=4 20617 B12R1.112 CCOc1ccc(cc1CC)F 7a_200000035566_100000210202 [0,2,0,0,0,0|2,0,0]=4 20618 B12R1.112 CCOc1ccc(cc1CC)O 271570a_203496583355_200010070707 [0,2,0,0,0,0|2,0,0]=4 20619 B12R1.112 CCOc1ccc(cc1CN)Br 34a_100000730032_100000210202 [0,2,0,0,0,0|2,0,0]=4 20620 B12R1.112 CCOc1ccc(cc1CN)Cl 34a_100000238540_100000210202 [0,2,0,0,0,0|2,0,0]=4 20621 B12R1.112 CCOc1ccc(cc1CO)Br 34a_100000184703_100000210202 [0,2,0,0,0,0|1,0,0]=3 20622 B12R1.112 CCOc1ccc(cc1CO)Br 7a_100000184703_100000210202 [0,2,0,0,0,0|1,0,0]=3 20623 B12R1.112 CCOc1ccc(cc1CO)C 34a_200011846009_100000210202 [0,2,0,0,0,0|1,0,0]=3 20624 B12R1.112 CCOc1ccc(cc1CO)C 7a_200011846009_100000210202 [0,2,0,0,0,0|1,0,0]=3 20625 B12R1.112 CCOc1ccc(cc1CO)Cl 34a_100011218961_100000210202 [0,2,0,0,0,0|1,0,0]=3 20626 B12R1.112 CCOc1ccc(cc1CO)Cl 7a_100011218961_100000210202 [0,2,0,0,0,0|1,0,0]=3 20627 B12R1.112 CCOc1ccc(cc1CO)F 34a_100011291448_100000210202 [0,2,0,0,0,0|1,0,0]=3 20628 B12R1.112 CCOc1ccc(cc1CO)F 7a_100011291448_100000210202 [0,2,0,0,0,0|1,0,0]=3 20629 B12R1.112 CCOc1ccc(cc1CO)I 34a_100000049520_100000210202 [0,2,0,0,0,0|1,0,0]=3 20630 B12R1.112 CCOc1ccc(cc1CO)I 7a_100000049520_100000210202 [0,2,0,0,0,0|1,0,0]=3 20631 B12R1.112 CCOc1ccc(cc1NC)Br 2230a_100000751366_200000210301 [0,2,0,0,0,0|2,0,0]=4 20632 B12R1.112 CCOc1ccc(cc1NC)Br 34a_100000751366_200000210301 [0,2,0,0,0,0|2,0,0]=4 20633 B12R1.112 CCOc1ccc(cc1NC)C 2230a_100011202655_200000210301 [0,2,0,0,0,0|2,0,0]=4 20634 B12R1.112 CCOc1ccc(cc1NC)C 34a_100011202655_200000210301 [0,2,0,0,0,0|2,0,0]=4 20635 B12R1.112 CCOc1ccc(cc1NC)Cl 2230a_100000742605_200000210301 [0,2,0,0,0,0|2,0,0]=4 20636 B12R1.112 CCOc1ccc(cc1NC)Cl 34a_100000742605_200000210301 [0,2,0,0,0,0|2,0,0]=4 20637 B12R1.112 CCOc1ccc(cc1N[13CH3])Br 2230a_100000751366_200025704644 [0,2,0,0,0,0|2,0,0]=4 20638 B12R1.112 CCOc1ccc(cc1N[13CH3])Br 34a_100000751366_200025704644 [0,2,0,0,0,0|2,0,0]=4 20639 B12R1.112 CCOc1ccc(cc1N[13CH3])C 2230a_100011202655_200025704644 [0,2,0,0,0,0|2,0,0]=4 20640 B12R1.112 CCOc1ccc(cc1N[13CH3])C 34a_100011202655_200025704644 [0,2,0,0,0,0|2,0,0]=4 20641 B12R1.112 CCOc1ccc(cc1N[13CH3])Cl 2230a_100000742605_200025704644 [0,2,0,0,0,0|2,0,0]=4 20642 B12R1.112 CCOc1ccc(cc1N[13CH3])Cl 34a_100000742605_200025704644 [0,2,0,0,0,0|2,0,0]=4 20643 B12R1.112 CCOc1ccc(cc1OC)Br 34a_100000694246_100000210202 [0,2,0,0,0,0|1,0,0]=3 20644 B12R1.112 CCOc1ccc(cc1OC)Br 7a_100000694246_100000210202 [0,2,0,0,0,0|1,0,0]=3 20645 B12R1.112 CCOc1ccc(cc1OC)C 34a_100000186466_100000210202 [0,2,0,0,0,0|1,0,0]=3 20646 B12R1.112 CCOc1ccc(cc1OC)Cl 34a_100000033002_100000210202 [0,2,0,0,0,0|1,0,0]=3 20647 B12R1.112 CCOc1ccc(cc1OC)F 34a_100000036057_100000210202 [0,2,0,0,0,0|1,0,0]=3 20648 B12R1.112 CCOc1ccc(cc1OC)F 7a_100000036057_100000210202 [0,2,0,0,0,0|1,0,0]=3 20649 B12R1.112 CCOc1ccc(cc1OC)I 34a_100000049635_100000210202 [0,2,0,0,0,0|1,0,0]=3 20650 B12R1.112 CCOc1ccc(cc1OC)N 34a_100000726020_100000210202 [0,2,0,0,0,0|1,0,0]=3 20651 B12R1.112 CCOc1ccc(cc1OC)O 271570a_203496583355_200012344064 [0,2,0,0,0,0|1,0,0]=3 20652 B12R1.112 CCOc1ccc(cc1SC)C 62a_200000210301_200000230997 [0,2,0,0,0,0|1,1,0]=4 20653 B12R1.112 CCOc1ccc(cc1SC)C 62a_200000230997_200000210301 [0,2,0,0,0,0|1,1,0]=4 20654 B12R1.112 CCOc1ccc(cc1SC)F 62a_100000171695_200000210301 [0,2,0,0,0,0|1,1,0]=4 20655 B12R1.112 CCOc1ccc(cc1SC)F 62a_200000210301_100000171695 [0,2,0,0,0,0|1,1,0]=4 20656 B12R1.112 CCOc1ccc(cc1S[13CH3])C 62a_200000230997_200025704644 [0,2,0,0,0,0|1,1,0]=4 20657 B12R1.112 CCOc1ccc(cc1S[13CH3])C 62a_200025704644_200000230997 [0,2,0,0,0,0|1,1,0]=4 20658 B12R1.112 CCOc1ccc(cc1S[13CH3])F 62a_100000171695_200025704644 [0,2,0,0,0,0|1,1,0]=4 20659 B12R1.112 CCOc1ccc(cc1S[13CH3])F 62a_200025704644_100000171695 [0,2,0,0,0,0|1,1,0]=4 20660 B12R1.112 CCOc1ccc(nc1CO)C 34a_100000751967_100000210202 [0,2,0,0,0,0|2,0,0]=4 20661 B12R1.112 CCOc1ccc(nc1OC)Br 34a_100010893133_100000210202 [0,2,0,0,0,0|2,0,0]=4 20662 B12R1.112 CCOc1ncc(cc1OC)Cl 34a_200009845368_100000210202 [0,2,0,0,0,0|2,0,0]=4 20663 B12R1.112 CCOc1ncc(cc1OC)O 271570a_203496583355_200010116856 [0,2,0,0,0,0|2,0,0]=4 20664 B12R1.112 CCSc1ccc(cc1C#N)Br 62a_100000210202_100011219714 [0,2,0,0,0,0|2,0,0]=4 20665 B12R1.112 CCSc1ccc(cc1C#N)C 62a_100000210202_100011935190 [0,2,0,0,0,0|2,0,0]=4 20666 B12R1.112 CCSc1ccc(cc1C#N)Cl 62a_100000210202_200011356825 [0,2,0,0,0,0|2,0,0]=4 20667 B12R1.112 CCSc1ccc(cc1C#N)F 62a_100000210202_100000747550 [0,2,0,0,0,0|2,0,0]=4 20668 B12R1.112 CCSc1ccc(cc1C#N)N 62a_100000210202_100011934039 [0,2,0,0,0,0|2,0,0]=4 20669 B12R1.112 CCSc1ccc(cc1C#N)O 62a_100000210202_100009818209 [0,2,0,0,0,0|2,0,0]=4 20670 B12R1.112 CCSc1ccc(cc1C=O)Br 62a_100000210202_100010185651 [0,2,0,0,0,0|1,0,1]=4 20671 B12R1.112 CCSc1ccc(cc1C=O)Br 62a_100010185651_100000210202 [0,2,0,0,0,0|1,0,1]=4 20672 B12R1.112 CCSc1ccc(cc1C=O)C 62a_100000210202_100011551863 [0,2,0,0,0,0|1,0,1]=4 20673 B12R1.112 CCSc1ccc(cc1C=O)C 62a_100011551863_100000210202 [0,2,0,0,0,0|1,0,1]=4 20674 B12R1.112 CCSc1ccc(cc1C=O)Cl 62a_100000210202_100010254386 [0,2,0,0,0,0|1,0,1]=4 20675 B12R1.112 CCSc1ccc(cc1C=O)Cl 62a_100010254386_100000210202 [0,2,0,0,0,0|1,0,1]=4 20676 B12R1.112 CCSc1ccc(cc1C=O)F 62a_100000210202_100011218309 [0,2,0,0,0,0|1,0,1]=4 20677 B12R1.112 CCSc1ccc(cc1C=O)F 62a_100011218309_100000210202 [0,2,0,0,0,0|1,0,1]=4 20678 B12R1.112 CCSc1ccc(cc1C=O)O 62a_100000210202_100000690577 [0,2,0,0,0,0|1,0,1]=4 20679 B12R1.112 CCSc1ccc(cc1C=O)O 62a_100000690577_100000210202 [0,2,0,0,0,0|1,0,1]=4 20680 B12R1.112 CCSc1ccc(cc1CC)Br 62a_100000210202_100011216195 [0,2,0,0,0,0|2,0,0]=4 20681 B12R1.112 CCSc1ccc(cc1CC)Br 62a_100011216195_100000210202 [0,2,0,0,0,0|2,0,0]=4 20682 B12R1.112 CCSc1ccc(cc1CC)N 62a_100000210202_100010109747 [0,2,0,0,0,0|2,0,0]=4 20683 B12R1.112 CCSc1ccc(cc1CC)N 62a_100010109747_100000210202 [0,2,0,0,0,0|2,0,0]=4 20684 B12R1.112 CCSc1ccc(cc1CN)F 62a_100000210202_100000742738 [0,2,0,0,0,0|2,0,0]=4 20685 B12R1.112 CCSc1ccc(cc1CN)F 62a_100000742738_100000210202 [0,2,0,0,0,0|2,0,0]=4 20686 B12R1.112 CCSc1ccc(cc1CO)Br 62a_100000210202_100011356890 [0,2,0,0,0,0|1,0,0]=3 20687 B12R1.112 CCSc1ccc(cc1CO)Br 62a_100011356890_100000210202 [0,2,0,0,0,0|1,0,0]=3 20688 B12R1.112 CCSc1ccc(cc1CO)C 62a_100000210202_100012361352 [0,2,0,0,0,0|1,0,0]=3 20689 B12R1.112 CCSc1ccc(cc1CO)C 62a_100012361352_100000210202 [0,2,0,0,0,0|1,0,0]=3 20690 B12R1.112 CCSc1ccc(cc1CO)F 62a_100000210202_100011217561 [0,2,0,0,0,0|1,0,0]=3 20691 B12R1.112 CCSc1ccc(cc1CO)F 62a_100011217561_100000210202 [0,2,0,0,0,0|1,0,0]=3 20692 B12R1.112 CCSc1ccc(cc1CO)N 62a_100000210202_100012347228 [0,2,0,0,0,0|1,0,0]=3 20693 B12R1.112 CCSc1ccc(cc1CO)N 62a_100012347228_100000210202 [0,2,0,0,0,0|1,0,0]=3 20694 B12R1.112 CCSc1ccc(cc1CO)O 62a_100000210202_100012351483 [0,2,0,0,0,0|1,0,0]=3 20695 B12R1.112 CCSc1ccc(cc1CO)O 62a_100012351483_100000210202 [0,2,0,0,0,0|1,0,0]=3 20696 B12R1.112 CCSc1ccc(cc1NC)Cl 34a_100000752208_200000210301 [0,2,0,0,0,0|2,0,0]=4 20697 B12R1.112 CCSc1ccc(cc1NC)F 62a_100000210202_100020633008 [0,2,0,0,0,0|2,0,0]=4 20698 B12R1.112 CCSc1ccc(cc1NC)F 62a_100020633008_100000210202 [0,2,0,0,0,0|2,0,0]=4 20699 B12R1.112 CCSc1ccc(cc1NN)F 62a_100000210202_100012362518 [0,2,0,0,0,0|2,0,0]=4 20700 B12R1.112 CCSc1ccc(cc1NN)F 62a_100012362518_100000210202 [0,2,0,0,0,0|2,0,0]=4 20701 B12R1.112 CCSc1ccc(cc1N[13CH3])Cl 34a_100000752208_200025704644 [0,2,0,0,0,0|2,0,0]=4 20702 B12R1.112 CCSc1ccc(cc1OC)Br 62a_100000210202_100010245111 [0,2,0,0,0,0|1,0,0]=3 20703 B12R1.112 CCSc1ccc(cc1OC)Br 62a_100010245111_100000210202 [0,2,0,0,0,0|1,0,0]=3 20704 B12R1.112 CCSc1ccc(cc1OC)C 62a_100000210202_100010200004 [0,2,0,0,0,0|1,0,0]=3 20705 B12R1.112 CCSc1ccc(cc1OC)C 62a_100010200004_100000210202 [0,2,0,0,0,0|1,0,0]=3 20706 B12R1.112 CCSc1ccc(cc1OC)Cl 62a_100000050115_100000210202 [0,2,0,0,0,0|1,0,0]=3 20707 B12R1.112 CCSc1ccc(cc1OC)Cl 62a_100000210202_100000050115 [0,2,0,0,0,0|1,0,0]=3 20708 B12R1.112 CCSc1ccc(cc1OC)F 62a_100000210202_100000757151 [0,2,0,0,0,0|1,0,0]=3 20709 B12R1.112 CCSc1ccc(cc1OC)F 62a_100000757151_100000210202 [0,2,0,0,0,0|1,0,0]=3 20710 B12R1.112 CCSc1ccc(cc1OC)N 62a_100000210202_100000765947 [0,2,0,0,0,0|1,0,0]=3 20711 B12R1.112 CCSc1ccc(cc1OC)N 62a_100000765947_100000210202 [0,2,0,0,0,0|1,0,0]=3 20712 B12R1.112 CCSc1ccc(cc1OC)O 62a_100000210202_100011827694 [0,2,0,0,0,0|1,0,0]=3 20713 B12R1.112 CCSc1ccc(cc1SC)C 62a_100000210202_200010709736 [0,2,0,0,0,0|1,1,0]=4 20714 B12R1.112 CCSc1ccc(cc1SC)C 62a_200010709736_100000210202 [0,2,0,0,0,0|1,1,0]=4 20715 B12R1.112 CCSc1ccc(nc1CO)C 62a_100000210202_100010074375 [0,2,0,0,0,0|2,0,0]=4 20716 B12R1.112 CCSc1ccc(nc1CO)C 62a_100010074375_100000210202 [0,2,0,0,0,0|2,0,0]=4 20717 B12R1.112 CCSc1ccc(nc1CO)F 62a_100000210202_100000701195 [0,2,0,0,0,0|2,0,0]=4 20718 B12R1.112 CCSc1ccc(nc1CO)F 62a_100000701195_100000210202 [0,2,0,0,0,0|2,0,0]=4 20719 B12R1.112 CCSc1ccc(nc1OC)C 62a_100000210202_100010138632 [0,2,0,0,0,0|2,0,0]=4 20720 B12R1.112 CCSc1ccc(nc1OC)C 62a_100010138632_100000210202 [0,2,0,0,0,0|2,0,0]=4 20721 B12R1.112 CCSc1ccc(nc1OC)N 62a_100000210202_100010187630 [0,2,0,0,0,0|2,0,0]=4 20722 B12R1.112 CCSc1ccc(nc1OC)N 62a_100010187630_100000210202 [0,2,0,0,0,0|2,0,0]=4 20723 B12R1.112 CCSc1cnc(cc1CO)C 62a_100000210202_100015579599 [0,2,0,0,0,0|2,0,0]=4 20724 B12R1.112 CCSc1cnc(cc1CO)C 62a_100015579599_100000210202 [0,2,0,0,0,0|2,0,0]=4 20725 B12R1.112 CCSc1cnc(cc1OC)C 62a_100000210202_100000717771 [0,2,0,0,0,0|2,0,0]=4 20726 B12R1.112 CCSc1cnc(cc1OC)C 62a_100000717771_100000210202 [0,2,0,0,0,0|2,0,0]=4 20727 B12R1.112 CCSc1cnc(cc1OC)Cl 62a_100000210202_100010154656 [0,2,0,0,0,0|2,0,0]=4 20728 B12R1.112 CCSc1cnc(cc1OC)Cl 62a_100010154656_100000210202 [0,2,0,0,0,0|2,0,0]=4 20729 B12R1.112 CCSc1cnc(cc1OC)F 62a_100000210202_100010135560 [0,2,0,0,0,0|2,0,0]=4 20730 B12R1.112 CCSc1cnc(cc1OC)F 62a_100010135560_100000210202 [0,2,0,0,0,0|2,0,0]=4 20731 B12R1.112 CCSc1cnc(cc1OC)N 62a_100000210202_100015506990 [0,2,0,0,0,0|2,0,0]=4 20732 B12R1.112 CCSc1cnc(cc1OC)N 62a_100015506990_100000210202 [0,2,0,0,0,0|2,0,0]=4 20733 B12R1.112 CCSc1ncc(cc1CO)C 62a_100000118064_100000210202 [0,2,0,0,0,0|2,0,0]=4 20734 B12R1.112 CCSc1ncc(cc1CO)C 62a_100000210202_100000118064 [0,2,0,0,0,0|2,0,0]=4 20735 B12R1.112 CCSc1ncc(cc1CO)F 62a_100000079972_100000210202 [0,2,0,0,0,0|2,0,0]=4 20736 B12R1.112 CCSc1ncc(cc1CO)F 62a_100000210202_100000079972 [0,2,0,0,0,0|2,0,0]=4 20737 B12R1.112 CCSc1ncc(cc1OC)C 62a_100000210202_200000118316 [0,2,0,0,0,0|2,0,0]=4 20738 B12R1.112 CCSc1ncc(cc1OC)F 62a_100000210202_100009867738 [0,2,0,0,0,0|2,0,0]=4 20739 B12R1.112 CCSc1ncc(cc1OC)F 62a_100010136273_100000210202 [0,2,0,0,0,0|2,0,0]=4 20740 B12R1.112 CCSc1ncc(cc1OC)N 62a_100000210202_100000097218 [0,2,0,0,0,0|2,0,0]=4 20741 B12R1.112 CCSc1ncc(cc1OC)N 62a_200010291755_100000210202 [0,2,0,0,0,0|2,0,0]=4 20742 B12R1.112 CCc1cc(ccc1CNC)Br 207a_100102657272_100010209654 [0,2,0,0,0,0|2,0,0]=4 20743 B12R1.112 CCc1cc(ccc1CNC)Br 269862a_106832991636_100010209654 [0,2,0,0,0,0|2,0,0]=4 20744 B12R1.112 CCc1cc(ccc1CNC)Br 26a_100102657272_100012338938 [0,2,0,0,0,0|2,0,0]=4 20745 B12R1.112 CCc1cc(ccc1CNC)Br 270004a_106832991635_100010209654 [0,2,0,0,0,0|2,0,0]=4 20746 B12R1.112 CNCc1ccc(cc1C#N)Br 207a_100102657272_100012355657 [0,2,0,0,0,0|2,0,0]=4 20747 B12R1.112 CNCc1ccc(cc1C#N)Br 2230a_106832991635_100000687761 [0,2,0,0,0,0|2,0,0]=4 20748 B12R1.112 CNCc1ccc(cc1C#N)Br 26a_100102657272_100000687585 [0,2,0,0,0,0|2,0,0]=4 20749 B12R1.112 CNCc1ccc(cc1C#N)Br 34a_100102657272_100000687761 [0,2,0,0,0,0|2,0,0]=4 20750 B12R1.112 CNCc1ccc(cc1C#N)Br 7a_106832991635_100000687761 [0,2,0,0,0,0|2,0,0]=4 20751 B12R1.112 CNCc1ccc(cc1C#N)Cl 2230a_106832991635_100000702095 [0,2,0,0,0,0|2,0,0]=4 20752 B12R1.112 CNCc1ccc(cc1C#N)Cl 34a_100102657272_100000702095 [0,2,0,0,0,0|2,0,0]=4 20753 B12R1.112 CNCc1ccc(cc1C#N)Cl 7a_106832991635_100000702095 [0,2,0,0,0,0|2,0,0]=4 20754 B12R1.112 CNCc1ccc(cc1C#N)F 207a_100102657272_100011934635 [0,2,0,0,0,0|2,0,0]=4 20755 B12R1.112 CNCc1ccc(cc1C#N)F 2230a_106832991635_100000751460 [0,2,0,0,0,0|2,0,0]=4 20756 B12R1.112 CNCc1ccc(cc1C#N)F 34a_100102657272_100000751460 [0,2,0,0,0,0|2,0,0]=4 20757 B12R1.112 CNCc1ccc(cc1C#N)F 7a_106832991635_100000751460 [0,2,0,0,0,0|2,0,0]=4 20758 B12R1.112 CNCc1ccc(cc1C=O)F 2230a_106832991635_100010132769 [0,2,0,0,0,0|1,0,1]=4 20759 B12R1.112 CNCc1ccc(cc1C=O)F 34a_100102657272_100010132769 [0,2,0,0,0,0|1,0,1]=4 20760 B12R1.112 CNCc1ccc(cc1C=O)F 7a_106832991635_100010132769 [0,2,0,0,0,0|1,0,1]=4 20761 B12R1.112 CNCc1ccc(cc1CBr)F 26a_100102657272_100010161318 [0,2,0,0,0,0|2,0,0]=4 20762 B12R1.112 CNCc1ccc(cc1CO)Br 26a_100102657272_100000184703 [0,2,0,0,0,0|1,0,0]=3 20763 B12R1.112 CNCc1ccc(cc1OC)Br 207a_100102657272_100000697075 [0,2,0,0,0,0|1,0,0]=3 20764 B12R1.112 CNCc1ccc(cc1OC)Br 2230a_106832991635_100012359436 [0,2,0,0,0,0|1,0,0]=3 20765 B12R1.112 CNCc1ccc(cc1OC)Br 26a_100102657272_100000694246 [0,2,0,0,0,0|1,0,0]=3 20766 B12R1.112 CNCc1ccc(cc1OC)Br 270004a_106832991635_100000697075 [0,2,0,0,0,0|1,0,0]=3 20767 B12R1.112 CNCc1ccc(cc1OC)Br 34a_100102657272_100012359436 [0,2,0,0,0,0|1,0,0]=3 20768 B12R1.112 CNCc1ccc(cc1OC)Br 7a_106832991635_100012359436 [0,2,0,0,0,0|1,0,0]=3 20769 B12R1.112 CNCc1ccc(cc1OC)C 207a_100102657272_100000689369 [0,2,0,0,0,0|1,0,0]=3 20770 B12R1.112 CNCc1ccc(cc1OC)C 270004a_106832991635_100000689369 [0,2,0,0,0,0|1,0,0]=3 20771 B12R1.112 CNCc1ccc(cc1OC)Cl 207a_100102657272_100000235374 [0,2,0,0,0,0|1,0,0]=3 20772 B12R1.112 CNCc1ccc(cc1OC)Cl 270004a_106832991635_100000235374 [0,2,0,0,0,0|1,0,0]=3 20773 B12R1.112 CNCc1ccc(cc1OC)F 207a_100102657272_100000042785 [0,2,0,0,0,0|1,0,0]=3 20774 B12R1.112 CNCc1ccc(cc1OC)F 2230a_106832991635_200010171551 [0,2,0,0,0,0|1,0,0]=3 20775 B12R1.112 CNCc1ccc(cc1OC)F 270004a_106832991635_100000042785 [0,2,0,0,0,0|1,0,0]=3 20776 B12R1.112 CNCc1ccc(cc1OC)F 34a_100000062129_200000210301 [0,2,0,0,0,0|1,0,0]=3 20777 B12R1.112 CNCc1ccc(cc1OC)F 34a_100102657272_200010171551 [0,2,0,0,0,0|1,0,0]=3 20778 B12R1.112 CNCc1ccc(cc1OC)F 7a_106832991635_200010171551 [0,2,0,0,0,0|1,0,0]=3 20779 B12R1.112 CNCc1ccc(cc1OC)I 207a_100102657272_100010290300 [0,2,0,0,0,0|1,0,0]=3 20780 B12R1.112 CNCc1ccc(cc1SC)F 62a_200000210301_200011192132 [0,2,0,0,0,0|1,1,0]=4 20781 B12R1.112 CNCc1ccc(cc1SC)F 62a_200011192132_200000210301 [0,2,0,0,0,0|1,1,0]=4 20782 B12R1.112 CNCc1ccc(cc1S[13CH3])F 62a_200011192132_200025704644 [0,2,0,0,0,0|1,1,0]=4 20783 B12R1.112 CNCc1ccc(cc1S[13CH3])F 62a_200025704644_200011192132 [0,2,0,0,0,0|1,1,0]=4 20784 B12R1.112 CNCc1ccc(nc1OC)Br 2230a_106832991635_100016029037 [0,2,0,0,0,0|2,0,0]=4 20785 B12R1.112 CNCc1ccc(nc1OC)Br 34a_100102657272_100016029037 [0,2,0,0,0,0|2,0,0]=4 20786 B12R1.112 CNCc1ccc(nc1OC)Br 7a_106832991635_100016029037 [0,2,0,0,0,0|2,0,0]=4 20787 B12R1.112 CNCc1ccc(nc1OC)Cl 2230a_100015687481_200000210301 [0,2,0,0,0,0|2,0,0]=4 20788 B12R1.112 CNCc1ccc(nc1OC)Cl 34a_100015687481_200000210301 [0,2,0,0,0,0|2,0,0]=4 20789 B12R1.112 CNCc1ncc(cc1OC)Br 207a_100102657272_100010246152 [0,2,0,0,0,0|2,0,0]=4 20790 B12R1.112 CNCc1ncc(cc1OC)Br 270004a_106832991635_100010246152 [0,2,0,0,0,0|2,0,0]=4 20791 B12R1.112 CNc1cc(ccc1COC)Br 34a_100013084866_200000210301 [0,2,0,0,0,0|2,0,0]=4 20792 B12R1.112 CNc1cc(ccc1COC)Br 7a_100013084866_200000210301 [0,2,0,0,0,0|2,0,0]=4 20793 B12R1.112 COCc1ccc(cc1C#N)Br 34a_100138415774_100000687761 [0,2,0,0,0,0|2,0,0]=4 20794 B12R1.112 COCc1ccc(cc1C#N)Cl 34a_100138415774_100000702095 [0,2,0,0,0,0|2,0,0]=4 20795 B12R1.112 COCc1ccc(cc1C#N)F 34a_100138415774_100000751460 [0,2,0,0,0,0|2,0,0]=4 20796 B12R1.112 COCc1ccc(cc1C=O)F 34a_100138415774_100010132769 [0,2,0,0,0,0|1,0,1]=4 20797 B12R1.112 COCc1ccc(cc1N[13CH3])Br 34a_100013084866_200025704644 [0,2,0,0,0,0|2,0,0]=4 20798 B12R1.112 COCc1ccc(cc1N[13CH3])Br 7a_100013084866_200025704644 [0,2,0,0,0,0|2,0,0]=4 20799 B12R1.112 COCc1ccc(cc1OC)Br 34a_100011277633_200000210301 [0,2,0,0,0,0|1,0,0]=3 20800 B12R1.112 COCc1ccc(cc1OC)Br 34a_100138415774_100012359436 [0,2,0,0,0,0|1,0,0]=3 20801 B12R1.112 COCc1ccc(cc1OC)Br 7a_100011277633_200000210301 [0,2,0,0,0,0|1,0,0]=3 20802 B12R1.112 COCc1ccc(cc1OC)C 34a_200012017176_200000210301 [0,2,0,0,0,0|1,0,0]=3 20803 B12R1.112 COCc1ccc(cc1OC)C 7a_200012017176_200000210301 [0,2,0,0,0,0|1,0,0]=3 20804 B12R1.112 COCc1ccc(cc1OC)Cl 34a_200011215853_200000210301 [0,2,0,0,0,0|1,0,0]=3 20805 B12R1.112 COCc1ccc(cc1OC)Cl 7a_200011215853_200000210301 [0,2,0,0,0,0|1,0,0]=3 20806 B12R1.112 COCc1ccc(cc1OC)F 34a_100000117171_200000210301 [0,2,0,0,0,0|1,0,0]=3 20807 B12R1.112 COCc1ccc(cc1OC)F 34a_100138415774_200010171551 [0,2,0,0,0,0|1,0,0]=3 20808 B12R1.112 COCc1ccc(cc1OC)F 7a_100000117171_200000210301 [0,2,0,0,0,0|1,0,0]=3 20809 B12R1.112 COCc1ccc(cc1OC)I 34a_100010233823_200000210301 [0,2,0,0,0,0|1,0,0]=3 20810 B12R1.112 COCc1ccc(cc1OC)I 7a_100010233823_200000210301 [0,2,0,0,0,0|1,0,0]=3 20811 B12R1.112 COCc1ccc(cc1OC)N 34a_100012183141_200000210301 [0,2,0,0,0,0|1,0,0]=3 20812 B12R1.112 COCc1ccc(nc1OC)Br 34a_100010988397_200000210301 [0,2,0,0,0,0|2,0,0]=4 20813 B12R1.112 COCc1ccc(nc1OC)Br 34a_100138415774_100016029037 [0,2,0,0,0,0|2,0,0]=4 20814 B12R1.112 COCc1ccc(nc1OC)Cl 34a_200009869906_200000210301 [0,2,0,0,0,0|2,0,0]=4 20815 B12R1.112 COCc1cnc(cc1OC)Cl 34a_100010714672_200000210301 [0,2,0,0,0,0|2,0,0]=4 20816 B12R1.112 COCc1ncc(cc1OC)Br 34a_200010246159_200000210301 [0,2,0,0,0,0|2,0,0]=4 20817 B12R1.112 COCc1ncc(cc1OC)Br 7a_200010246159_200000210301 [0,2,0,0,0,0|2,0,0]=4 20818 B12R1.112 COc1cc(ccc1CC#N)O 271570a_203496583355_100010245117 [0,2,0,0,0,0|1,0,1]=4 20819 B12R1.112 COc1cc(ccc1CN[13CH3])F 34a_100000062129_200025704644 [0,2,0,0,0,0|1,0,0]=3 20820 B12R1.112 COc1cc(ccc1CO[13CH3])Br 34a_100011277633_200025704644 [0,2,0,0,0,0|1,0,0]=3 20821 B12R1.112 COc1cc(ccc1CO[13CH3])Br 7a_100011277633_200025704644 [0,2,0,0,0,0|1,0,0]=3 20822 B12R1.112 COc1cc(ccc1CO[13CH3])C 34a_200012017176_200025704644 [0,2,0,0,0,0|1,0,0]=3 20823 B12R1.112 COc1cc(ccc1CO[13CH3])C 7a_200012017176_200025704644 [0,2,0,0,0,0|1,0,0]=3 20824 B12R1.112 COc1cc(ccc1CO[13CH3])Cl 34a_200011215853_200025704644 [0,2,0,0,0,0|1,0,0]=3 20825 B12R1.112 COc1cc(ccc1CO[13CH3])Cl 7a_200011215853_200025704644 [0,2,0,0,0,0|1,0,0]=3 20826 B12R1.112 COc1cc(ccc1CO[13CH3])F 34a_100000117171_200025704644 [0,2,0,0,0,0|1,0,0]=3 20827 B12R1.112 COc1cc(ccc1CO[13CH3])F 7a_100000117171_200025704644 [0,2,0,0,0,0|1,0,0]=3 20828 B12R1.112 COc1cc(ccc1CO[13CH3])I 34a_100010233823_200025704644 [0,2,0,0,0,0|1,0,0]=3 20829 B12R1.112 COc1cc(ccc1CO[13CH3])I 7a_100010233823_200025704644 [0,2,0,0,0,0|1,0,0]=3 20830 B12R1.112 COc1cc(ccc1CO[13CH3])N 34a_100012183141_200025704644 [0,2,0,0,0,0|1,0,0]=3 20831 B12R1.112 COc1cc(ccc1CSC)Br 62a_100012359436_200000210301 [0,2,0,0,0,0|1,0,0]=3 20832 B12R1.112 COc1cc(ccc1CSC)Br 62a_200000210301_100012359436 [0,2,0,0,0,0|1,0,0]=3 20833 B12R1.112 COc1cc(ccc1CSC)F 62a_200000210301_200010171551 [0,2,0,0,0,0|1,0,0]=3 20834 B12R1.112 COc1cc(ccc1CSC)F 62a_200010171551_200000210301 [0,2,0,0,0,0|1,0,0]=3 20835 B12R1.112 COc1cc(ccc1CS[13CH3])Br 62a_100012359436_200025704644 [0,2,0,0,0,0|1,0,0]=3 20836 B12R1.112 COc1cc(ccc1CS[13CH3])Br 62a_200025704644_100012359436 [0,2,0,0,0,0|1,0,0]=3 20837 B12R1.112 COc1cc(ccc1CS[13CH3])F 62a_200010171551_200025704644 [0,2,0,0,0,0|1,0,0]=3 20838 B12R1.112 COc1cc(ccc1CS[13CH3])F 62a_200025704644_200010171551 [0,2,0,0,0,0|1,0,0]=3 20839 B12R1.112 COc1cc(ccc1NCF)Br 34a_100011279103_100015361967 [0,2,0,0,0,0|2,0,0]=4 20840 B12R1.112 COc1cc(ccc1NCF)C 34a_100000746441_100015361967 [0,2,0,0,0,0|2,0,0]=4 20841 B12R1.112 COc1cc(ccc1NCF)Cl 34a_100000707585_100015361967 [0,2,0,0,0,0|2,0,0]=4 20842 B12R1.112 COc1cc(ccc1NCF)F 34a_100000737216_100015361967 [0,2,0,0,0,0|2,0,0]=4 20843 B12R1.112 COc1cc(ccc1NCF)I 34a_100015196925_100015361967 [0,2,0,0,0,0|2,0,0]=4 20844 B12R1.112 COc1cc(ccc1NCF)O 34a_100015326901_100015361967 [0,2,0,0,0,0|2,0,0]=4 20845 B12R1.112 COc1cc(ccc1OCF)Br 34a_100000694246_100015361967 [0,2,0,0,0,0|2,0,0]=4 20846 B12R1.112 COc1cc(ccc1OCF)Br 7a_100000694246_100015361967 [0,2,0,0,0,0|2,0,0]=4 20847 B12R1.112 COc1cc(ccc1OCF)C 34a_100000186466_100015361967 [0,2,0,0,0,0|2,0,0]=4 20848 B12R1.112 COc1cc(ccc1OCF)Cl 34a_100000033002_100015361967 [0,2,0,0,0,0|2,0,0]=4 20849 B12R1.112 COc1cc(ccc1OCF)F 34a_100000036057_100015361967 [0,2,0,0,0,0|2,0,0]=4 20850 B12R1.112 COc1cc(ccc1OCF)F 7a_100000036057_100015361967 [0,2,0,0,0,0|2,0,0]=4 20851 B12R1.112 COc1cc(ccc1OCF)I 34a_100000049635_100015361967 [0,2,0,0,0,0|2,0,0]=4 20852 B12R1.112 COc1cc(ccc1OCF)N 34a_100000726020_100015361967 [0,2,0,0,0,0|2,0,0]=4 20853 B12R1.112 COc1cc(ccc1SCF)Br 62a_100010245111_100015361967 [0,2,0,0,0,0|2,0,0]=4 20854 B12R1.112 COc1cc(ccc1SCF)Br 62a_100015361967_100010245111 [0,2,0,0,0,0|2,0,0]=4 20855 B12R1.112 COc1cc(ccc1SCF)C 62a_100010200004_100015361967 [0,2,0,0,0,0|2,0,0]=4 20856 B12R1.112 COc1cc(ccc1SCF)C 62a_100015361967_100010200004 [0,2,0,0,0,0|2,0,0]=4 20857 B12R1.112 COc1cc(ccc1SCF)Cl 62a_100000050115_100015361967 [0,2,0,0,0,0|2,0,0]=4 20858 B12R1.112 COc1cc(ccc1SCF)Cl 62a_100015361967_100000050115 [0,2,0,0,0,0|2,0,0]=4 20859 B12R1.112 COc1cc(ccc1SCF)F 62a_100000757151_100015361967 [0,2,0,0,0,0|2,0,0]=4 20860 B12R1.112 COc1cc(ccc1SCF)F 62a_100015361967_100000757151 [0,2,0,0,0,0|2,0,0]=4 20861 B12R1.112 COc1cc(ccc1SCF)N 62a_100000765947_100015361967 [0,2,0,0,0,0|2,0,0]=4 20862 B12R1.112 COc1cc(ccc1SCF)N 62a_100015361967_100000765947 [0,2,0,0,0,0|2,0,0]=4 20863 B12R1.112 COc1cc(ccc1SCF)O 62a_100015361967_100011827694 [0,2,0,0,0,0|2,0,0]=4 20864 B12R1.112 COc1cc(cnc1CO[13CH3])Br 34a_200010246159_200025704644 [0,2,0,0,0,0|2,0,0]=4 20865 B12R1.112 COc1cc(cnc1CO[13CH3])Br 7a_200010246159_200025704644 [0,2,0,0,0,0|2,0,0]=4 20866 B12R1.112 COc1cc(ncc1CO[13CH3])Cl 34a_100010714672_200025704644 [0,2,0,0,0,0|2,0,0]=4 20867 B12R1.112 COc1nc(ccc1CN[13CH3])Cl 2230a_100015687481_200025704644 [0,2,0,0,0,0|2,0,0]=4 20868 B12R1.112 COc1nc(ccc1CN[13CH3])Cl 34a_100015687481_200025704644 [0,2,0,0,0,0|2,0,0]=4 20869 B12R1.112 COc1nc(ccc1CO[13CH3])Br 34a_100010988397_200025704644 [0,2,0,0,0,0|2,0,0]=4 20870 B12R1.112 COc1nc(ccc1CO[13CH3])Cl 34a_200009869906_200025704644 [0,2,0,0,0,0|2,0,0]=4 20871 B12R1.112 COc1nc(ccc1CSC)Br 62a_100016029037_200000210301 [0,2,0,0,0,0|2,0,0]=4 20872 B12R1.112 COc1nc(ccc1CSC)Br 62a_200000210301_100016029037 [0,2,0,0,0,0|2,0,0]=4 20873 B12R1.112 COc1nc(ccc1CS[13CH3])Br 62a_100016029037_200025704644 [0,2,0,0,0,0|2,0,0]=4 20874 B12R1.112 COc1nc(ccc1CS[13CH3])Br 62a_200025704644_100016029037 [0,2,0,0,0,0|2,0,0]=4 20875 B12R1.112 CSCc1ccc(cc1C#N)Br 62a_100000687761_200000210301 [0,2,0,0,0,0|2,0,0]=4 20876 B12R1.112 CSCc1ccc(cc1C#N)Br 62a_200000210301_100000687761 [0,2,0,0,0,0|2,0,0]=4 20877 B12R1.112 CSCc1ccc(cc1C#N)Cl 62a_200000210301_100000702095 [0,2,0,0,0,0|2,0,0]=4 20878 B12R1.112 CSCc1ccc(cc1C#N)F 62a_100000751460_200000210301 [0,2,0,0,0,0|2,0,0]=4 20879 B12R1.112 CSCc1ccc(cc1C#N)F 62a_200000210301_100000751460 [0,2,0,0,0,0|2,0,0]=4 20880 B12R1.112 CSCc1ccc(cc1C=O)F 62a_100010132769_200000210301 [0,2,0,0,0,0|1,0,1]=4 20881 B12R1.112 CSCc1ccc(cc1C=O)F 62a_200000210301_100010132769 [0,2,0,0,0,0|1,0,1]=4 20882 B12R1.112 Cc1ccc(c(c1)CO)NCF 34a_100011215565_100015361967 [0,2,0,0,0,0|2,0,0]=4 20883 B12R1.112 Cc1ccc(c(c1)CO)OCF 34a_200011846009_100015361967 [0,2,0,0,0,0|2,0,0]=4 20884 B12R1.112 Cc1ccc(c(c1)CO)OCF 7a_200011846009_100015361967 [0,2,0,0,0,0|2,0,0]=4 20885 B12R1.112 Cc1ccc(c(c1)CO)SCF 62a_100012361352_100015361967 [0,2,0,0,0,0|2,0,0]=4 20886 B12R1.112 Cc1ccc(c(c1)CO)SCF 62a_100015361967_100012361352 [0,2,0,0,0,0|2,0,0]=4 20887 B12R1.112 Nc1ccc(c(c1)CO)SCF 62a_100012347228_100015361967 [0,2,0,0,0,0|2,0,0]=4 20888 B12R1.112 Nc1ccc(c(c1)CO)SCF 62a_100015361967_100012347228 [0,2,0,0,0,0|2,0,0]=4 20889 B12R1.112 OCc1cc(ccc1NCF)Br 34a_100012353972_100015361967 [0,2,0,0,0,0|2,0,0]=4 20890 B12R1.112 OCc1cc(ccc1NCF)Cl 34a_100011214999_100015361967 [0,2,0,0,0,0|2,0,0]=4 20891 B12R1.112 OCc1cc(ccc1NCF)F 34a_100011296978_100015361967 [0,2,0,0,0,0|2,0,0]=4 20892 B12R1.112 OCc1cc(ccc1OCF)Br 34a_100000184703_100015361967 [0,2,0,0,0,0|2,0,0]=4 20893 B12R1.112 OCc1cc(ccc1OCF)Br 7a_100000184703_100015361967 [0,2,0,0,0,0|2,0,0]=4 20894 B12R1.112 OCc1cc(ccc1OCF)Cl 34a_100011218961_100015361967 [0,2,0,0,0,0|2,0,0]=4 20895 B12R1.112 OCc1cc(ccc1OCF)Cl 7a_100011218961_100015361967 [0,2,0,0,0,0|2,0,0]=4 20896 B12R1.112 OCc1cc(ccc1OCF)F 34a_100011291448_100015361967 [0,2,0,0,0,0|2,0,0]=4 20897 B12R1.112 OCc1cc(ccc1OCF)F 7a_100011291448_100015361967 [0,2,0,0,0,0|2,0,0]=4 20898 B12R1.112 OCc1cc(ccc1OCF)I 34a_100000049520_100015361967 [0,2,0,0,0,0|2,0,0]=4 20899 B12R1.112 OCc1cc(ccc1OCF)I 7a_100000049520_100015361967 [0,2,0,0,0,0|2,0,0]=4 20900 B12R1.112 OCc1cc(ccc1SCF)Br 62a_100011356890_100015361967 [0,2,0,0,0,0|2,0,0]=4 20901 B12R1.112 OCc1cc(ccc1SCF)Br 62a_100015361967_100011356890 [0,2,0,0,0,0|2,0,0]=4 20902 B12R1.112 OCc1cc(ccc1SCF)F 62a_100011217561_100015361967 [0,2,0,0,0,0|2,0,0]=4 20903 B12R1.112 OCc1cc(ccc1SCF)F 62a_100015361967_100011217561 [0,2,0,0,0,0|2,0,0]=4 20904 B12R1.112 OCc1cc(ccc1SCF)O 62a_100012351483_100015361967 [0,2,0,0,0,0|2,0,0]=4 20905 B12R1.112 OCc1cc(ccc1SCF)O 62a_100015361967_100012351483 [0,2,0,0,0,0|2,0,0]=4 20906 B12R1.112 [13CH3]SCc1ccc(cc1C#N)Br 62a_100000687761_200025704644 [0,2,0,0,0,0|2,0,0]=4 20907 B12R1.112 [13CH3]SCc1ccc(cc1C#N)Br 62a_200025704644_100000687761 [0,2,0,0,0,0|2,0,0]=4 20908 B12R1.112 [13CH3]SCc1ccc(cc1C#N)Cl 62a_200025704644_100000702095 [0,2,0,0,0,0|2,0,0]=4 20909 B12R1.112 [13CH3]SCc1ccc(cc1C#N)F 62a_100000751460_200025704644 [0,2,0,0,0,0|2,0,0]=4 20910 B12R1.112 [13CH3]SCc1ccc(cc1C#N)F 62a_200025704644_100000751460 [0,2,0,0,0,0|2,0,0]=4 20911 B12R1.112 [13CH3]SCc1ccc(cc1C=O)F 62a_100010132769_200025704644 [0,2,0,0,0,0|1,0,1]=4 20912 B12R1.112 [13CH3]SCc1ccc(cc1C=O)F 62a_200025704644_100010132769 [0,2,0,0,0,0|1,0,1]=4 20913 B12R1.169 C/C=C/c1ccccc1OCC 34a_200000189419_100000210202 [0,2,0,0,0,0|0,0,2]=4 20914 B12R1.169 C/C=C/c1ccccc1OCC 7a_200000189419_100000210202 [0,2,0,0,0,0|0,0,2]=4 20915 B12R1.169 C/C=C/c1ccccc1OCF 34a_200000189419_100015361967 [0,2,0,0,0,0|0,0,2]=4 20916 B12R1.169 C/C=C/c1ccccc1OCF 7a_200000189419_100015361967 [0,2,0,0,0,0|0,0,2]=4 20917 B12R1.169 C=C=Cc1ccccc1CCN 271570a_100015277604_100000747383 [0,2,0,0,0,0|2,0,0]=4 20918 B12R1.169 C=C=Cc1ccccc1CCO 271570a_100015277604_100000731337 [0,2,0,0,0,0|2,0,0]=4 20919 B12R1.169 C=C=Cc1ccccc1CNC 271570a_100015277604_100000184654 [0,2,0,0,0,0|2,0,0]=4 20920 B12R1.169 C=C=Cc1ccccc1COC 271570a_100015277604_100011493684 [0,2,0,0,0,0|2,0,0]=4 20921 B12R1.169 C=C=Cc1ccccc1CSC 271570a_100015277604_100000148299 [0,2,0,0,0,0|2,0,0]=4 20922 B12R1.169 C=C=Cc1ccccc1NCC 271570a_100015277604_114873767003 [0,2,0,0,0,0|2,0,0]=4 20923 B12R1.169 C=C=Cc1ccccc1OCC 271570a_100015277604_100000230754 [0,2,0,0,0,0|2,0,0]=4 20924 B12R1.169 C=C=Cc1ccccc1SCC 271570a_100015277604_100000230856 [0,2,0,0,0,0|2,0,0]=4 20925 B12R1.169 C=CCc1ccccc1CNC 207a_100102657272_100010619294 [0,2,0,0,0,0|2,0,0]=4 20926 B12R1.169 C=CCc1ccccc1CNC 26a_100102657272_100000211836 [0,2,0,0,0,0|2,0,0]=4 20927 B12R1.169 C=CCc1ccccc1CNC 270004a_106832991635_100010619294 [0,2,0,0,0,0|2,0,0]=4 20928 B12R1.169 C=CCc1ccccc1NCC 2230a_200138433279_100000210202 [0,2,0,0,0,0|2,0,0]=4 20929 B12R1.169 C=CCc1ccccc1NCC 34a_200138433279_100000210202 [0,2,0,0,0,0|2,0,0]=4 20930 B12R1.169 C=CCc1ccccc1OCC 34a_100000211836_100000210202 [0,2,0,0,0,0|0,0,2]=4 20931 B12R1.169 C=CCc1ccccc1OCC 7a_100000211836_100000210202 [0,2,0,0,0,0|0,0,2]=4 20932 B12R1.169 C=CCc1ccccc1OCF 34a_100000211836_100015361967 [0,2,0,0,0,0|0,0,2]=4 20933 B12R1.169 C=CCc1ccccc1OCF 7a_100000211836_100015361967 [0,2,0,0,0,0|0,0,2]=4 20934 B12R1.169 C=CCc1ccccc1SCC 62a_100000210202_100009828059 [0,2,0,0,0,0|2,0,0]=4 20935 B12R1.169 C=CCc1ccccc1SCC 62a_100009828059_100000210202 [0,2,0,0,0,0|2,0,0]=4 20936 B12R1.169 CC=Cc1ccccc1CCN 271570a_100016259895_100000747383 [0,2,0,0,0,0|2,0,0]=4 20937 B12R1.169 CC=Cc1ccccc1CCO 271570a_100016259895_100000731337 [0,2,0,0,0,0|0,0,2]=4 20938 B12R1.169 CC=Cc1ccccc1CNC 271570a_100016259895_100000184654 [0,2,0,0,0,0|2,0,0]=4 20939 B12R1.169 CC=Cc1ccccc1COC 271570a_100016259895_100011493684 [0,2,0,0,0,0|0,0,2]=4 20940 B12R1.169 CC=Cc1ccccc1CSC 271570a_100016259895_100000148299 [0,2,0,0,0,0|2,0,0]=4 20941 B12R1.169 CC=Cc1ccccc1NCC 271570a_100016259895_114873767003 [0,2,0,0,0,0|2,0,0]=4 20942 B12R1.169 CC=Cc1ccccc1OCC 271570a_100016259895_100000230754 [0,2,0,0,0,0|0,0,2]=4 20943 B12R1.169 CC=Cc1ccccc1SCC 271570a_100016259895_100000230856 [0,2,0,0,0,0|2,0,0]=4 20944 B12R1.169 CCCc1ccccc1CNC 26a_100102657272_100011217252 [0,2,0,0,0,0|1,0,0]=3 20945 B12R1.169 CCCc1ccccc1NCC 2230a_100000737634_100000210202 [0,2,0,0,0,0|1,0,0]=3 20946 B12R1.169 CCCc1ccccc1NCC 34a_100000737634_100000210202 [0,2,0,0,0,0|1,0,0]=3 20947 B12R1.169 CCCc1ccccc1NCC 7a_100000737634_100000210202 [0,2,0,0,0,0|1,0,0]=3 20948 B12R1.169 CCCc1ccccc1NCF 34a_100000737634_100015361967 [0,2,0,0,0,0|1,0,0]=3 20949 B12R1.169 CCCc1ccccc1NCF 7a_100000737634_100015361967 [0,2,0,0,0,0|1,0,0]=3 20950 B12R1.169 CCCc1ccccc1OCC 34a_100011217252_100000210202 [0,2,0,0,0,0|0,0,0]=2 20951 B12R1.169 CCCc1ccccc1OCC 7a_100011217252_100000210202 [0,2,0,0,0,0|0,0,0]=2 20952 B12R1.169 CCCc1ccccc1OCF 34a_100011217252_100015361967 [0,2,0,0,0,0|0,0,0]=2 20953 B12R1.169 CCCc1ccccc1OCF 7a_100011217252_100015361967 [0,2,0,0,0,0|0,0,0]=2 20954 B12R1.169 CCNc1ccccc1CCO 2230a_100011215289_100000210202 [0,2,0,0,0,0|1,0,0]=3 20955 B12R1.169 CCNc1ccccc1CCO 34a_100011215289_100000210202 [0,2,0,0,0,0|1,0,0]=3 20956 B12R1.169 CCNc1ccccc1OCC 34a_100000211218_100000210202 [0,2,0,0,0,0|1,0,0]=3 20957 B12R1.169 CCNc1ccccc1OCC 34a_103624766699_100000210202 [0,2,0,0,0,0|1,0,0]=3 20958 B12R1.169 CCNc1ccccc1OCC 7a_103624766699_100000210202 [0,2,0,0,0,0|1,0,0]=3 20959 B12R1.169 CCNc1ccccc1OCF 34a_103624766699_100015361967 [0,2,0,0,0,0|1,0,0]=3 20960 B12R1.169 CCNc1ccccc1OCF 7a_103624766699_100015361967 [0,2,0,0,0,0|1,0,0]=3 20961 B12R1.169 CCNc1ccccc1SCC 34a_100011223125_100000210202 [0,2,0,0,0,0|1,1,0]=4 20962 B12R1.169 CCNc1ccccc1SCC 62a_100000210202_114873767003 [0,2,0,0,0,0|1,1,0]=4 20963 B12R1.169 CCNc1ccccc1SCC 62a_114873767003_100000210202 [0,2,0,0,0,0|1,1,0]=4 20964 B12R1.169 CCNc1ccccc1SCF 62a_100015361967_114873767003 [0,2,0,0,0,0|1,1,0]=4 20965 B12R1.169 CCNc1ccccc1SCF 62a_114873767003_100015361967 [0,2,0,0,0,0|1,1,0]=4 20966 B12R1.169 CCOc1ccccc1CC#N 34a_100000043107_100000210202 [0,2,0,0,0,0|1,0,1]=4 20967 B12R1.169 CCOc1ccccc1CC#N 7a_100000043107_100000210202 [0,2,0,0,0,0|1,0,1]=4 20968 B12R1.169 CCOc1ccccc1CCBr 34a_100000722297_100000210202 [0,2,0,0,0,0|1,0,0]=3 20969 B12R1.169 CCOc1ccccc1CCBr 7a_100000722297_100000210202 [0,2,0,0,0,0|1,0,0]=3 20970 B12R1.169 CCOc1ccccc1CCN 34a_100011207237_100000210202 [0,2,0,0,0,0|1,0,0]=3 20971 B12R1.169 CCOc1ccccc1CCO 34a_100000719421_100000210202 [0,2,0,0,0,0|1,0,0]=3 20972 B12R1.169 CCOc1ccccc1CCO 7a_100000719421_100000210202 [0,2,0,0,0,0|1,0,0]=3 20973 B12R1.169 CCOc1ccccc1CNC 207a_100102657272_100000169843 [0,2,0,0,0,0|1,0,0]=3 20974 B12R1.169 CCOc1ccccc1CNC 270004a_106832991635_100000169843 [0,2,0,0,0,0|1,0,0]=3 20975 B12R1.169 CCOc1ccccc1CNC 34a_100015189988_100000210202 [0,2,0,0,0,0|1,0,0]=3 20976 B12R1.169 CCOc1ccccc1COC 34a_100000708577_200000210301 [0,2,0,0,0,0|1,0,0]=3 20977 B12R1.169 CCOc1ccccc1COC 34a_100011488565_100000210202 [0,2,0,0,0,0|1,0,0]=3 20978 B12R1.169 CCOc1ccccc1COC 7a_100000708577_200000210301 [0,2,0,0,0,0|1,0,0]=3 20979 B12R1.169 CCOc1ccccc1COC 7a_100011488565_100000210202 [0,2,0,0,0,0|1,0,0]=3 20980 B12R1.169 CCOc1ccccc1CO[13CH3] 34a_100000708577_200025704644 [0,2,0,0,0,0|1,0,0]=3 20981 B12R1.169 CCOc1ccccc1CO[13CH3] 7a_100000708577_200025704644 [0,2,0,0,0,0|1,0,0]=3 20982 B12R1.169 CCOc1ccccc1NCF 34a_100000211218_100015361967 [0,2,0,0,0,0|2,0,0]=4 20983 B12R1.169 CCOc1ccccc1OCC 34a_100000211404_100000210202 [0,2,0,0,0,0|1,0,0]=3 20984 B12R1.169 CCOc1ccccc1OCC 7a_100000211404_100000210202 [0,2,0,0,0,0|1,0,0]=3 20985 B12R1.169 CCOc1ccccc1OCF 34a_100000211404_100015361967 [0,2,0,0,0,0|1,0,0]=3 20986 B12R1.169 CCOc1ccccc1OCF 7a_100000211404_100015361967 [0,2,0,0,0,0|1,0,0]=3 20987 B12R1.169 CCOc1ccccc1SCC 62a_100000210202_100000230754 [0,2,0,0,0,0|1,0,0]=3 20988 B12R1.169 CCOc1ccccc1SCC 62a_100000230754_100000210202 [0,2,0,0,0,0|1,0,0]=3 20989 B12R1.169 CCOc1ccccc1SCF 62a_100000230754_100015361967 [0,2,0,0,0,0|1,1,0]=4 20990 B12R1.169 CCOc1ccccc1SCF 62a_100015361967_100000230754 [0,2,0,0,0,0|1,1,0]=4 20991 B12R1.169 CCOc1cccnc1CNC 207a_100102657272_100009876934 [0,2,0,0,0,0|2,0,0]=4 20992 B12R1.169 CCOc1cccnc1CNC 270004a_106832991635_100009876934 [0,2,0,0,0,0|2,0,0]=4 20993 B12R1.169 CCOc1cccnc1OCC 34a_100011998697_100000210202 [0,2,0,0,0,0|2,0,0]=4 20994 B12R1.169 CCOc1cccnc1SCC 62a_100000210202_100011597540 [0,2,0,0,0,0|2,0,0]=4 20995 B12R1.169 CCOc1cccnc1SCC 62a_100011597540_100000210202 [0,2,0,0,0,0|2,0,0]=4 20996 B12R1.169 CCOc1ccncc1CNC 270004a_106832991635_200011935332 [0,2,0,0,0,0|2,0,0]=4 20997 B12R1.169 CCOc1ncccc1CNC 207a_100102657272_100011290805 [0,2,0,0,0,0|2,0,0]=4 20998 B12R1.169 CCOc1ncccc1CNC 270004a_106832991635_100011290805 [0,2,0,0,0,0|2,0,0]=4 20999 B12R1.169 CCOc1ncccc1OCF 34a_100011998697_100015361967 [0,2,0,0,0,0|2,0,0]=4 21000 B12R1.169 CCOc1ncccc1SCC 62a_100000210202_100011465154 [0,2,0,0,0,0|2,0,0]=4 21001 B12R1.169 CCOc1ncccc1SCC 62a_100011465154_100000210202 [0,2,0,0,0,0|2,0,0]=4 21002 B12R1.169 CCSc1ccccc1CC#N 62a_100000033512_100000210202 [0,2,0,0,0,0|2,0,0]=4 21003 B12R1.169 CCSc1ccccc1CC#N 62a_100000210202_100000033512 [0,2,0,0,0,0|2,0,0]=4 21004 B12R1.169 CCSc1ccccc1CCN 62a_100000210202_100000747383 [0,2,0,0,0,0|1,1,0]=4 21005 B12R1.169 CCSc1ccccc1CCN 62a_100000747383_100000210202 [0,2,0,0,0,0|1,1,0]=4 21006 B12R1.169 CCSc1ccccc1CCO 62a_100000210202_100000731337 [0,2,0,0,0,0|1,0,0]=3 21007 B12R1.169 CCSc1ccccc1CCO 62a_100000731337_100000210202 [0,2,0,0,0,0|1,0,0]=3 21008 B12R1.169 CCSc1ccccc1CNC 62a_100000184654_100000210202 [0,2,0,0,0,0|1,1,0]=4 21009 B12R1.169 CCSc1ccccc1CNC 62a_100000210202_100000184654 [0,2,0,0,0,0|1,1,0]=4 21010 B12R1.169 CCSc1ccccc1CNN 62a_100000210202_200016993956 [0,2,0,0,0,0|2,0,0]=4 21011 B12R1.169 CCSc1ccccc1CNN 62a_200016993956_100000210202 [0,2,0,0,0,0|2,0,0]=4 21012 B12R1.169 CCSc1ccccc1COC 62a_100000210202_100011493684 [0,2,0,0,0,0|1,0,0]=3 21013 B12R1.169 CCSc1ccccc1COC 62a_100011493684_100000210202 [0,2,0,0,0,0|1,0,0]=3 21014 B12R1.169 CCSc1ccccc1CSC 62a_100000148299_100000210202 [0,2,0,0,0,0|1,1,0]=4 21015 B12R1.169 CCSc1ccccc1CSC 62a_100000210202_100000148299 [0,2,0,0,0,0|1,1,0]=4 21016 B12R1.169 CCSc1ccccc1N=[N+]=[N-] 62a_100000210202_100000762926 [0,2,0,0,0,0|2,0,0]=4 21017 B12R1.169 CCSc1ccccc1NC#N 62a_100000210202_100011685340 [0,2,0,0,0,0|2,0,0]=4 21018 B12R1.169 CCSc1ccccc1NC=O 62a_100000210202_200020615051 [0,2,0,0,0,0|1,0,1]=4 21019 B12R1.169 CCSc1ccccc1NC=O 62a_200020615051_100000210202 [0,2,0,0,0,0|1,0,1]=4 21020 B12R1.169 CCSc1ccccc1NCF 34a_100011223125_100015361967 [0,2,0,0,0,0|2,0,0]=4 21021 B12R1.169 CCSc1ccccc1SCC 62a_100000210202_100000230856 [0,2,0,0,0,0|1,1,0]=4 21022 B12R1.169 CCSc1ccccc1SCC 62a_100000230856_100000210202 [0,2,0,0,0,0|1,1,0]=4 21023 B12R1.169 CCSc1ccccc1SCF 62a_100000230856_100015361967 [0,2,0,0,0,0|1,1,0]=4 21024 B12R1.169 CCSc1ccccc1SCF 62a_100015361967_100000230856 [0,2,0,0,0,0|1,1,0]=4 21025 B12R1.169 CNCc1ccccc1CC#N 2230a_106832991635_100010402002 [0,2,0,0,0,0|2,0,0]=4 21026 B12R1.169 CNCc1ccccc1CCBr 26a_100102657272_100000722297 [0,2,0,0,0,0|2,0,0]=4 21027 B12R1.169 CNCc1ccccc1OCF 34a_100015189988_100015361967 [0,2,0,0,0,0|1,0,0]=3 21028 B12R1.169 CNCc1ccccc1SCF 62a_100000184654_100015361967 [0,2,0,0,0,0|1,1,0]=4 21029 B12R1.169 CNCc1ccccc1SCF 62a_100015361967_100000184654 [0,2,0,0,0,0|1,1,0]=4 21030 B12R1.169 COCc1ccccc1OCF 34a_100011488565_100015361967 [0,2,0,0,0,0|1,0,0]=3 21031 B12R1.169 COCc1ccccc1OCF 7a_100011488565_100015361967 [0,2,0,0,0,0|1,0,0]=3 21032 B12R1.169 COCc1ccccc1SCF 62a_100011493684_100015361967 [0,2,0,0,0,0|1,1,0]=4 21033 B12R1.169 COCc1ccccc1SCF 62a_100015361967_100011493684 [0,2,0,0,0,0|1,1,0]=4 21034 B12R1.169 CSCc1ccccc1CC#N 62a_100010402002_200000210301 [0,2,0,0,0,0|2,0,0]=4 21035 B12R1.169 CSCc1ccccc1CC#N 62a_200000210301_100010402002 [0,2,0,0,0,0|2,0,0]=4 21036 B12R1.169 CSCc1ccccc1SCF 62a_100000148299_100015361967 [0,2,0,0,0,0|1,1,0]=4 21037 B12R1.169 CSCc1ccccc1SCF 62a_100015361967_100000148299 [0,2,0,0,0,0|1,1,0]=4 21038 B12R1.169 FCOc1ccccc1CCBr 34a_100000722297_100015361967 [0,2,0,0,0,0|1,0,0]=3 21039 B12R1.169 FCOc1ccccc1CCBr 7a_100000722297_100015361967 [0,2,0,0,0,0|1,0,0]=3 21040 B12R1.169 N#CCc1ccccc1OCF 34a_100000043107_100015361967 [0,2,0,0,0,0|1,0,1]=4 21041 B12R1.169 N#CCc1ccccc1OCF 7a_100000043107_100015361967 [0,2,0,0,0,0|1,0,1]=4 21042 B12R1.169 NCCc1ccccc1OCF 34a_100011207237_100015361967 [0,2,0,0,0,0|1,0,0]=3 21043 B12R1.169 NCCc1ccccc1SCF 62a_100000747383_100015361967 [0,2,0,0,0,0|1,1,0]=4 21044 B12R1.169 NCCc1ccccc1SCF 62a_100015361967_100000747383 [0,2,0,0,0,0|1,1,0]=4 21045 B12R1.169 OCCc1ccccc1NCF 34a_100011215289_100015361967 [0,2,0,0,0,0|2,0,0]=4 21046 B12R1.169 OCCc1ccccc1OCF 34a_100000719421_100015361967 [0,2,0,0,0,0|1,0,0]=3 21047 B12R1.169 OCCc1ccccc1OCF 7a_100000719421_100015361967 [0,2,0,0,0,0|1,0,0]=3 21048 B12R1.169 OCCc1ccccc1SCF 62a_100000731337_100015361967 [0,2,0,0,0,0|1,1,0]=4 21049 B12R1.169 OCCc1ccccc1SCF 62a_100015361967_100000731337 [0,2,0,0,0,0|1,1,0]=4 21050 B12R1.169 [13CH3]SCc1ccccc1CC#N 62a_100010402002_200025704644 [0,2,0,0,0,0|2,0,0]=4 21051 B12R1.169 [13CH3]SCc1ccccc1CC#N 62a_200025704644_100010402002 [0,2,0,0,0,0|2,0,0]=4 21052 B12R1.268 C=Cc1ccc(cc1OCC)C 271570a_100011290941_200010713166 [0,2,0,0,0,0|2,0,0]=4 21053 B12R1.268 C=Cc1ccc(cc1OCC)F 271570a_100011290941_200012340411 [0,2,0,0,0,0|2,0,0]=4 21054 B12R1.268 C=Cc1ccc(cc1OCC)N 271570a_100011290941_200016990551 [0,2,0,0,0,0|2,0,0]=4 21055 B12R1.268 C=Cc1ccc(cc1SCC)F 62a_100000210202_100012354420 [0,2,0,0,0,0|2,0,0]=4 21056 B12R1.268 C=Cc1ccc(cc1SCC)F 62a_100012354420_100000210202 [0,2,0,0,0,0|2,0,0]=4 21057 B12R1.268 CC=Cc1cc(ccc1CO)Br 271570a_100016259895_100010146605 [0,2,0,0,0,0|0,0,2]=4 21058 B12R1.268 CC=Cc1cc(ccc1CO)Cl 271570a_100016259895_100000722340 [0,2,0,0,0,0|0,0,2]=4 21059 B12R1.268 CC=Cc1cc(ccc1CO)F 271570a_100016259895_100000744086 [0,2,0,0,0,0|0,0,2]=4 21060 B12R1.268 CC=Cc1cc(ccc1CO)O 271570a_100016259895_100010146404 [0,2,0,0,0,0|0,0,2]=4 21061 B12R1.268 CC=Cc1cc(ccc1OC)Br 271570a_100016259895_100012351588 [0,2,0,0,0,0|0,0,2]=4 21062 B12R1.268 CC=Cc1cc(ccc1OC)C 271570a_100016259895_100000186399 [0,2,0,0,0,0|0,0,2]=4 21063 B12R1.268 CC=Cc1cc(ccc1OC)Cl 271570a_100016259895_100011215930 [0,2,0,0,0,0|0,0,2]=4 21064 B12R1.268 CC=Cc1cc(ccc1OC)F 271570a_100016259895_100000171694 [0,2,0,0,0,0|0,0,2]=4 21065 B12R1.268 CC=Cc1cc(ccc1OC)N 271570a_100016259895_100000187427 [0,2,0,0,0,0|0,0,2]=4 21066 B12R1.268 CC=Cc1cc(ccc1OC)O 271570a_100016259895_100010084122 [0,2,0,0,0,0|0,0,2]=4 21067 B12R1.268 CCNc1cc(ccc1C#N)Br 27a_100015525214_100010214477 [0,2,0,0,0,0|2,0,0]=4 21068 B12R1.268 CCNc1cc(ccc1C#N)Br 7a_100000699244_100000210202 [0,2,0,0,0,0|2,0,0]=4 21069 B12R1.268 CCNc1cc(ccc1C#N)C 34a_100011218341_100000210202 [0,2,0,0,0,0|2,0,0]=4 21070 B12R1.268 CCNc1cc(ccc1C#N)C 7a_100011218341_100000210202 [0,2,0,0,0,0|2,0,0]=4 21071 B12R1.268 CCNc1cc(ccc1C#N)Cl 27a_100015525214_100012355178 [0,2,0,0,0,0|2,0,0]=4 21072 B12R1.268 CCNc1cc(ccc1C#N)Cl 34a_100000211392_100000210202 [0,2,0,0,0,0|2,0,0]=4 21073 B12R1.268 CCNc1cc(ccc1C#N)Cl 7a_100000211392_100000210202 [0,2,0,0,0,0|2,0,0]=4 21074 B12R1.268 CCNc1cc(ccc1C#N)F 27a_100015525214_100011935285 [0,2,0,0,0,0|2,0,0]=4 21075 B12R1.268 CCNc1cc(ccc1C#N)F 34a_100011935279_100000210202 [0,2,0,0,0,0|2,0,0]=4 21076 B12R1.268 CCNc1cc(ccc1C#N)F 7a_100011935279_100000210202 [0,2,0,0,0,0|2,0,0]=4 21077 B12R1.268 CCNc1cc(ccc1CC)Br 2230a_100012354963_100000210202 [0,2,0,0,0,0|2,0,0]=4 21078 B12R1.268 CCNc1cc(ccc1CC)Br 34a_100012354963_100000210202 [0,2,0,0,0,0|2,0,0]=4 21079 B12R1.268 CCNc1cc(ccc1CC)Br 7a_100012354963_100000210202 [0,2,0,0,0,0|2,0,0]=4 21080 B12R1.268 CCNc1cc(ccc1CC)Cl 2230a_200012281948_100000210202 [0,2,0,0,0,0|2,0,0]=4 21081 B12R1.268 CCNc1cc(ccc1CC)Cl 34a_200012281948_100000210202 [0,2,0,0,0,0|2,0,0]=4 21082 B12R1.268 CCNc1cc(ccc1CC)Cl 7a_200012281948_100000210202 [0,2,0,0,0,0|2,0,0]=4 21083 B12R1.268 CCNc1cc(ccc1CO)Br 34a_100000718831_100000210202 [0,2,0,0,0,0|1,0,0]=3 21084 B12R1.268 CCNc1cc(ccc1CO)C 34a_100000087799_100000210202 [0,2,0,0,0,0|1,0,0]=3 21085 B12R1.268 CCNc1cc(ccc1CO)Cl 34a_100000238622_100000210202 [0,2,0,0,0,0|1,0,0]=3 21086 B12R1.268 CCNc1cc(ccc1CO)F 34a_100011996588_100000210202 [0,2,0,0,0,0|1,0,0]=3 21087 B12R1.268 CCNc1cc(ccc1OC)Br 34a_100000743470_100000210202 [0,2,0,0,0,0|1,0,0]=3 21088 B12R1.268 CCNc1cc(ccc1OC)C 2230a_100000210980_100000210202 [0,2,0,0,0,0|1,0,0]=3 21089 B12R1.268 CCNc1cc(ccc1OC)C 34a_100000210980_100000210202 [0,2,0,0,0,0|1,0,0]=3 21090 B12R1.268 CCNc1cc(ccc1OC)Cl 34a_100000182114_100000210202 [0,2,0,0,0,0|1,0,0]=3 21091 B12R1.268 CCNc1cc(ccc1OC)F 34a_100000757179_100000210202 [0,2,0,0,0,0|1,0,0]=3 21092 B12R1.268 CCNc1cc(ccc1SC)Cl 34a_100000745667_100000210202 [0,2,0,0,0,0|1,1,0]=4 21093 B12R1.268 CCNc1cc(ncc1CO)O 271570a_203496583355_100009950477 [0,2,0,0,0,0|2,0,0]=4 21094 B12R1.268 CCOc1cc(ccc1C#N)Br 34a_100011934713_100000210202 [0,2,0,0,0,0|2,0,0]=4 21095 B12R1.268 CCOc1cc(ccc1C#N)Br 7a_100011934713_100000210202 [0,2,0,0,0,0|2,0,0]=4 21096 B12R1.268 CCOc1cc(ccc1C#N)C 34a_100011640519_100000210202 [0,2,0,0,0,0|2,0,0]=4 21097 B12R1.268 CCOc1cc(ccc1C#N)C 7a_100011640519_100000210202 [0,2,0,0,0,0|2,0,0]=4 21098 B12R1.268 CCOc1cc(ccc1C#N)Cl 34a_100000688488_100000210202 [0,2,0,0,0,0|2,0,0]=4 21099 B12R1.268 CCOc1cc(ccc1C#N)Cl 7a_100000688488_100000210202 [0,2,0,0,0,0|2,0,0]=4 21100 B12R1.268 CCOc1cc(ccc1C#N)F 34a_100012185923_100000210202 [0,2,0,0,0,0|2,0,0]=4 21101 B12R1.268 CCOc1cc(ccc1C#N)F 7a_100012185923_100000210202 [0,2,0,0,0,0|2,0,0]=4 21102 B12R1.268 CCOc1cc(ccc1C#N)N 34a_100000094571_100000210202 [0,2,0,0,0,0|2,0,0]=4 21103 B12R1.268 CCOc1cc(ccc1C#N)N 7a_100000094571_100000210202 [0,2,0,0,0,0|2,0,0]=4 21104 B12R1.268 CCOc1cc(ccc1C#N)O 271570a_203496583355_100013120067 [0,2,0,0,0,0|2,0,0]=4 21105 B12R1.268 CCOc1cc(ccc1CO)Br 34a_100000071718_100000210202 [0,2,0,0,0,0|1,0,0]=3 21106 B12R1.268 CCOc1cc(ccc1CO)Br 7a_100000071718_100000210202 [0,2,0,0,0,0|1,0,0]=3 21107 B12R1.268 CCOc1cc(ccc1NC)Br 2230a_100000688918_200000210301 [0,2,0,0,0,0|2,0,0]=4 21108 B12R1.268 CCOc1cc(ccc1NC)Br 34a_100000688918_200000210301 [0,2,0,0,0,0|2,0,0]=4 21109 B12R1.268 CCOc1cc(ccc1NC)C 2230a_100000742043_200000210301 [0,2,0,0,0,0|2,0,0]=4 21110 B12R1.268 CCOc1cc(ccc1NC)C 34a_100000742043_200000210301 [0,2,0,0,0,0|2,0,0]=4 21111 B12R1.268 CCOc1cc(ccc1NC)Cl 34a_100000687649_200000210301 [0,2,0,0,0,0|2,0,0]=4 21112 B12R1.268 CCOc1cc(ccc1NC)F 2230a_100000741351_200000210301 [0,2,0,0,0,0|2,0,0]=4 21113 B12R1.268 CCOc1cc(ccc1NC)F 34a_100000741351_200000210301 [0,2,0,0,0,0|2,0,0]=4 21114 B12R1.268 CCOc1cc(ccc1N[13CH3])Br 2230a_100000688918_200025704644 [0,2,0,0,0,0|2,0,0]=4 21115 B12R1.268 CCOc1cc(ccc1N[13CH3])Br 34a_100000688918_200025704644 [0,2,0,0,0,0|2,0,0]=4 21116 B12R1.268 CCOc1cc(ccc1N[13CH3])C 2230a_100000742043_200025704644 [0,2,0,0,0,0|2,0,0]=4 21117 B12R1.268 CCOc1cc(ccc1N[13CH3])C 34a_100000742043_200025704644 [0,2,0,0,0,0|2,0,0]=4 21118 B12R1.268 CCOc1cc(ccc1N[13CH3])Cl 34a_100000687649_200025704644 [0,2,0,0,0,0|2,0,0]=4 21119 B12R1.268 CCOc1cc(ccc1N[13CH3])F 2230a_100000741351_200025704644 [0,2,0,0,0,0|2,0,0]=4 21120 B12R1.268 CCOc1cc(ccc1N[13CH3])F 34a_100000741351_200025704644 [0,2,0,0,0,0|2,0,0]=4 21121 B12R1.268 CCOc1cc(ccc1OC)Br 34a_100009816560_100000210202 [0,2,0,0,0,0|1,0,0]=3 21122 B12R1.268 CCOc1cc(ccc1OC)Br 7a_100009816560_100000210202 [0,2,0,0,0,0|1,0,0]=3 21123 B12R1.268 CCOc1cc(ccc1OC)C 34a_100011216497_100000210202 [0,2,0,0,0,0|1,0,0]=3 21124 B12R1.268 CCOc1cc(ccc1OC)C 34a_200000034294_200000210301 [0,2,0,0,0,0|1,0,0]=3 21125 B12R1.268 CCOc1cc(ccc1OC)C 7a_100011216497_100000210202 [0,2,0,0,0,0|1,0,0]=3 21126 B12R1.268 CCOc1cc(ccc1OC)C 7a_200000034294_200000210301 [0,2,0,0,0,0|1,0,0]=3 21127 B12R1.268 CCOc1cc(ccc1OC)Cl 34a_100000101779_100000210202 [0,2,0,0,0,0|1,0,0]=3 21128 B12R1.268 CCOc1cc(ccc1OC)Cl 7a_100000101779_100000210202 [0,2,0,0,0,0|1,0,0]=3 21129 B12R1.268 CCOc1cc(ccc1OC)F 34a_100000034962_100000210202 [0,2,0,0,0,0|1,0,0]=3 21130 B12R1.268 CCOc1cc(ccc1OC)F 7a_100000034962_100000210202 [0,2,0,0,0,0|1,0,0]=3 21131 B12R1.268 CCOc1cc(ccc1OC)N 34a_100000211920_100000210202 [0,2,0,0,0,0|1,0,0]=3 21132 B12R1.268 CCOc1cc(ccc1OC)O 271570a_203496583355_200010219349 [0,2,0,0,0,0|1,0,0]=3 21133 B12R1.268 CCOc1cc(ccc1O[13CH3])C 34a_200000034294_200025704644 [0,2,0,0,0,0|1,0,0]=3 21134 B12R1.268 CCOc1cc(ccc1O[13CH3])C 7a_200000034294_200025704644 [0,2,0,0,0,0|1,0,0]=3 21135 B12R1.268 CCOc1cc(ccc1SC)C 62a_200000210301_200010713166 [0,2,0,0,0,0|1,1,0]=4 21136 B12R1.268 CCOc1cc(ccc1SC)C 62a_200010713166_200000210301 [0,2,0,0,0,0|1,1,0]=4 21137 B12R1.268 CCOc1cc(ccc1SC)F 62a_200000210301_200012340411 [0,2,0,0,0,0|1,1,0]=4 21138 B12R1.268 CCOc1cc(ccc1SC)F 62a_200012340411_200000210301 [0,2,0,0,0,0|1,1,0]=4 21139 B12R1.268 CCOc1cc(ccc1SC)N 62a_200000210301_200016990551 [0,2,0,0,0,0|1,1,0]=4 21140 B12R1.268 CCOc1cc(ccc1SC)N 62a_200016990551_200000210301 [0,2,0,0,0,0|1,1,0]=4 21141 B12R1.268 CCOc1cc(ccc1S[13CH3])C 62a_200010713166_200025704644 [0,2,0,0,0,0|1,1,0]=4 21142 B12R1.268 CCOc1cc(ccc1S[13CH3])C 62a_200025704644_200010713166 [0,2,0,0,0,0|1,1,0]=4 21143 B12R1.268 CCOc1cc(ccc1S[13CH3])F 62a_200012340411_200025704644 [0,2,0,0,0,0|1,1,0]=4 21144 B12R1.268 CCOc1cc(ccc1S[13CH3])F 62a_200025704644_200012340411 [0,2,0,0,0,0|1,1,0]=4 21145 B12R1.268 CCOc1cc(ccc1S[13CH3])N 62a_200016990551_200025704644 [0,2,0,0,0,0|1,1,0]=4 21146 B12R1.268 CCOc1cc(ccc1S[13CH3])N 62a_200025704644_200016990551 [0,2,0,0,0,0|1,1,0]=4 21147 B12R1.268 CCOc1cc(cnc1OC)Br 34a_100010135713_100000210202 [0,2,0,0,0,0|2,0,0]=4 21148 B12R1.268 CCOc1cc(ncc1OC)Br 34a_100010264082_100000210202 [0,2,0,0,0,0|2,0,0]=4 21149 B12R1.268 CCOc1cc(ncc1OC)Cl 34a_100009849459_100000210202 [0,2,0,0,0,0|2,0,0]=4 21150 B12R1.268 CCSc1cc(=O)[nH]cc1OC 62a_100000210202_100121573661 [0,2,0,0,0,0|2,0,0]=4 21151 B12R1.268 CCSc1cc(=O)[nH]cc1OC 62a_100121573661_100000210202 [0,2,0,0,0,0|2,0,0]=4 21152 B12R1.268 CCSc1cc(ccc1C#N)Br 62a_100000210202_100010214477 [0,2,0,0,0,0|2,0,0]=4 21153 B12R1.268 CCSc1cc(ccc1C#N)C 62a_100000210202_100000693804 [0,2,0,0,0,0|2,0,0]=4 21154 B12R1.268 CCSc1cc(ccc1C#N)Cl 62a_100000210202_100012355178 [0,2,0,0,0,0|2,0,0]=4 21155 B12R1.268 CCSc1cc(ccc1C#N)F 62a_100000210202_100011935285 [0,2,0,0,0,0|2,0,0]=4 21156 B12R1.268 CCSc1cc(ccc1C#N)N 62a_100000210202_100000689153 [0,2,0,0,0,0|2,0,0]=4 21157 B12R1.268 CCSc1cc(ccc1C#N)O 62a_100000210202_100012184851 [0,2,0,0,0,0|2,0,0]=4 21158 B12R1.268 CCSc1cc(ccc1C=O)Br 62a_100000210202_100010146562 [0,2,0,0,0,0|1,0,1]=4 21159 B12R1.268 CCSc1cc(ccc1C=O)Br 62a_100010146562_100000210202 [0,2,0,0,0,0|1,0,1]=4 21160 B12R1.268 CCSc1cc(ccc1C=O)C 62a_100000210202_100011935181 [0,2,0,0,0,0|1,0,1]=4 21161 B12R1.268 CCSc1cc(ccc1C=O)C 62a_100011935181_100000210202 [0,2,0,0,0,0|1,0,1]=4 21162 B12R1.268 CCSc1cc(ccc1C=O)F 62a_100000210202_100000752949 [0,2,0,0,0,0|1,0,1]=4 21163 B12R1.268 CCSc1cc(ccc1C=O)F 62a_100000752949_100000210202 [0,2,0,0,0,0|1,0,1]=4 21164 B12R1.268 CCSc1cc(ccc1C=O)O 62a_100000210202_100011236494 [0,2,0,0,0,0|1,0,1]=4 21165 B12R1.268 CCSc1cc(ccc1C=O)O 62a_100011236494_100000210202 [0,2,0,0,0,0|1,0,1]=4 21166 B12R1.268 CCSc1cc(ccc1CN)F 62a_100000210202_100000708791 [0,2,0,0,0,0|2,0,0]=4 21167 B12R1.268 CCSc1cc(ccc1CN)F 62a_100000708791_100000210202 [0,2,0,0,0,0|2,0,0]=4 21168 B12R1.268 CCSc1cc(ccc1CO)Br 62a_100000210202_100010146605 [0,2,0,0,0,0|1,0,0]=3 21169 B12R1.268 CCSc1cc(ccc1CO)Br 62a_100010146605_100000210202 [0,2,0,0,0,0|1,0,0]=3 21170 B12R1.268 CCSc1cc(ccc1CO)Cl 62a_100000210202_100000722340 [0,2,0,0,0,0|1,0,0]=3 21171 B12R1.268 CCSc1cc(ccc1CO)Cl 62a_100000722340_100000210202 [0,2,0,0,0,0|1,0,0]=3 21172 B12R1.268 CCSc1cc(ccc1CO)F 62a_100000210202_100000744086 [0,2,0,0,0,0|1,0,0]=3 21173 B12R1.268 CCSc1cc(ccc1CO)F 62a_100000744086_100000210202 [0,2,0,0,0,0|1,0,0]=3 21174 B12R1.268 CCSc1cc(ccc1CO)O 62a_100000210202_100010146404 [0,2,0,0,0,0|1,0,0]=3 21175 B12R1.268 CCSc1cc(ccc1CO)O 62a_100010146404_100000210202 [0,2,0,0,0,0|1,0,0]=3 21176 B12R1.268 CCSc1cc(ccc1NC)C 62a_100000210202_100000221369 [0,2,0,0,0,0|2,0,0]=4 21177 B12R1.268 CCSc1cc(ccc1NC)C 62a_100000221369_100000210202 [0,2,0,0,0,0|2,0,0]=4 21178 B12R1.268 CCSc1cc(ccc1NC)F 62a_100000210202_100011246292 [0,2,0,0,0,0|2,0,0]=4 21179 B12R1.268 CCSc1cc(ccc1NC)F 62a_100011246292_100000210202 [0,2,0,0,0,0|2,0,0]=4 21180 B12R1.268 CCSc1cc(ccc1NN)C 62a_100000210202_100016996181 [0,2,0,0,0,0|2,0,0]=4 21181 B12R1.268 CCSc1cc(ccc1NN)C 62a_100016996181_100000210202 [0,2,0,0,0,0|2,0,0]=4 21182 B12R1.268 CCSc1cc(ccc1OC)Br 62a_100000210202_100012351588 [0,2,0,0,0,0|1,0,0]=3 21183 B12R1.268 CCSc1cc(ccc1OC)Br 62a_100012351588_100000210202 [0,2,0,0,0,0|1,0,0]=3 21184 B12R1.268 CCSc1cc(ccc1OC)C 62a_100000186399_100000210202 [0,2,0,0,0,0|1,0,0]=3 21185 B12R1.268 CCSc1cc(ccc1OC)C 62a_100000210202_100000186399 [0,2,0,0,0,0|1,0,0]=3 21186 B12R1.268 CCSc1cc(ccc1OC)Cl 62a_100000210202_100011215930 [0,2,0,0,0,0|1,0,0]=3 21187 B12R1.268 CCSc1cc(ccc1OC)Cl 62a_100011215930_100000210202 [0,2,0,0,0,0|1,0,0]=3 21188 B12R1.268 CCSc1cc(ccc1OC)F 62a_100000171694_100000210202 [0,2,0,0,0,0|1,0,0]=3 21189 B12R1.268 CCSc1cc(ccc1OC)F 62a_100000210202_100000171694 [0,2,0,0,0,0|1,0,0]=3 21190 B12R1.268 CCSc1cc(ccc1OC)N 62a_100000210202_100011356947 [0,2,0,0,0,0|1,0,0]=3 21191 B12R1.268 CCSc1cc(ccc1OC)N 62a_100011356947_100000210202 [0,2,0,0,0,0|1,0,0]=3 21192 B12R1.268 CCSc1cc(ccc1OC)O 62a_100000210202_100010234764 [0,2,0,0,0,0|1,0,0]=3 21193 B12R1.268 CCSc1cc(ccc1OC)O 62a_100010234764_100000210202 [0,2,0,0,0,0|1,0,0]=3 21194 B12R1.268 CCSc1cc(ccc1SC)C 62a_100000210202_200010201864 [0,2,0,0,0,0|1,1,0]=4 21195 B12R1.268 CCSc1cc(ccc1SC)C 62a_200010201864_100000210202 [0,2,0,0,0,0|1,1,0]=4 21196 B12R1.268 CCSc1cc(ccc1SC)F 62a_100000210202_100009817003 [0,2,0,0,0,0|1,1,0]=4 21197 B12R1.268 CCSc1cc(ccc1SC)F 62a_100009817003_100000210202 [0,2,0,0,0,0|1,1,0]=4 21198 B12R1.268 CCSc1cc(cnc1OC)Br 62a_100000210202_100009814608 [0,2,0,0,0,0|2,0,0]=4 21199 B12R1.268 CCSc1cc(cnc1OC)Br 62a_100009814608_100000210202 [0,2,0,0,0,0|2,0,0]=4 21200 B12R1.268 CCSc1cc(cnc1OC)C 62a_100000210202_100012353929 [0,2,0,0,0,0|2,0,0]=4 21201 B12R1.268 CCSc1cc(cnc1OC)C 62a_100012353929_100000210202 [0,2,0,0,0,0|2,0,0]=4 21202 B12R1.268 CCSc1cc(cnc1OC)F 62a_100000210202_100009828472 [0,2,0,0,0,0|2,0,0]=4 21203 B12R1.268 CCSc1cc(cnc1OC)F 62a_100009828472_100000210202 [0,2,0,0,0,0|2,0,0]=4 21204 B12R1.268 CCSc1cc(cnc1OC)N 62a_100000210202_100012351452 [0,2,0,0,0,0|2,0,0]=4 21205 B12R1.268 CCSc1cc(cnc1OC)N 62a_100012351452_100000210202 [0,2,0,0,0,0|2,0,0]=4 21206 B12R1.268 CCSc1cc(ncc1OC)C 62a_100000210202_100010109759 [0,2,0,0,0,0|2,0,0]=4 21207 B12R1.268 CCSc1cc(ncc1OC)C 62a_100010109759_100000210202 [0,2,0,0,0,0|2,0,0]=4 21208 B12R1.268 CCSc1nc(ccc1CO)C 62a_100000210202_102495338573 [0,2,0,0,0,0|2,0,0]=4 21209 B12R1.268 CCSc1nc(ccc1CO)C 62a_102495338573_100000210202 [0,2,0,0,0,0|2,0,0]=4 21210 B12R1.268 CCSc1nc(ccc1OC)C 62a_100000210202_100009820875 [0,2,0,0,0,0|2,0,0]=4 21211 B12R1.268 CCSc1nc(ccc1OC)C 62a_100009820875_100000210202 [0,2,0,0,0,0|2,0,0]=4 21212 B12R1.268 CCSc1nc(ccc1OC)N 62a_100000210202_100010172607 [0,2,0,0,0,0|2,0,0]=4 21213 B12R1.268 CCSc1nc(ccc1OC)N 62a_100010172607_100000210202 [0,2,0,0,0,0|2,0,0]=4 21214 B12R1.268 CCc1ccc(cc1COC)Br 34a_100010766240_200000210301 [0,2,0,0,0,0|2,0,0]=4 21215 B12R1.268 CCc1ccc(cc1COC)Br 7a_100010766240_200000210301 [0,2,0,0,0,0|2,0,0]=4 21216 B12R1.268 CCc1ccc(cc1CO[13CH3])Br 34a_100010766240_200025704644 [0,2,0,0,0,0|2,0,0]=4 21217 B12R1.268 CCc1ccc(cc1CO[13CH3])Br 7a_100010766240_200025704644 [0,2,0,0,0,0|2,0,0]=4 21218 B12R1.268 CNCc1cc(ccc1C#N)Br 2230a_106832991635_100000718229 [0,2,0,0,0,0|2,0,0]=4 21219 B12R1.268 CNCc1cc(ccc1C#N)Br 26a_100102657272_100011934713 [0,2,0,0,0,0|2,0,0]=4 21220 B12R1.268 CNCc1cc(ccc1C#N)Br 34a_100102657272_100000718229 [0,2,0,0,0,0|2,0,0]=4 21221 B12R1.268 CNCc1cc(ccc1C#N)Br 7a_106832991635_100000718229 [0,2,0,0,0,0|2,0,0]=4 21222 B12R1.268 CNCc1cc(ccc1C#N)F 2230a_106832991635_100000759424 [0,2,0,0,0,0|2,0,0]=4 21223 B12R1.268 CNCc1cc(ccc1C#N)F 34a_100102657272_100000759424 [0,2,0,0,0,0|2,0,0]=4 21224 B12R1.268 CNCc1cc(ccc1C#N)F 7a_106832991635_100000759424 [0,2,0,0,0,0|2,0,0]=4 21225 B12R1.268 CNCc1cc(ccc1C=O)F 2230a_106832991635_100010132768 [0,2,0,0,0,0|1,0,1]=4 21226 B12R1.268 CNCc1cc(ccc1C=O)F 34a_100102657272_100010132768 [0,2,0,0,0,0|1,0,1]=4 21227 B12R1.268 CNCc1cc(ccc1C=O)F 7a_106832991635_100010132768 [0,2,0,0,0,0|1,0,1]=4 21228 B12R1.268 CNCc1cc(ccc1CO)Br 26a_100102657272_100000071718 [0,2,0,0,0,0|1,0,0]=3 21229 B12R1.268 CNCc1cc(ccc1OC)Br 207a_100102657272_100000170026 [0,2,0,0,0,0|1,0,0]=3 21230 B12R1.268 CNCc1cc(ccc1OC)Br 2230a_106832991635_100000204665 [0,2,0,0,0,0|1,0,0]=3 21231 B12R1.268 CNCc1cc(ccc1OC)Br 26a_100102657272_100009816560 [0,2,0,0,0,0|1,0,0]=3 21232 B12R1.268 CNCc1cc(ccc1OC)Br 270004a_106832991635_100000170026 [0,2,0,0,0,0|1,0,0]=3 21233 B12R1.268 CNCc1cc(ccc1OC)Br 34a_100000690498_200000210301 [0,2,0,0,0,0|1,0,0]=3 21234 B12R1.268 CNCc1cc(ccc1OC)Br 34a_100011602694_200000210301 [0,2,0,0,0,0|1,0,0]=3 21235 B12R1.268 CNCc1cc(ccc1OC)Br 34a_100102657272_100000204665 [0,2,0,0,0,0|1,0,0]=3 21236 B12R1.268 CNCc1cc(ccc1OC)Br 7a_106832991635_100000204665 [0,2,0,0,0,0|1,0,0]=3 21237 B12R1.268 CNCc1cc(ccc1OC)C 207a_100102657272_100000203738 [0,2,0,0,0,0|1,0,0]=3 21238 B12R1.268 CNCc1cc(ccc1OC)C 2230a_106832991635_100000199068 [0,2,0,0,0,0|1,0,0]=3 21239 B12R1.268 CNCc1cc(ccc1OC)C 270004a_106832991635_100000203738 [0,2,0,0,0,0|1,0,0]=3 21240 B12R1.268 CNCc1cc(ccc1OC)C 34a_100102657272_100000199068 [0,2,0,0,0,0|1,0,0]=3 21241 B12R1.268 CNCc1cc(ccc1OC)C 7a_106832991635_100000199068 [0,2,0,0,0,0|1,0,0]=3 21242 B12R1.268 CNCc1cc(ccc1OC)Cl 207a_100102657272_100000188328 [0,2,0,0,0,0|1,0,0]=3 21243 B12R1.268 CNCc1cc(ccc1OC)Cl 2230a_100000740580_200000210301 [0,2,0,0,0,0|1,0,0]=3 21244 B12R1.268 CNCc1cc(ccc1OC)Cl 2230a_106832991635_100000209806 [0,2,0,0,0,0|1,0,0]=3 21245 B12R1.268 CNCc1cc(ccc1OC)Cl 270004a_106832991635_100000188328 [0,2,0,0,0,0|1,0,0]=3 21246 B12R1.268 CNCc1cc(ccc1OC)Cl 34a_100000712467_200000210301 [0,2,0,0,0,0|1,0,0]=3 21247 B12R1.268 CNCc1cc(ccc1OC)Cl 34a_100000740580_200000210301 [0,2,0,0,0,0|1,0,0]=3 21248 B12R1.268 CNCc1cc(ccc1OC)Cl 34a_100102657272_100000209806 [0,2,0,0,0,0|1,0,0]=3 21249 B12R1.268 CNCc1cc(ccc1OC)Cl 7a_106832991635_100000209806 [0,2,0,0,0,0|1,0,0]=3 21250 B12R1.268 CNCc1cc(ccc1OC)F 207a_100102657272_100000722865 [0,2,0,0,0,0|1,0,0]=3 21251 B12R1.268 CNCc1cc(ccc1OC)F 2230a_106832991635_100011830354 [0,2,0,0,0,0|1,0,0]=3 21252 B12R1.268 CNCc1cc(ccc1OC)F 270004a_106832991635_100000722865 [0,2,0,0,0,0|1,0,0]=3 21253 B12R1.268 CNCc1cc(ccc1OC)F 34a_100011199032_200000210301 [0,2,0,0,0,0|1,0,0]=3 21254 B12R1.268 CNCc1cc(ccc1OC)F 34a_100102657272_100011830354 [0,2,0,0,0,0|1,0,0]=3 21255 B12R1.268 CNCc1cc(ccc1OC)F 34a_114855342409_200000210301 [0,2,0,0,0,0|1,0,0]=3 21256 B12R1.268 CNCc1cc(ccc1OC)F 7a_106832991635_100011830354 [0,2,0,0,0,0|1,0,0]=3 21257 B12R1.268 CNCc1cc(ccc1OC)I 207a_100102657272_100011266407 [0,2,0,0,0,0|1,0,0]=3 21258 B12R1.268 CNCc1cc(ccc1OC)I 270004a_106832991635_100011266407 [0,2,0,0,0,0|1,0,0]=3 21259 B12R1.268 CNCc1cc(ccc1OC)O 207a_100102657272_100000067581 [0,2,0,0,0,0|1,0,0]=3 21260 B12R1.268 CNCc1cc(ccc1OC)O 271570a_203496583355_100000690607 [0,2,0,0,0,0|1,0,0]=3 21261 B12R1.268 CNCc1cc(ccc1O[13CH3])Br 34a_100011602694_200025704644 [0,2,0,0,0,0|1,0,0]=3 21262 B12R1.268 CNCc1cc(ccc1O[13CH3])Cl 34a_100000712467_200025704644 [0,2,0,0,0,0|1,0,0]=3 21263 B12R1.268 CNCc1cc(ccc1O[13CH3])F 34a_114855342409_200025704644 [0,2,0,0,0,0|1,0,0]=3 21264 B12R1.268 CNCc1cc(cnc1OC)Br 207a_100102657272_100009814609 [0,2,0,0,0,0|2,0,0]=4 21265 B12R1.268 CNCc1cc(cnc1OC)Br 2230a_106832991635_100010065838 [0,2,0,0,0,0|2,0,0]=4 21266 B12R1.268 CNCc1cc(cnc1OC)Br 270004a_106832991635_100009814609 [0,2,0,0,0,0|2,0,0]=4 21267 B12R1.268 CNCc1cc(cnc1OC)Br 34a_100102657272_100010065838 [0,2,0,0,0,0|2,0,0]=4 21268 B12R1.268 CNCc1cc(cnc1OC)Br 7a_106832991635_100010065838 [0,2,0,0,0,0|2,0,0]=4 21269 B12R1.268 CNCc1cc(cnc1OC)C 207a_100102657272_100000118322 [0,2,0,0,0,0|2,0,0]=4 21270 B12R1.268 CNCc1cc(cnc1OC)C 270004a_106832991635_100000118322 [0,2,0,0,0,0|2,0,0]=4 21271 B12R1.268 CNCc1cc(cnc1OC)F 207a_100102657272_100000081817 [0,2,0,0,0,0|2,0,0]=4 21272 B12R1.268 CNCc1cc(cnc1OC)F 270004a_106832991635_100000081817 [0,2,0,0,0,0|2,0,0]=4 21273 B12R1.268 CNCc1nc(ccc1OC)Br 270004a_106832991635_200010137984 [0,2,0,0,0,0|2,0,0]=4 21274 B12R1.268 COCc1cc(ccc1C#N)Br 34a_100138415774_100000718229 [0,2,0,0,0,0|2,0,0]=4 21275 B12R1.268 COCc1cc(ccc1C#N)F 34a_100138415774_100000759424 [0,2,0,0,0,0|2,0,0]=4 21276 B12R1.268 COCc1cc(ccc1C#N)F 34a_200011935090_200000210301 [0,2,0,0,0,0|2,0,0]=4 21277 B12R1.268 COCc1cc(ccc1C#N)F 7a_200011935090_200000210301 [0,2,0,0,0,0|2,0,0]=4 21278 B12R1.268 COCc1cc(ccc1C=O)F 34a_100138415774_100010132768 [0,2,0,0,0,0|1,0,1]=4 21279 B12R1.268 COCc1cc(ccc1OC)Br 34a_100000204679_200000210301 [0,2,0,0,0,0|1,0,0]=3 21280 B12R1.268 COCc1cc(ccc1OC)Br 34a_100138415774_100000204665 [0,2,0,0,0,0|1,0,0]=3 21281 B12R1.268 COCc1cc(ccc1OC)Br 7a_100000204679_200000210301 [0,2,0,0,0,0|1,0,0]=3 21282 B12R1.268 COCc1cc(ccc1OC)C 34a_100138415774_100000199068 [0,2,0,0,0,0|1,0,0]=3 21283 B12R1.268 COCc1cc(ccc1OC)C 34a_200000246444_200000210301 [0,2,0,0,0,0|1,0,0]=3 21284 B12R1.268 COCc1cc(ccc1OC)C 7a_200000246444_200000210301 [0,2,0,0,0,0|1,0,0]=3 21285 B12R1.268 COCc1cc(ccc1OC)Cl 34a_100138415774_100000209806 [0,2,0,0,0,0|1,0,0]=3 21286 B12R1.268 COCc1cc(ccc1OC)F 34a_100011266440_200000210301 [0,2,0,0,0,0|1,0,0]=3 21287 B12R1.268 COCc1cc(ccc1OC)F 34a_100135391359_200000210301 [0,2,0,0,0,0|1,0,0]=3 21288 B12R1.268 COCc1cc(ccc1OC)F 34a_100138415774_100011830354 [0,2,0,0,0,0|1,0,0]=3 21289 B12R1.268 COCc1cc(ccc1OC)F 7a_100011266440_200000210301 [0,2,0,0,0,0|1,0,0]=3 21290 B12R1.268 COCc1cc(ccc1OC)F 7a_100135391359_200000210301 [0,2,0,0,0,0|1,0,0]=3 21291 B12R1.268 COCc1cc(ccc1OC)I 34a_200137411115_200000210301 [0,2,0,0,0,0|1,0,0]=3 21292 B12R1.268 COCc1cc(ccc1OC)I 7a_200137411115_200000210301 [0,2,0,0,0,0|1,0,0]=3 21293 B12R1.268 COCc1cc(ccc1OC)O 271570a_203496583355_200011493686 [0,2,0,0,0,0|1,0,0]=3 21294 B12R1.268 COCc1cc(ccc1O[13CH3])F 34a_100135391359_200025704644 [0,2,0,0,0,0|1,0,0]=3 21295 B12R1.268 COCc1cc(ccc1O[13CH3])F 7a_100135391359_200025704644 [0,2,0,0,0,0|1,0,0]=3 21296 B12R1.268 COCc1cc(cnc1OC)Br 34a_100000695684_200000210301 [0,2,0,0,0,0|2,0,0]=4 21297 B12R1.268 COCc1cc(cnc1OC)Br 34a_100138415774_100010065838 [0,2,0,0,0,0|2,0,0]=4 21298 B12R1.268 COCc1cc(cnc1OC)F 34a_100011997213_200000210301 [0,2,0,0,0,0|2,0,0]=4 21299 B12R1.268 COc1ccc(cc1CC#N)O 271570a_203496583355_200011218486 [0,2,0,0,0,0|1,0,1]=4 21300 B12R1.268 COc1ccc(cc1CCN)O 271570a_203496583355_100000763266 [0,2,0,0,0,0|1,0,0]=3 21301 B12R1.268 COc1ccc(cc1CN[13CH3])Br 34a_100000690498_200025704644 [0,2,0,0,0,0|1,0,0]=3 21302 B12R1.268 COc1ccc(cc1CN[13CH3])Cl 2230a_100000740580_200025704644 [0,2,0,0,0,0|1,0,0]=3 21303 B12R1.268 COc1ccc(cc1CN[13CH3])Cl 34a_100000740580_200025704644 [0,2,0,0,0,0|1,0,0]=3 21304 B12R1.268 COc1ccc(cc1CN[13CH3])F 34a_100011199032_200025704644 [0,2,0,0,0,0|1,0,0]=3 21305 B12R1.268 COc1ccc(cc1CO[13CH3])Br 34a_100000204679_200025704644 [0,2,0,0,0,0|1,0,0]=3 21306 B12R1.268 COc1ccc(cc1CO[13CH3])Br 7a_100000204679_200025704644 [0,2,0,0,0,0|1,0,0]=3 21307 B12R1.268 COc1ccc(cc1CO[13CH3])C 34a_200000246444_200025704644 [0,2,0,0,0,0|1,0,0]=3 21308 B12R1.268 COc1ccc(cc1CO[13CH3])C 7a_200000246444_200025704644 [0,2,0,0,0,0|1,0,0]=3 21309 B12R1.268 COc1ccc(cc1CO[13CH3])F 34a_100011266440_200025704644 [0,2,0,0,0,0|1,0,0]=3 21310 B12R1.268 COc1ccc(cc1CO[13CH3])F 7a_100011266440_200025704644 [0,2,0,0,0,0|1,0,0]=3 21311 B12R1.268 COc1ccc(cc1CO[13CH3])I 34a_200137411115_200025704644 [0,2,0,0,0,0|1,0,0]=3 21312 B12R1.268 COc1ccc(cc1CO[13CH3])I 7a_200137411115_200025704644 [0,2,0,0,0,0|1,0,0]=3 21313 B12R1.268 COc1ccc(cc1CSC)Br 62a_100000204665_200000210301 [0,2,0,0,0,0|1,0,0]=3 21314 B12R1.268 COc1ccc(cc1CSC)Br 62a_200000210301_100000204665 [0,2,0,0,0,0|1,0,0]=3 21315 B12R1.268 COc1ccc(cc1CSC)C 62a_100000199068_200000210301 [0,2,0,0,0,0|1,0,0]=3 21316 B12R1.268 COc1ccc(cc1CSC)C 62a_200000210301_100000199068 [0,2,0,0,0,0|1,0,0]=3 21317 B12R1.268 COc1ccc(cc1CSC)Cl 62a_100000209806_200000210301 [0,2,0,0,0,0|1,0,0]=3 21318 B12R1.268 COc1ccc(cc1CSC)Cl 62a_200000210301_100000209806 [0,2,0,0,0,0|1,0,0]=3 21319 B12R1.268 COc1ccc(cc1CSC)F 62a_100011830354_200000210301 [0,2,0,0,0,0|1,0,0]=3 21320 B12R1.268 COc1ccc(cc1CSC)F 62a_200000210301_100011830354 [0,2,0,0,0,0|1,0,0]=3 21321 B12R1.268 COc1ccc(cc1CS[13CH3])Br 62a_100000204665_200025704644 [0,2,0,0,0,0|1,0,0]=3 21322 B12R1.268 COc1ccc(cc1CS[13CH3])Br 62a_200025704644_100000204665 [0,2,0,0,0,0|1,0,0]=3 21323 B12R1.268 COc1ccc(cc1CS[13CH3])C 62a_100000199068_200025704644 [0,2,0,0,0,0|1,0,0]=3 21324 B12R1.268 COc1ccc(cc1CS[13CH3])C 62a_200025704644_100000199068 [0,2,0,0,0,0|1,0,0]=3 21325 B12R1.268 COc1ccc(cc1CS[13CH3])Cl 62a_100000209806_200025704644 [0,2,0,0,0,0|1,0,0]=3 21326 B12R1.268 COc1ccc(cc1CS[13CH3])Cl 62a_200025704644_100000209806 [0,2,0,0,0,0|1,0,0]=3 21327 B12R1.268 COc1ccc(cc1CS[13CH3])F 62a_100011830354_200025704644 [0,2,0,0,0,0|1,0,0]=3 21328 B12R1.268 COc1ccc(cc1CS[13CH3])F 62a_200025704644_100011830354 [0,2,0,0,0,0|1,0,0]=3 21329 B12R1.268 COc1ccc(cc1NCF)Br 34a_100000743470_100015361967 [0,2,0,0,0,0|2,0,0]=4 21330 B12R1.268 COc1ccc(cc1NCF)C 34a_100000210980_100015361967 [0,2,0,0,0,0|2,0,0]=4 21331 B12R1.268 COc1ccc(cc1NCF)Cl 34a_100000182114_100015361967 [0,2,0,0,0,0|2,0,0]=4 21332 B12R1.268 COc1ccc(cc1NCF)F 34a_100000757179_100015361967 [0,2,0,0,0,0|2,0,0]=4 21333 B12R1.268 COc1ccc(cc1OCF)Br 34a_100009816560_100015361967 [0,2,0,0,0,0|2,0,0]=4 21334 B12R1.268 COc1ccc(cc1OCF)Br 7a_100009816560_100015361967 [0,2,0,0,0,0|2,0,0]=4 21335 B12R1.268 COc1ccc(cc1OCF)C 34a_100011216497_100015361967 [0,2,0,0,0,0|2,0,0]=4 21336 B12R1.268 COc1ccc(cc1OCF)C 7a_100011216497_100015361967 [0,2,0,0,0,0|2,0,0]=4 21337 B12R1.268 COc1ccc(cc1OCF)Cl 34a_100000101779_100015361967 [0,2,0,0,0,0|2,0,0]=4 21338 B12R1.268 COc1ccc(cc1OCF)Cl 7a_100000101779_100015361967 [0,2,0,0,0,0|2,0,0]=4 21339 B12R1.268 COc1ccc(cc1OCF)F 34a_100000034962_100015361967 [0,2,0,0,0,0|2,0,0]=4 21340 B12R1.268 COc1ccc(cc1OCF)F 7a_100000034962_100015361967 [0,2,0,0,0,0|2,0,0]=4 21341 B12R1.268 COc1ccc(cc1OCF)N 34a_100000211920_100015361967 [0,2,0,0,0,0|2,0,0]=4 21342 B12R1.268 COc1ccc(cc1SCF)Br 62a_100012351588_100015361967 [0,2,0,0,0,0|2,0,0]=4 21343 B12R1.268 COc1ccc(cc1SCF)Br 62a_100015361967_100012351588 [0,2,0,0,0,0|2,0,0]=4 21344 B12R1.268 COc1ccc(cc1SCF)C 62a_100000186399_100015361967 [0,2,0,0,0,0|2,0,0]=4 21345 B12R1.268 COc1ccc(cc1SCF)C 62a_100015361967_100000186399 [0,2,0,0,0,0|2,0,0]=4 21346 B12R1.268 COc1ccc(cc1SCF)Cl 62a_100011215930_100015361967 [0,2,0,0,0,0|2,0,0]=4 21347 B12R1.268 COc1ccc(cc1SCF)Cl 62a_100015361967_100011215930 [0,2,0,0,0,0|2,0,0]=4 21348 B12R1.268 COc1ccc(cc1SCF)F 62a_100000171694_100015361967 [0,2,0,0,0,0|2,0,0]=4 21349 B12R1.268 COc1ccc(cc1SCF)F 62a_100015361967_100000171694 [0,2,0,0,0,0|2,0,0]=4 21350 B12R1.268 COc1ccc(cc1SCF)N 62a_100011356947_100015361967 [0,2,0,0,0,0|2,0,0]=4 21351 B12R1.268 COc1ccc(cc1SCF)N 62a_100015361967_100011356947 [0,2,0,0,0,0|2,0,0]=4 21352 B12R1.268 COc1ccc(cc1SCF)O 62a_100010234764_100015361967 [0,2,0,0,0,0|2,0,0]=4 21353 B12R1.268 COc1ccc(cc1SCF)O 62a_100015361967_100010234764 [0,2,0,0,0,0|2,0,0]=4 21354 B12R1.268 COc1ncc(cc1CO[13CH3])Br 34a_100000695684_200025704644 [0,2,0,0,0,0|2,0,0]=4 21355 B12R1.268 COc1ncc(cc1CO[13CH3])F 34a_100011997213_200025704644 [0,2,0,0,0,0|2,0,0]=4 21356 B12R1.268 COc1ncc(cc1CSC)Br 62a_100010065838_200000210301 [0,2,0,0,0,0|2,0,0]=4 21357 B12R1.268 COc1ncc(cc1CSC)Br 62a_200000210301_100010065838 [0,2,0,0,0,0|2,0,0]=4 21358 B12R1.268 COc1ncc(cc1CS[13CH3])Br 62a_100010065838_200025704644 [0,2,0,0,0,0|2,0,0]=4 21359 B12R1.268 COc1ncc(cc1CS[13CH3])Br 62a_200025704644_100010065838 [0,2,0,0,0,0|2,0,0]=4 21360 B12R1.268 CSCc1cc(ccc1C#N)Br 62a_100000718229_200000210301 [0,2,0,0,0,0|2,0,0]=4 21361 B12R1.268 CSCc1cc(ccc1C#N)Br 62a_200000210301_100000718229 [0,2,0,0,0,0|2,0,0]=4 21362 B12R1.268 CSCc1cc(ccc1C#N)F 62a_200000210301_100000759424 [0,2,0,0,0,0|2,0,0]=4 21363 B12R1.268 CSCc1cc(ccc1C=O)F 62a_100010132768_200000210301 [0,2,0,0,0,0|1,0,1]=4 21364 B12R1.268 CSCc1cc(ccc1C=O)F 62a_200000210301_100010132768 [0,2,0,0,0,0|1,0,1]=4 21365 B12R1.268 Cc1ccc(c(c1)NCF)CO 34a_100000087799_100015361967 [0,2,0,0,0,0|2,0,0]=4 21366 B12R1.268 OCc1ccc(cc1NCF)Br 34a_100000718831_100015361967 [0,2,0,0,0,0|2,0,0]=4 21367 B12R1.268 OCc1ccc(cc1NCF)Cl 34a_100000238622_100015361967 [0,2,0,0,0,0|2,0,0]=4 21368 B12R1.268 OCc1ccc(cc1NCF)F 34a_100011996588_100015361967 [0,2,0,0,0,0|2,0,0]=4 21369 B12R1.268 OCc1ccc(cc1OCF)Br 34a_100000071718_100015361967 [0,2,0,0,0,0|2,0,0]=4 21370 B12R1.268 OCc1ccc(cc1OCF)Br 7a_100000071718_100015361967 [0,2,0,0,0,0|2,0,0]=4 21371 B12R1.268 OCc1ccc(cc1SCF)Br 62a_100010146605_100015361967 [0,2,0,0,0,0|2,0,0]=4 21372 B12R1.268 OCc1ccc(cc1SCF)Br 62a_100015361967_100010146605 [0,2,0,0,0,0|2,0,0]=4 21373 B12R1.268 OCc1ccc(cc1SCF)Cl 62a_100000722340_100015361967 [0,2,0,0,0,0|2,0,0]=4 21374 B12R1.268 OCc1ccc(cc1SCF)Cl 62a_100015361967_100000722340 [0,2,0,0,0,0|2,0,0]=4 21375 B12R1.268 OCc1ccc(cc1SCF)F 62a_100000744086_100015361967 [0,2,0,0,0,0|2,0,0]=4 21376 B12R1.268 OCc1ccc(cc1SCF)F 62a_100015361967_100000744086 [0,2,0,0,0,0|2,0,0]=4 21377 B12R1.268 OCc1ccc(cc1SCF)O 62a_100010146404_100015361967 [0,2,0,0,0,0|2,0,0]=4 21378 B12R1.268 OCc1ccc(cc1SCF)O 62a_100015361967_100010146404 [0,2,0,0,0,0|2,0,0]=4 21379 B12R1.268 [13CH3]OCc1cc(ccc1C#N)F 34a_200011935090_200025704644 [0,2,0,0,0,0|2,0,0]=4 21380 B12R1.268 [13CH3]OCc1cc(ccc1C#N)F 7a_200011935090_200025704644 [0,2,0,0,0,0|2,0,0]=4 21381 B12R1.268 [13CH3]SCc1cc(ccc1C#N)Br 62a_100000718229_200025704644 [0,2,0,0,0,0|2,0,0]=4 21382 B12R1.268 [13CH3]SCc1cc(ccc1C#N)Br 62a_200025704644_100000718229 [0,2,0,0,0,0|2,0,0]=4 21383 B12R1.268 [13CH3]SCc1cc(ccc1C#N)F 62a_200025704644_100000759424 [0,2,0,0,0,0|2,0,0]=4 21384 B12R1.268 [13CH3]SCc1cc(ccc1C=O)F 62a_100010132768_200025704644 [0,2,0,0,0,0|1,0,1]=4 21385 B12R1.268 [13CH3]SCc1cc(ccc1C=O)F 62a_200025704644_100010132768 [0,2,0,0,0,0|1,0,1]=4 21386 B12R1.283 C=C(C)c1ccccc1CCN 271570a_100000694244_100000747383 [0,2,0,0,0,0|2,0,0]=4 21387 B12R1.283 C=C(C)c1ccccc1CCO 271570a_100000694244_100000731337 [0,2,0,0,0,0|2,0,0]=4 21388 B12R1.283 C=C(C)c1ccccc1CNC 271570a_100000694244_100000184654 [0,2,0,0,0,0|2,0,0]=4 21389 B12R1.283 C=C(C)c1ccccc1COC 271570a_100000694244_100011493684 [0,2,0,0,0,0|2,0,0]=4 21390 B12R1.283 C=C(C)c1ccccc1CSC 271570a_100000694244_100000148299 [0,2,0,0,0,0|2,0,0]=4 21391 B12R1.283 C=C(C)c1ccccc1NCC 271570a_100000694244_114873767003 [0,2,0,0,0,0|2,0,0]=4 21392 B12R1.283 C=C(C)c1ccccc1NCC 34a_100000037685_100000210202 [0,2,0,0,0,0|2,0,0]=4 21393 B12R1.283 C=C(C)c1ccccc1OCC 271570a_100000694244_100000230754 [0,2,0,0,0,0|2,0,0]=4 21394 B12R1.283 C=C(C)c1ccccc1SCC 271570a_100000694244_100000230856 [0,2,0,0,0,0|2,0,0]=4 21395 B12R1.283 CC(O)c1ccccc1OCF 34a_200011232679_100015361967 [0,2,0,0,0,0|2,0,0]=4 21396 B12R1.283 CC(O)c1ccccc1OCF 7a_200011232679_100015361967 [0,2,0,0,0,0|2,0,0]=4 21397 B12R1.283 CC(O)c1ccccc1SCF 62a_100000702211_100015361967 [0,2,0,0,0,0|2,0,0]=4 21398 B12R1.283 CC(O)c1ccccc1SCF 62a_100015361967_100000702211 [0,2,0,0,0,0|2,0,0]=4 21399 B12R1.283 CC=Cc1ccccc1B(O)O 271570a_100016259895_100000693059 [0,2,0,0,0,0|0,0,2]=4 21400 B12R1.283 CC=Cc1ccccc1C(C)O 271570a_100016259895_100000702211 [0,2,0,0,0,0|0,0,2]=4 21401 B12R1.283 CCNc1ccccc1C(=O)N 34a_100000185089_100000210202 [0,2,0,0,0,0|1,0,1]=4 21402 B12R1.283 CCNc1ccccc1C(C)C 2230a_100000210643_100000210202 [0,2,0,0,0,0|2,0,0]=4 21403 B12R1.283 CCNc1ccccc1C(C)C 34a_100000210643_100000210202 [0,2,0,0,0,0|2,0,0]=4 21404 B12R1.283 CCNc1ccccc1C(C)C 7a_100000210643_100000210202 [0,2,0,0,0,0|2,0,0]=4 21405 B12R1.283 CCNc1ccccc1C(C)O 2230a_100011405641_100000210202 [0,2,0,0,0,0|1,0,0]=3 21406 B12R1.283 CCNc1ccccc1C(F)F 2230a_100000734540_100000210202 [0,2,0,0,0,0|2,0,0]=4 21407 B12R1.283 CCNc1ccccc1C(F)F 34a_100000734540_100000210202 [0,2,0,0,0,0|2,0,0]=4 21408 B12R1.283 CCNc1ccccc1C(F)F 7a_100000734540_100000210202 [0,2,0,0,0,0|2,0,0]=4 21409 B12R1.283 CCOc1ccccc1C(=O)C 1458a_100000211144_200000210301 [0,2,0,0,0,0|1,0,1]=4 21410 B12R1.283 CCOc1ccccc1C(=O)N 34a_100000192804_100000210202 [0,2,0,0,0,0|1,0,1]=4 21411 B12R1.283 CCOc1ccccc1C(=O)N 7a_100000192804_100000210202 [0,2,0,0,0,0|1,0,1]=4 21412 B12R1.283 CCOc1ccccc1C(=O)[13CH3] 1458a_100000211144_200025704644 [0,2,0,0,0,0|1,0,1]=4 21413 B12R1.283 CCOc1ccccc1C(=O)[O-] 7a_100015234032_100000210202 [0,2,0,0,0,0|1,0,1]=4 21414 B12R1.283 CCOc1ccccc1C(=S)N 7a_100000745089_100000210202 [0,2,0,0,0,0|1,1,0]=4 21415 B12R1.283 CCOc1ccccc1C(C)C 34a_100000211617_100000210202 [0,2,0,0,0,0|2,0,0]=4 21416 B12R1.283 CCOc1ccccc1C(C)C 7a_100000211617_100000210202 [0,2,0,0,0,0|2,0,0]=4 21417 B12R1.283 CCOc1ccccc1C(C)O 34a_200011232679_100000210202 [0,2,0,0,0,0|1,0,0]=3 21418 B12R1.283 CCOc1ccccc1C(C)O 7a_200011232679_100000210202 [0,2,0,0,0,0|1,0,0]=3 21419 B12R1.283 CCOc1ccccc1[C@@H](C)N 34a_100025703389_100000210202 [0,2,0,0,0,0|2,0,0]=4 21420 B12R1.283 CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000210202 [0,2,0,0,0,0|1,0,1]=4 21421 B12R1.283 CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000210202 [0,2,0,0,0,0|1,0,1]=4 21422 B12R1.283 CCSc1ccccc1B(O)O 62a_100000210202_100000693059 [0,2,0,0,0,0|1,0,0]=3 21423 B12R1.283 CCSc1ccccc1B(O)O 62a_100000693059_100000210202 [0,2,0,0,0,0|1,0,0]=3 21424 B12R1.283 CCSc1ccccc1C(=O)C 1458a_100000195471_200000210301 [0,2,0,0,0,0|1,0,1]=4 21425 B12R1.283 CCSc1ccccc1C(=O)C 62a_100000751169_100000210202 [0,2,0,0,0,0|1,0,1]=4 21426 B12R1.283 CCSc1ccccc1C(=O)N 62a_100000162227_100000210202 [0,2,0,0,0,0|1,0,1]=4 21427 B12R1.283 CCSc1ccccc1C(=O)N 62a_100000210202_100000162227 [0,2,0,0,0,0|1,0,1]=4 21428 B12R1.283 CCSc1ccccc1C(=O)O 62a_100000210202_100000734275 [0,2,0,0,0,0|1,0,0]=3 21429 B12R1.283 CCSc1ccccc1C(=O)O 62a_202125556159_100000210202 [0,2,0,0,0,0|1,0,0]=3 21430 B12R1.283 CCSc1ccccc1C(=O)[13CH3] 1458a_100000195471_200025704644 [0,2,0,0,0,0|1,0,1]=4 21431 B12R1.283 CCSc1ccccc1C(C)C 62a_100000210202_100000708600 [0,2,0,0,0,0|2,0,0]=4 21432 B12R1.283 CCSc1ccccc1C(C)C 62a_100000708600_100000210202 [0,2,0,0,0,0|2,0,0]=4 21433 B12R1.283 CCSc1ccccc1C(C)N 62a_100000181357_100000210202 [0,2,0,0,0,0|2,0,0]=4 21434 B12R1.283 CCSc1ccccc1C(C)N 62a_100000210202_100000181357 [0,2,0,0,0,0|2,0,0]=4 21435 B12R1.283 CCSc1ccccc1C(C)O 62a_100000210202_100000702211 [0,2,0,0,0,0|1,0,0]=3 21436 B12R1.283 CCSc1ccccc1C(C)O 62a_100000702211_100000210202 [0,2,0,0,0,0|1,0,0]=3 21437 B12R1.283 CCSc1ccccc1C(F)F 62a_100000210202_100010169824 [0,2,0,0,0,0|2,0,0]=4 21438 B12R1.283 CCSc1ccccc1C(F)F 62a_100010169824_100000210202 [0,2,0,0,0,0|2,0,0]=4 21439 B12R1.283 CCSc1ccccc1N(C)C 62a_100000210202_100011290883 [0,2,0,0,0,0|2,0,0]=4 21440 B12R1.283 CCSc1ccccc1N(C)C 62a_100011290883_100000210202 [0,2,0,0,0,0|2,0,0]=4 21441 B12R1.283 CCSc1ccccc1S(=O)C 62a_100000734199_100000210202 [0,2,0,0,0,0|1,0,1]=4 21442 B12R1.283 CCSc1cccnc1[C@H](C)O 62a_100000210202_100013325542 [0,2,0,0,0,0|2,0,0]=4 21443 B12R1.283 CCSc1cccnc1[C@H](C)O 62a_100013325542_100000210202 [0,2,0,0,0,0|2,0,0]=4 21444 B12R1.283 CCSc1cnccc1B(O)O 62a_100000210202_200010176179 [0,2,0,0,0,0|2,0,0]=4 21445 B12R1.283 CCSc1cnccc1B(O)O 62a_200010176179_100000210202 [0,2,0,0,0,0|2,0,0]=4 21446 B12R1.283 CCSc1ncccc1B(O)O 62a_100000047247_100000210202 [0,2,0,0,0,0|2,0,0]=4 21447 B12R1.283 CCSc1ncccc1B(O)O 62a_100000210202_100000047247 [0,2,0,0,0,0|2,0,0]=4 21448 B12R1.283 CCSc1ncccc1C(C)O 62a_100000210202_100009865335 [0,2,0,0,0,0|2,0,0]=4 21449 B12R1.283 CCSc1ncccc1C(C)O 62a_100009865335_100000210202 [0,2,0,0,0,0|2,0,0]=4 21450 B12R1.283 CNCc1ccccc1B(O)O 2230a_106832991635_100009814197 [0,2,0,0,0,0|1,0,0]=3 21451 B12R1.283 CNCc1ccccc1B(O)O 34a_100102657272_100009814197 [0,2,0,0,0,0|1,0,0]=3 21452 B12R1.283 CNCc1ccccc1B(O)O 7a_106832991635_100009814197 [0,2,0,0,0,0|1,0,0]=3 21453 B12R1.283 CNCc1ccccc1C(=O)O 269956a_100015183376_200000210301 [0,2,0,0,0,0|1,0,0]=3 21454 B12R1.283 CNCc1ccccc1C(C)C 207a_100102657272_100011361515 [0,2,0,0,0,0|2,0,0]=4 21455 B12R1.283 CNCc1ccccc1C(C)C 26a_100102657272_100000211617 [0,2,0,0,0,0|2,0,0]=4 21456 B12R1.283 CNCc1ccccc1C(C)C 270004a_106832991635_100011361515 [0,2,0,0,0,0|2,0,0]=4 21457 B12R1.283 CNCc1ccccc1C(F)F 207a_100102657272_100009869017 [0,2,0,0,0,0|2,0,0]=4 21458 B12R1.283 CNCc1ccccc1C(F)F 270004a_106832991635_100009869017 [0,2,0,0,0,0|2,0,0]=4 21459 B12R1.283 CNCc1ccccc1N(C)C 207a_100102657272_100000750901 [0,2,0,0,0,0|2,0,0]=4 21460 B12R1.283 CNCc1ccccc1N(C)C 270004a_106832991635_100000750901 [0,2,0,0,0,0|2,0,0]=4 21461 B12R1.283 CNCc1ccccc1[N+](=O)[O-] 2230a_106832991635_100000181388 [0,2,0,0,0,0|1,0,1]=4 21462 B12R1.283 CNCc1ccccc1[N+](=O)[O-] 270004a_106832991635_100000186027 [0,2,0,0,0,0|1,0,1]=4 21463 B12R1.283 CNCc1ccccc1[N+](=O)[O-] 34a_100102657272_100000181388 [0,2,0,0,0,0|1,0,1]=4 21464 B12R1.283 CNCc1ccccc1[N+](=O)[O-] 7a_106832991635_100000181388 [0,2,0,0,0,0|1,0,1]=4 21465 B12R1.283 COCc1ccccc1B(O)O 34a_100138415774_100009814197 [0,2,0,0,0,0|1,0,0]=3 21466 B12R1.283 COCc1ccccc1C(=O)C 1458a_100000737999_200000210301 [0,2,0,0,0,0|1,0,1]=4 21467 B12R1.283 COCc1ccccc1C(=O)[13CH3] 1458a_100000737999_200025704644 [0,2,0,0,0,0|1,0,1]=4 21468 B12R1.283 COCc1ccccc1[N+](=O)[O-] 34a_100138415774_100000181388 [0,2,0,0,0,0|1,0,1]=4 21469 B12R1.283 COCc1ccccc1[N+](=O)[O-] 7a_100011218404_200000210301 [0,2,0,0,0,0|1,0,1]=4 21470 B12R1.283 CSCc1ccccc1B(O)O 62a_100009814197_200000210301 [0,2,0,0,0,0|1,0,0]=3 21471 B12R1.283 CSCc1ccccc1B(O)O 62a_200000210301_100009814197 [0,2,0,0,0,0|1,0,0]=3 21472 B12R1.283 CSCc1ccccc1[N+](=O)[O-] 62a_200000210301_100000181388 [0,2,0,0,0,0|1,0,1]=4 21473 B12R1.283 O=C(O)c1ccccc1SCF 62a_100015361967_100000734275 [0,2,0,0,0,0|2,0,0]=4 21474 B12R1.283 O=C(O)c1ccccc1SCF 62a_202125556159_100015361967 [0,2,0,0,0,0|2,0,0]=4 21475 B12R1.283 OB(O)c1ccccc1SCF 62a_100000693059_100015361967 [0,2,0,0,0,0|2,0,0]=4 21476 B12R1.283 OB(O)c1ccccc1SCF 62a_100015361967_100000693059 [0,2,0,0,0,0|2,0,0]=4 21477 B12R1.283 [13CH3]NCc1ccccc1C(=O)O 269956a_100015183376_200025704644 [0,2,0,0,0,0|1,0,0]=3 21478 B12R1.283 [13CH3]OCc1ccccc1[N+](=O)[O-] 7a_100011218404_200025704644 [0,2,0,0,0,0|1,0,1]=4 21479 B12R1.283 [13CH3]SCc1ccccc1B(O)O 62a_100009814197_200025704644 [0,2,0,0,0,0|1,0,0]=3 21480 B12R1.283 [13CH3]SCc1ccccc1B(O)O 62a_200025704644_100009814197 [0,2,0,0,0,0|1,0,0]=3 21481 B12R1.283 [13CH3]SCc1ccccc1[N+](=O)[O-] 62a_200025704644_100000181388 [0,2,0,0,0,0|1,0,1]=4 21482 B12R1.1112 C=Cc1cccc(c1CNC)F 271570a_100011290941_106744473292 [0,2,0,0,0,0|2,0,0]=4 21483 B12R1.1112 C=Cc1cccc(c1OCC)F 271570a_100011290941_100010232518 [0,2,0,0,0,0|2,0,0]=4 21484 B12R1.1112 CC=Cc1c(cccc1C#N)O 271570a_100016259895_100009818990 [0,2,0,0,0,0|0,0,2]=4 21485 B12R1.1112 CC=Cc1c(cccc1C=O)O 271570a_100016259895_100009816417 [0,2,0,0,0,0|0,0,2]=4 21486 B12R1.1112 CC=Cc1c(cccc1CO)Br 271570a_100016259895_100010146604 [0,2,0,0,0,0|0,0,2]=4 21487 B12R1.1112 CC=Cc1c(cccc1CO)C 271570a_100016259895_100011659289 [0,2,0,0,0,0|0,0,2]=4 21488 B12R1.1112 CC=Cc1c(cccc1CO)F 271570a_100016259895_100000692438 [0,2,0,0,0,0|0,0,2]=4 21489 B12R1.1112 CC=Cc1c(cccc1OC)Br 271570a_100016259895_100010131421 [0,2,0,0,0,0|0,0,2]=4 21490 B12R1.1112 CC=Cc1c(cccc1OC)F 271570a_100016259895_100000041735 [0,2,0,0,0,0|0,0,2]=4 21491 B12R1.1112 CC=Cc1c(cccc1OC)N 271570a_100016259895_100000703447 [0,2,0,0,0,0|0,0,2]=4 21492 B12R1.1112 CC=Cc1c(cccc1OC)O 271570a_100016259895_100010202623 [0,2,0,0,0,0|0,0,2]=4 21493 B12R1.1112 CCNc1c(cccc1C#N)C 2230a_100011826843_100000210202 [0,2,0,0,0,0|2,0,0]=4 21494 B12R1.1112 CCNc1c(cccc1C#N)F 2230a_100011219409_100000210202 [0,2,0,0,0,0|2,0,0]=4 21495 B12R1.1112 CCNc1c(cccc1C#N)F 34a_100011219409_100000210202 [0,2,0,0,0,0|2,0,0]=4 21496 B12R1.1112 CCNc1c(cccc1CC)C 2230a_100000210048_100000210202 [0,2,0,0,0,0|2,0,0]=4 21497 B12R1.1112 CCNc1c(cccc1CC)C 34a_100000210048_100000210202 [0,2,0,0,0,0|2,0,0]=4 21498 B12R1.1112 CCNc1c(cccc1CC)C 7a_100000210048_100000210202 [0,2,0,0,0,0|2,0,0]=4 21499 B12R1.1112 CCNc1c(cccc1CO)C 34a_100011215590_100000210202 [0,2,0,0,0,0|1,0,0]=3 21500 B12R1.1112 CCNc1c(cccc1CO)Cl 34a_100012182729_100000210202 [0,2,0,0,0,0|1,0,0]=3 21501 B12R1.1112 CCNc1c(cccc1CO)F 34a_100000692437_100000210202 [0,2,0,0,0,0|1,0,0]=3 21502 B12R1.1112 CCNc1c(cccc1OC)Br 34a_100000708083_100000210202 [0,2,0,0,0,0|1,0,0]=3 21503 B12R1.1112 CCNc1c(cccc1OC)C 2230a_100000758225_100000210202 [0,2,0,0,0,0|1,0,0]=3 21504 B12R1.1112 CCNc1c(cccc1OC)C 34a_100000758225_100000210202 [0,2,0,0,0,0|1,0,0]=3 21505 B12R1.1112 CCNc1c(cccc1OC)Cl 34a_100011309317_100000210202 [0,2,0,0,0,0|1,0,0]=3 21506 B12R1.1112 CCNc1c(cccc1OC)F 34a_100000686744_100000210202 [0,2,0,0,0,0|1,0,0]=3 21507 B12R1.1112 CCNc1c(cccc1OC)O 34a_100012022766_100000210202 [0,2,0,0,0,0|1,0,0]=3 21508 B12R1.1112 CCOc1c(cccc1C#N)Br 34a_100009817103_100000210202 [0,2,0,0,0,0|2,0,0]=4 21509 B12R1.1112 CCOc1c(cccc1C#N)C 34a_100011659161_100000210202 [0,2,0,0,0,0|2,0,0]=4 21510 B12R1.1112 CCOc1c(cccc1C#N)C 7a_100011659161_100000210202 [0,2,0,0,0,0|2,0,0]=4 21511 B12R1.1112 CCOc1c(cccc1C#N)Cl 34a_100009866432_100000210202 [0,2,0,0,0,0|2,0,0]=4 21512 B12R1.1112 CCOc1c(cccc1C#N)Cl 7a_100009866432_100000210202 [0,2,0,0,0,0|2,0,0]=4 21513 B12R1.1112 CCOc1c(cccc1C#N)F 34a_100000117915_100000210202 [0,2,0,0,0,0|2,0,0]=4 21514 B12R1.1112 CCOc1c(cccc1C#N)F 7a_100000117915_100000210202 [0,2,0,0,0,0|2,0,0]=4 21515 B12R1.1112 CCOc1c(cccc1CC)Br 34a_200010001580_100000210202 [0,2,0,0,0,0|2,0,0]=4 21516 B12R1.1112 CCOc1c(cccc1CC)Br 7a_200010001580_100000210202 [0,2,0,0,0,0|2,0,0]=4 21517 B12R1.1112 CCOc1c(cccc1CC)C 34a_100000034007_100000210202 [0,2,0,0,0,0|2,0,0]=4 21518 B12R1.1112 CCOc1c(cccc1CC)C 7a_100000034007_100000210202 [0,2,0,0,0,0|2,0,0]=4 21519 B12R1.1112 CCOc1c(cccc1CN)C 34a_100020639391_100000210202 [0,2,0,0,0,0|2,0,0]=4 21520 B12R1.1112 CCOc1c(cccc1CO)F 34a_100011997349_100000210202 [0,2,0,0,0,0|1,0,0]=3 21521 B12R1.1112 CCOc1c(cccc1CO)F 7a_100011997349_100000210202 [0,2,0,0,0,0|1,0,0]=3 21522 B12R1.1112 CCOc1c(cccc1NC)Cl 2230a_100000744310_200000210301 [0,2,0,0,0,0|2,0,0]=4 21523 B12R1.1112 CCOc1c(cccc1NC)Cl 34a_100000744310_200000210301 [0,2,0,0,0,0|2,0,0]=4 21524 B12R1.1112 CCOc1c(cccc1N[13CH3])Cl 2230a_100000744310_200025704644 [0,2,0,0,0,0|2,0,0]=4 21525 B12R1.1112 CCOc1c(cccc1N[13CH3])Cl 34a_100000744310_200025704644 [0,2,0,0,0,0|2,0,0]=4 21526 B12R1.1112 CCOc1c(cccc1OC)Br 34a_100000686866_100000210202 [0,2,0,0,0,0|1,0,0]=3 21527 B12R1.1112 CCOc1c(cccc1OC)C 34a_100011219253_100000210202 [0,2,0,0,0,0|1,0,0]=3 21528 B12R1.1112 CCOc1c(cccc1OC)C 7a_100011219253_100000210202 [0,2,0,0,0,0|1,0,0]=3 21529 B12R1.1112 CCOc1c(cccc1OC)Cl 34a_100009851661_100000210202 [0,2,0,0,0,0|1,0,0]=3 21530 B12R1.1112 CCOc1c(cccc1OC)Cl 7a_100009851661_100000210202 [0,2,0,0,0,0|1,0,0]=3 21531 B12R1.1112 CCOc1c(cccc1OC)F 34a_100000036725_100000210202 [0,2,0,0,0,0|1,0,0]=3 21532 B12R1.1112 CCOc1c(cccc1OC)F 7a_100000036725_100000210202 [0,2,0,0,0,0|1,0,0]=3 21533 B12R1.1112 CCOc1c(cccc1OC)N 34a_100000123586_100000210202 [0,2,0,0,0,0|1,0,0]=3 21534 B12R1.1112 CCOc1c(cccc1SC)F 62a_100010232518_200000210301 [0,2,0,0,0,0|1,1,0]=4 21535 B12R1.1112 CCOc1c(cccc1SC)F 62a_200000210301_100010232518 [0,2,0,0,0,0|1,1,0]=4 21536 B12R1.1112 CCOc1c(cccc1S[13CH3])F 62a_100010232518_200025704644 [0,2,0,0,0,0|1,1,0]=4 21537 B12R1.1112 CCOc1c(cccc1S[13CH3])F 62a_200025704644_100010232518 [0,2,0,0,0,0|1,1,0]=4 21538 B12R1.1112 CCSc1c(cccc1C#N)Br 62a_100000210202_100000703783 [0,2,0,0,0,0|2,0,0]=4 21539 B12R1.1112 CCSc1c(cccc1C#N)Br 62a_100000703783_100000210202 [0,2,0,0,0,0|2,0,0]=4 21540 B12R1.1112 CCSc1c(cccc1C#N)C 62a_100000210202_100011934862 [0,2,0,0,0,0|2,0,0]=4 21541 B12R1.1112 CCSc1c(cccc1C#N)Cl 62a_100000210202_100010134094 [0,2,0,0,0,0|2,0,0]=4 21542 B12R1.1112 CCSc1c(cccc1C#N)F 62a_100000210202_100011219237 [0,2,0,0,0,0|2,0,0]=4 21543 B12R1.1112 CCSc1c(cccc1C#N)N 62a_100000210202_100009877206 [0,2,0,0,0,0|2,0,0]=4 21544 B12R1.1112 CCSc1c(cccc1C#N)O 62a_100000210202_100009818990 [0,2,0,0,0,0|1,0,0]=3 21545 B12R1.1112 CCSc1c(cccc1C=O)C 62a_100000210202_100012186367 [0,2,0,0,0,0|1,0,1]=4 21546 B12R1.1112 CCSc1c(cccc1C=O)C 62a_100012186367_100000210202 [0,2,0,0,0,0|1,0,1]=4 21547 B12R1.1112 CCSc1c(cccc1C=O)F 62a_100000210202_100011934749 [0,2,0,0,0,0|1,0,1]=4 21548 B12R1.1112 CCSc1c(cccc1C=O)F 62a_100011934749_100000210202 [0,2,0,0,0,0|1,0,1]=4 21549 B12R1.1112 CCSc1c(cccc1C=O)O 62a_100000210202_100009816417 [0,2,0,0,0,0|1,0,0]=3 21550 B12R1.1112 CCSc1c(cccc1C=O)O 62a_100009816417_100000210202 [0,2,0,0,0,0|1,0,0]=3 21551 B12R1.1112 CCSc1c(cccc1CC)C 62a_100000036235_100000210202 [0,2,0,0,0,0|2,0,0]=4 21552 B12R1.1112 CCSc1c(cccc1CC)C 62a_100000210202_100000036235 [0,2,0,0,0,0|2,0,0]=4 21553 B12R1.1112 CCSc1c(cccc1CN)F 62a_100000210202_100020638964 [0,2,0,0,0,0|2,0,0]=4 21554 B12R1.1112 CCSc1c(cccc1CN)F 62a_100020638964_100000210202 [0,2,0,0,0,0|2,0,0]=4 21555 B12R1.1112 CCSc1c(cccc1CO)Br 62a_100000210202_100010146604 [0,2,0,0,0,0|1,0,0]=3 21556 B12R1.1112 CCSc1c(cccc1CO)Br 62a_100010146604_100000210202 [0,2,0,0,0,0|1,0,0]=3 21557 B12R1.1112 CCSc1c(cccc1CO)C 62a_100000210202_100011659289 [0,2,0,0,0,0|1,0,0]=3 21558 B12R1.1112 CCSc1c(cccc1CO)C 62a_100011659289_100000210202 [0,2,0,0,0,0|1,0,0]=3 21559 B12R1.1112 CCSc1c(cccc1CO)F 62a_100000210202_100012351117 [0,2,0,0,0,0|1,0,0]=3 21560 B12R1.1112 CCSc1c(cccc1CO)F 62a_100012351117_100000210202 [0,2,0,0,0,0|1,0,0]=3 21561 B12R1.1112 CCSc1c(cccc1OC)Br 62a_100000210202_100010131421 [0,2,0,0,0,0|1,0,0]=3 21562 B12R1.1112 CCSc1c(cccc1OC)Br 62a_100010131421_100000210202 [0,2,0,0,0,0|1,0,0]=3 21563 B12R1.1112 CCSc1c(cccc1OC)C 62a_100000210202_100010191535 [0,2,0,0,0,0|1,0,0]=3 21564 B12R1.1112 CCSc1c(cccc1OC)C 62a_100010191535_100000210202 [0,2,0,0,0,0|1,0,0]=3 21565 B12R1.1112 CCSc1c(cccc1OC)F 62a_100000210202_100000703912 [0,2,0,0,0,0|1,0,0]=3 21566 B12R1.1112 CCSc1c(cccc1OC)F 62a_100000703912_100000210202 [0,2,0,0,0,0|1,0,0]=3 21567 B12R1.1112 CCSc1c(cccc1OC)N 62a_100000210202_100000703447 [0,2,0,0,0,0|1,0,0]=3 21568 B12R1.1112 CCSc1c(cccc1OC)N 62a_100000703447_100000210202 [0,2,0,0,0,0|1,0,0]=3 21569 B12R1.1112 CCSc1c(cccc1OC)O 62a_100000210202_100010202623 [0,2,0,0,0,0|1,0,0]=3 21570 B12R1.1112 CCSc1c(ccnc1Cl)OC 62a_100000210202_100010154655 [0,2,0,0,0,0|2,0,0]=4 21571 B12R1.1112 CCSc1c(ccnc1Cl)OC 62a_100010154655_100000210202 [0,2,0,0,0,0|2,0,0]=4 21572 B12R1.1112 CCSc1c(ccnc1OC)C 62a_100000210202_100012353928 [0,2,0,0,0,0|2,0,0]=4 21573 B12R1.1112 CCSc1c(ccnc1OC)C 62a_100012353928_100000210202 [0,2,0,0,0,0|2,0,0]=4 21574 B12R1.1112 CCSc1c(ccnc1OC)N 62a_100000210202_100010243811 [0,2,0,0,0,0|2,0,0]=4 21575 B12R1.1112 CCSc1c(ccnc1OC)N 62a_100010243811_100000210202 [0,2,0,0,0,0|2,0,0]=4 21576 B12R1.1112 CCc1cccc(c1CNC)Br 26a_100102657272_200010001580 [0,2,0,0,0,0|2,0,0]=4 21577 B12R1.1112 CNCc1c(cccc1C#N)Br 2230a_106832991635_100010145454 [0,2,0,0,0,0|2,0,0]=4 21578 B12R1.1112 CNCc1c(cccc1C#N)Br 26a_100102657272_100009817103 [0,2,0,0,0,0|2,0,0]=4 21579 B12R1.1112 CNCc1c(cccc1C#N)Br 34a_100102657272_100010145454 [0,2,0,0,0,0|2,0,0]=4 21580 B12R1.1112 CNCc1c(cccc1C#N)Br 7a_106832991635_100010145454 [0,2,0,0,0,0|2,0,0]=4 21581 B12R1.1112 CNCc1c(cccc1C#N)Cl 2230a_106832991635_100010254528 [0,2,0,0,0,0|2,0,0]=4 21582 B12R1.1112 CNCc1c(cccc1C#N)Cl 34a_100102657272_100010254528 [0,2,0,0,0,0|2,0,0]=4 21583 B12R1.1112 CNCc1c(cccc1C#N)Cl 7a_106832991635_100010254528 [0,2,0,0,0,0|2,0,0]=4 21584 B12R1.1112 CNCc1c(cccc1C#N)F 2230a_106832991635_100010254529 [0,2,0,0,0,0|2,0,0]=4 21585 B12R1.1112 CNCc1c(cccc1C#N)F 34a_100102657272_100010254529 [0,2,0,0,0,0|2,0,0]=4 21586 B12R1.1112 CNCc1c(cccc1C#N)F 7a_106832991635_100010254529 [0,2,0,0,0,0|2,0,0]=4 21587 B12R1.1112 CNCc1c(cccc1C=O)F 2230a_106832991635_100010132767 [0,2,0,0,0,0|1,0,1]=4 21588 B12R1.1112 CNCc1c(cccc1C=O)F 34a_100102657272_100010132767 [0,2,0,0,0,0|1,0,1]=4 21589 B12R1.1112 CNCc1c(cccc1C=O)F 7a_106832991635_100010132767 [0,2,0,0,0,0|1,0,1]=4 21590 B12R1.1112 CNCc1c(cccc1OC)Br 207a_100102657272_100009814803 [0,2,0,0,0,0|1,0,0]=3 21591 B12R1.1112 CNCc1c(cccc1OC)Br 26a_100102657272_100000686866 [0,2,0,0,0,0|1,0,0]=3 21592 B12R1.1112 CNCc1c(cccc1OC)Br 270004a_106832991635_100009814803 [0,2,0,0,0,0|1,0,0]=3 21593 B12R1.1112 CNCc1c(cccc1OC)C 207a_100102657272_100000050978 [0,2,0,0,0,0|1,0,0]=3 21594 B12R1.1112 CNCc1c(cccc1OC)C 270004a_106832991635_100000050978 [0,2,0,0,0,0|1,0,0]=3 21595 B12R1.1112 CNCc1c(cccc1OC)Cl 207a_100102657272_100000757644 [0,2,0,0,0,0|1,0,0]=3 21596 B12R1.1112 CNCc1c(cccc1OC)Cl 2230a_106832991635_100012349678 [0,2,0,0,0,0|1,0,0]=3 21597 B12R1.1112 CNCc1c(cccc1OC)Cl 270004a_106832991635_100000757644 [0,2,0,0,0,0|1,0,0]=3 21598 B12R1.1112 CNCc1c(cccc1OC)Cl 34a_100102657272_100012349678 [0,2,0,0,0,0|1,0,0]=3 21599 B12R1.1112 CNCc1c(cccc1OC)Cl 7a_106832991635_100012349678 [0,2,0,0,0,0|1,0,0]=3 21600 B12R1.1112 CNCc1c(cccc1OC)F 207a_100102657272_100011216730 [0,2,0,0,0,0|1,0,0]=3 21601 B12R1.1112 CNCc1c(cccc1OC)F 2230a_106832991635_100011216731 [0,2,0,0,0,0|1,0,0]=3 21602 B12R1.1112 CNCc1c(cccc1OC)F 270004a_106832991635_100011216730 [0,2,0,0,0,0|1,0,0]=3 21603 B12R1.1112 CNCc1c(cccc1OC)F 34a_100016992011_200000210301 [0,2,0,0,0,0|1,0,0]=3 21604 B12R1.1112 CNCc1c(cccc1OC)F 34a_100102657272_100011216731 [0,2,0,0,0,0|1,0,0]=3 21605 B12R1.1112 CNCc1c(cccc1OC)F 7a_106832991635_100011216731 [0,2,0,0,0,0|1,0,0]=3 21606 B12R1.1112 CNCc1c(cccc1SC)F 62a_106744473292_200000210301 [0,2,0,0,0,0|1,1,0]=4 21607 B12R1.1112 CNCc1c(cccc1SC)F 62a_200000210301_106744473292 [0,2,0,0,0,0|1,1,0]=4 21608 B12R1.1112 CNCc1c(cccc1S[13CH3])F 62a_106744473292_200025704644 [0,2,0,0,0,0|1,1,0]=4 21609 B12R1.1112 CNCc1c(cccc1S[13CH3])F 62a_200025704644_106744473292 [0,2,0,0,0,0|1,1,0]=4 21610 B12R1.1112 CNCc1c(ccnc1OC)Cl 207a_100102657272_100009849443 [0,2,0,0,0,0|2,0,0]=4 21611 B12R1.1112 CNCc1c(ccnc1OC)Cl 270004a_106832991635_100009849443 [0,2,0,0,0,0|2,0,0]=4 21612 B12R1.1112 CNCc1c(ccnc1OC)I 207a_100102657272_100010160771 [0,2,0,0,0,0|2,0,0]=4 21613 B12R1.1112 COCc1c(cccc1C#N)Br 34a_100138415774_100010145454 [0,2,0,0,0,0|2,0,0]=4 21614 B12R1.1112 COCc1c(cccc1C#N)Cl 34a_100138415774_100010254528 [0,2,0,0,0,0|2,0,0]=4 21615 B12R1.1112 COCc1c(cccc1C#N)F 34a_100138415774_100010254529 [0,2,0,0,0,0|2,0,0]=4 21616 B12R1.1112 COCc1c(cccc1C=O)F 34a_100138415774_100010132767 [0,2,0,0,0,0|1,0,1]=4 21617 B12R1.1112 COCc1c(cccc1OC)Cl 34a_100138415774_100012349678 [0,2,0,0,0,0|1,0,0]=3 21618 B12R1.1112 COCc1c(cccc1OC)F 34a_100011216733_200000210301 [0,2,0,0,0,0|1,0,0]=3 21619 B12R1.1112 COCc1c(cccc1OC)F 34a_100138415774_100011216731 [0,2,0,0,0,0|1,0,0]=3 21620 B12R1.1112 COCc1c(cccc1OC)F 7a_100011216733_200000210301 [0,2,0,0,0,0|1,0,0]=3 21621 B12R1.1112 COc1cccc(c1CN[13CH3])F 34a_100016992011_200025704644 [0,2,0,0,0,0|1,0,0]=3 21622 B12R1.1112 COc1cccc(c1CO[13CH3])F 34a_100011216733_200025704644 [0,2,0,0,0,0|1,0,0]=3 21623 B12R1.1112 COc1cccc(c1CO[13CH3])F 7a_100011216733_200025704644 [0,2,0,0,0,0|1,0,0]=3 21624 B12R1.1112 COc1cccc(c1CSC)Cl 62a_100012349678_200000210301 [0,2,0,0,0,0|1,0,0]=3 21625 B12R1.1112 COc1cccc(c1CSC)Cl 62a_200000210301_100012349678 [0,2,0,0,0,0|1,0,0]=3 21626 B12R1.1112 COc1cccc(c1CSC)F 62a_100011216731_200000210301 [0,2,0,0,0,0|1,0,0]=3 21627 B12R1.1112 COc1cccc(c1CSC)F 62a_200000210301_100011216731 [0,2,0,0,0,0|1,0,0]=3 21628 B12R1.1112 COc1cccc(c1CS[13CH3])Cl 62a_100012349678_200025704644 [0,2,0,0,0,0|1,0,0]=3 21629 B12R1.1112 COc1cccc(c1CS[13CH3])Cl 62a_200025704644_100012349678 [0,2,0,0,0,0|1,0,0]=3 21630 B12R1.1112 COc1cccc(c1CS[13CH3])F 62a_100011216731_200025704644 [0,2,0,0,0,0|1,0,0]=3 21631 B12R1.1112 COc1cccc(c1CS[13CH3])F 62a_200025704644_100011216731 [0,2,0,0,0,0|1,0,0]=3 21632 B12R1.1112 COc1cccc(c1NCF)Br 34a_100000708083_100015361967 [0,2,0,0,0,0|2,0,0]=4 21633 B12R1.1112 COc1cccc(c1NCF)C 34a_100000758225_100015361967 [0,2,0,0,0,0|2,0,0]=4 21634 B12R1.1112 COc1cccc(c1NCF)Cl 34a_100011309317_100015361967 [0,2,0,0,0,0|2,0,0]=4 21635 B12R1.1112 COc1cccc(c1NCF)F 34a_100000686744_100015361967 [0,2,0,0,0,0|2,0,0]=4 21636 B12R1.1112 COc1cccc(c1NCF)O 34a_100012022766_100015361967 [0,2,0,0,0,0|2,0,0]=4 21637 B12R1.1112 COc1cccc(c1OCF)Br 34a_100000686866_100015361967 [0,2,0,0,0,0|2,0,0]=4 21638 B12R1.1112 COc1cccc(c1OCF)C 34a_100011219253_100015361967 [0,2,0,0,0,0|2,0,0]=4 21639 B12R1.1112 COc1cccc(c1OCF)C 7a_100011219253_100015361967 [0,2,0,0,0,0|2,0,0]=4 21640 B12R1.1112 COc1cccc(c1OCF)Cl 34a_100009851661_100015361967 [0,2,0,0,0,0|2,0,0]=4 21641 B12R1.1112 COc1cccc(c1OCF)Cl 7a_100009851661_100015361967 [0,2,0,0,0,0|2,0,0]=4 21642 B12R1.1112 COc1cccc(c1OCF)F 34a_100000036725_100015361967 [0,2,0,0,0,0|2,0,0]=4 21643 B12R1.1112 COc1cccc(c1OCF)F 7a_100000036725_100015361967 [0,2,0,0,0,0|2,0,0]=4 21644 B12R1.1112 COc1cccc(c1OCF)N 34a_100000123586_100015361967 [0,2,0,0,0,0|2,0,0]=4 21645 B12R1.1112 COc1cccc(c1SCF)Br 62a_100010131421_100015361967 [0,2,0,0,0,0|2,0,0]=4 21646 B12R1.1112 COc1cccc(c1SCF)Br 62a_100015361967_100010131421 [0,2,0,0,0,0|2,0,0]=4 21647 B12R1.1112 COc1cccc(c1SCF)C 62a_100010191535_100015361967 [0,2,0,0,0,0|2,0,0]=4 21648 B12R1.1112 COc1cccc(c1SCF)C 62a_100015361967_100010191535 [0,2,0,0,0,0|2,0,0]=4 21649 B12R1.1112 COc1cccc(c1SCF)F 62a_100000703912_100015361967 [0,2,0,0,0,0|2,0,0]=4 21650 B12R1.1112 COc1cccc(c1SCF)F 62a_100015361967_100000703912 [0,2,0,0,0,0|2,0,0]=4 21651 B12R1.1112 COc1cccc(c1SCF)N 62a_100000703447_100015361967 [0,2,0,0,0,0|2,0,0]=4 21652 B12R1.1112 COc1cccc(c1SCF)N 62a_100015361967_100000703447 [0,2,0,0,0,0|2,0,0]=4 21653 B12R1.1112 COc1cccc(c1SCF)O 62a_100015361967_100010202623 [0,2,0,0,0,0|2,0,0]=4 21654 B12R1.1112 CSCc1c(cccc1C#N)Br 62a_100010145454_200000210301 [0,2,0,0,0,0|2,0,0]=4 21655 B12R1.1112 CSCc1c(cccc1C#N)Br 62a_200000210301_100010145454 [0,2,0,0,0,0|2,0,0]=4 21656 B12R1.1112 CSCc1c(cccc1C#N)Cl 62a_200000210301_100010254528 [0,2,0,0,0,0|2,0,0]=4 21657 B12R1.1112 CSCc1c(cccc1C#N)F 62a_200000210301_100010254529 [0,2,0,0,0,0|2,0,0]=4 21658 B12R1.1112 CSCc1c(cccc1C=O)F 62a_100010132767_200000210301 [0,2,0,0,0,0|1,0,1]=4 21659 B12R1.1112 CSCc1c(cccc1C=O)F 62a_200000210301_100010132767 [0,2,0,0,0,0|1,0,1]=4 21660 B12R1.1112 Cc1cccc(c1NCF)CO 34a_100011215590_100015361967 [0,2,0,0,0,0|2,0,0]=4 21661 B12R1.1112 Cc1cccc(c1SCF)CO 62a_100011659289_100015361967 [0,2,0,0,0,0|2,0,0]=4 21662 B12R1.1112 Cc1cccc(c1SCF)CO 62a_100015361967_100011659289 [0,2,0,0,0,0|2,0,0]=4 21663 B12R1.1112 N#Cc1cccc(c1SCF)O 62a_100015361967_100009818990 [0,2,0,0,0,0|2,0,0]=4 21664 B12R1.1112 O=Cc1cccc(c1SCF)O 62a_100009816417_100015361967 [0,2,0,0,0,0|2,0,0]=4 21665 B12R1.1112 O=Cc1cccc(c1SCF)O 62a_100015361967_100009816417 [0,2,0,0,0,0|2,0,0]=4 21666 B12R1.1112 OCc1cccc(c1NCF)Cl 34a_100012182729_100015361967 [0,2,0,0,0,0|2,0,0]=4 21667 B12R1.1112 OCc1cccc(c1NCF)F 34a_100000692437_100015361967 [0,2,0,0,0,0|2,0,0]=4 21668 B12R1.1112 OCc1cccc(c1OCF)F 34a_100011997349_100015361967 [0,2,0,0,0,0|2,0,0]=4 21669 B12R1.1112 OCc1cccc(c1OCF)F 7a_100011997349_100015361967 [0,2,0,0,0,0|2,0,0]=4 21670 B12R1.1112 OCc1cccc(c1SCF)Br 62a_100010146604_100015361967 [0,2,0,0,0,0|2,0,0]=4 21671 B12R1.1112 OCc1cccc(c1SCF)Br 62a_100015361967_100010146604 [0,2,0,0,0,0|2,0,0]=4 21672 B12R1.1112 OCc1cccc(c1SCF)F 62a_100012351117_100015361967 [0,2,0,0,0,0|2,0,0]=4 21673 B12R1.1112 OCc1cccc(c1SCF)F 62a_100015361967_100012351117 [0,2,0,0,0,0|2,0,0]=4 21674 B12R1.1112 [13CH3]SCc1c(cccc1C#N)Br 62a_100010145454_200025704644 [0,2,0,0,0,0|2,0,0]=4 21675 B12R1.1112 [13CH3]SCc1c(cccc1C#N)Br 62a_200025704644_100010145454 [0,2,0,0,0,0|2,0,0]=4 21676 B12R1.1112 [13CH3]SCc1c(cccc1C#N)Cl 62a_200025704644_100010254528 [0,2,0,0,0,0|2,0,0]=4 21677 B12R1.1112 [13CH3]SCc1c(cccc1C#N)F 62a_200025704644_100010254529 [0,2,0,0,0,0|2,0,0]=4 21678 B12R1.1112 [13CH3]SCc1c(cccc1C=O)F 62a_100010132767_200025704644 [0,2,0,0,0,0|1,0,1]=4 21679 B12R1.1112 [13CH3]SCc1c(cccc1C=O)F 62a_200025704644_100010132767 [0,2,0,0,0,0|1,0,1]=4 21680 B12R1.114 C=Cc1ccc(c(c1)C)OCC 271570a_100011290941_100011308936 [0,2,0,0,0,0|2,0,0]=4 21681 B12R1.114 C=Cc1ccc(c(c1)F)CCO 271570a_100011290941_100011962869 [0,2,0,0,0,0|2,0,0]=4 21682 B12R1.114 C=Cc1ccc(c(c1)F)OCC 271570a_100011290941_200000171753 [0,2,0,0,0,0|2,0,0]=4 21683 B12R1.114 C=Cc1ccc(c(c1)N)COC 271570a_100011290941_100013084866 [0,2,0,0,0,0|2,0,0]=4 21684 B12R1.114 C=Cc1ccc(c(c1)N)OCC 271570a_100011290941_100000751366 [0,2,0,0,0,0|2,0,0]=4 21685 B12R1.114 CC=Cc1ccc(cc1O)C#N 271570a_100016259895_100000724445 [0,2,0,0,0,0|0,0,2]=4 21686 B12R1.114 CC=Cc1ccc(cc1O)C=O 271570a_100016259895_100000041418 [0,2,0,0,0,0|0,0,2]=4 21687 B12R1.114 CC=Cc1ccc(cc1O)CO 271570a_100016259895_100000049605 [0,2,0,0,0,0|0,0,2]=4 21688 B12R1.114 CC=Cc1ccc(cc1O)OC 271570a_100016259895_100000719091 [0,2,0,0,0,0|0,0,2]=4 21689 B12R1.114 CCNc1ccc(cc1Br)C#N 34a_100000736769_100000210202 [0,2,0,0,0,0|2,0,0]=4 21690 B12R1.114 CCNc1ccc(cc1Br)C#N 7a_100000736769_100000210202 [0,2,0,0,0,0|2,0,0]=4 21691 B12R1.114 CCNc1ccc(cc1Br)CC 2230a_100012339725_100000210202 [0,2,0,0,0,0|2,0,0]=4 21692 B12R1.114 CCNc1ccc(cc1Br)CC 34a_100012339725_100000210202 [0,2,0,0,0,0|2,0,0]=4 21693 B12R1.114 CCNc1ccc(cc1Br)OC 34a_100015195136_100000210202 [0,2,0,0,0,0|2,0,0]=4 21694 B12R1.114 CCNc1ccc(cc1C)C#N 34a_100011216260_100000210202 [0,2,0,0,0,0|2,0,0]=4 21695 B12R1.114 CCNc1ccc(cc1C)C#N 7a_100011216260_100000210202 [0,2,0,0,0,0|2,0,0]=4 21696 B12R1.114 CCNc1ccc(cc1C)CC 2230a_100011226020_100000210202 [0,2,0,0,0,0|2,0,0]=4 21697 B12R1.114 CCNc1ccc(cc1C)CC 34a_100011226020_100000210202 [0,2,0,0,0,0|2,0,0]=4 21698 B12R1.114 CCNc1ccc(cc1C)CC 7a_100011226020_100000210202 [0,2,0,0,0,0|2,0,0]=4 21699 B12R1.114 CCNc1ccc(cc1C)CO 2230a_200011997030_100000210202 [0,2,0,0,0,0|2,0,0]=4 21700 B12R1.114 CCNc1ccc(cc1C)CO 34a_200011997030_100000210202 [0,2,0,0,0,0|2,0,0]=4 21701 B12R1.114 CCNc1ccc(cc1C)OC 34a_100000750285_100000210202 [0,2,0,0,0,0|2,0,0]=4 21702 B12R1.114 CCNc1ccc(cc1Cl)C#N 34a_100000690208_100000210202 [0,2,0,0,0,0|2,0,0]=4 21703 B12R1.114 CCNc1ccc(cc1Cl)C#N 7a_100000690208_100000210202 [0,2,0,0,0,0|2,0,0]=4 21704 B12R1.114 CCNc1ccc(cc1Cl)OC 34a_100000747055_100000210202 [0,2,0,0,0,0|2,0,0]=4 21705 B12R1.114 CCNc1ccc(cc1F)C#N 34a_100000760432_100000210202 [0,2,0,0,0,0|2,0,0]=4 21706 B12R1.114 CCNc1ccc(cc1F)C#N 7a_100000760432_100000210202 [0,2,0,0,0,0|2,0,0]=4 21707 B12R1.114 CCNc1ccc(cc1F)CC 2230a_100016177294_100000210202 [0,2,0,0,0,0|2,0,0]=4 21708 B12R1.114 CCNc1ccc(cc1F)CC 34a_100016177294_100000210202 [0,2,0,0,0,0|2,0,0]=4 21709 B12R1.114 CCNc1ccc(cc1F)CO 2230a_100011217239_100000210202 [0,2,0,0,0,0|2,0,0]=4 21710 B12R1.114 CCNc1ccc(cc1F)CO 34a_100011217239_100000210202 [0,2,0,0,0,0|2,0,0]=4 21711 B12R1.114 CCNc1ccc(cc1F)OC 34a_100011299463_100000210202 [0,2,0,0,0,0|2,0,0]=4 21712 B12R1.114 CCNc1ccc(cc1F)SC 34a_100012056844_100000210202 [0,2,0,0,0,0|2,0,0]=4 21713 B12R1.114 CCNc1ccc(cc1I)C#N 7a_100000067503_100000210202 [0,2,0,0,0,0|2,0,0]=4 21714 B12R1.114 CCNc1ccc(cc1I)OC 34a_100000049804_100000210202 [0,2,0,0,0,0|2,0,0]=4 21715 B12R1.114 CCNc1ccc(cc1O)C#N 34a_100011997735_100000210202 [0,2,0,0,0,0|1,0,0]=3 21716 B12R1.114 CCNc1ccc(cc1O)CC 34a_100000124328_100000210202 [0,2,0,0,0,0|1,0,0]=3 21717 B12R1.114 CCNc1ccc(cc1O)OC 34a_100016989039_100000210202 [0,2,0,0,0,0|1,0,0]=3 21718 B12R1.114 CCOc1ccc(cc1Br)C#N 34a_100011216086_100000210202 [0,2,0,0,0,0|2,0,0]=4 21719 B12R1.114 CCOc1ccc(cc1Br)C#N 7a_100011216086_100000210202 [0,2,0,0,0,0|2,0,0]=4 21720 B12R1.114 CCOc1ccc(cc1Br)CC 34a_100012339963_100000210202 [0,2,0,0,0,0|2,0,0]=4 21721 B12R1.114 CCOc1ccc(cc1Br)CC 7a_100012339963_100000210202 [0,2,0,0,0,0|2,0,0]=4 21722 B12R1.114 CCOc1ccc(cc1Br)CO 34a_100011191544_100000210202 [0,2,0,0,0,0|2,0,0]=4 21723 B12R1.114 CCOc1ccc(cc1Br)CO 7a_100011191544_100000210202 [0,2,0,0,0,0|2,0,0]=4 21724 B12R1.114 CCOc1ccc(cc1Br)OC 34a_100000685887_100000210202 [0,2,0,0,0,0|2,0,0]=4 21725 B12R1.114 CCOc1ccc(cc1Br)OC 7a_100000685887_100000210202 [0,2,0,0,0,0|2,0,0]=4 21726 B12R1.114 CCOc1ccc(cc1C)C#N 34a_100000749339_100000210202 [0,2,0,0,0,0|2,0,0]=4 21727 B12R1.114 CCOc1ccc(cc1C)C#N 7a_100000749339_100000210202 [0,2,0,0,0,0|2,0,0]=4 21728 B12R1.114 CCOc1ccc(cc1C)CO 34a_100000075815_100000210202 [0,2,0,0,0,0|2,0,0]=4 21729 B12R1.114 CCOc1ccc(cc1C)CO 7a_100000075815_100000210202 [0,2,0,0,0,0|2,0,0]=4 21730 B12R1.114 CCOc1ccc(cc1C)OC 34a_100012002223_100000210202 [0,2,0,0,0,0|2,0,0]=4 21731 B12R1.114 CCOc1ccc(cc1C)OC 7a_100012002223_100000210202 [0,2,0,0,0,0|2,0,0]=4 21732 B12R1.114 CCOc1ccc(cc1C)SC 62a_100011308936_200000210301 [0,2,0,0,0,0|2,0,0]=4 21733 B12R1.114 CCOc1ccc(cc1C)SC 62a_200000210301_100011308936 [0,2,0,0,0,0|2,0,0]=4 21734 B12R1.114 CCOc1ccc(cc1C)S[13CH3] 62a_100011308936_200025704644 [0,2,0,0,0,0|2,0,0]=4 21735 B12R1.114 CCOc1ccc(cc1C)S[13CH3] 62a_200025704644_100011308936 [0,2,0,0,0,0|2,0,0]=4 21736 B12R1.114 CCOc1ccc(cc1Cl)C#N 34a_100000205955_100000210202 [0,2,0,0,0,0|2,0,0]=4 21737 B12R1.114 CCOc1ccc(cc1Cl)C#N 7a_100000205955_100000210202 [0,2,0,0,0,0|2,0,0]=4 21738 B12R1.114 CCOc1ccc(cc1Cl)NC 2230a_100000741444_200000210301 [0,2,0,0,0,0|2,0,0]=4 21739 B12R1.114 CCOc1ccc(cc1Cl)NC 34a_100000741444_200000210301 [0,2,0,0,0,0|2,0,0]=4 21740 B12R1.114 CCOc1ccc(cc1Cl)NC 7a_100000741444_200000210301 [0,2,0,0,0,0|2,0,0]=4 21741 B12R1.114 CCOc1ccc(cc1Cl)N[13CH3] 2230a_100000741444_200025704644 [0,2,0,0,0,0|2,0,0]=4 21742 B12R1.114 CCOc1ccc(cc1Cl)N[13CH3] 34a_100000741444_200025704644 [0,2,0,0,0,0|2,0,0]=4 21743 B12R1.114 CCOc1ccc(cc1Cl)N[13CH3] 7a_100000741444_200025704644 [0,2,0,0,0,0|2,0,0]=4 21744 B12R1.114 CCOc1ccc(cc1Cl)OC 34a_100000038596_100000210202 [0,2,0,0,0,0|2,0,0]=4 21745 B12R1.114 CCOc1ccc(cc1Cl)OC 7a_100000038596_100000210202 [0,2,0,0,0,0|2,0,0]=4 21746 B12R1.114 CCOc1ccc(cc1F)C#N 34a_100000751310_100000210202 [0,2,0,0,0,0|2,0,0]=4 21747 B12R1.114 CCOc1ccc(cc1F)C#N 7a_100000751310_100000210202 [0,2,0,0,0,0|2,0,0]=4 21748 B12R1.114 CCOc1ccc(cc1F)CN 34a_100000758358_100000210202 [0,2,0,0,0,0|2,0,0]=4 21749 B12R1.114 CCOc1ccc(cc1F)OC 34a_100000036999_100000210202 [0,2,0,0,0,0|2,0,0]=4 21750 B12R1.114 CCOc1ccc(cc1F)OC 34a_100012771078_200000210301 [0,2,0,0,0,0|2,0,0]=4 21751 B12R1.114 CCOc1ccc(cc1F)OC 7a_100000036999_100000210202 [0,2,0,0,0,0|2,0,0]=4 21752 B12R1.114 CCOc1ccc(cc1F)OC 7a_100012771078_200000210301 [0,2,0,0,0,0|2,0,0]=4 21753 B12R1.114 CCOc1ccc(cc1F)O[13CH3] 34a_100012771078_200025704644 [0,2,0,0,0,0|2,0,0]=4 21754 B12R1.114 CCOc1ccc(cc1F)O[13CH3] 7a_100012771078_200025704644 [0,2,0,0,0,0|2,0,0]=4 21755 B12R1.114 CCOc1ccc(cc1F)SC 62a_200000171753_200000210301 [0,2,0,0,0,0|2,0,0]=4 21756 B12R1.114 CCOc1ccc(cc1F)SC 62a_200000210301_200000171753 [0,2,0,0,0,0|2,0,0]=4 21757 B12R1.114 CCOc1ccc(cc1F)S[13CH3] 62a_200000171753_200025704644 [0,2,0,0,0,0|2,0,0]=4 21758 B12R1.114 CCOc1ccc(cc1F)S[13CH3] 62a_200025704644_200000171753 [0,2,0,0,0,0|2,0,0]=4 21759 B12R1.114 CCOc1ccc(cc1I)C#N 34a_100000725478_100000210202 [0,2,0,0,0,0|2,0,0]=4 21760 B12R1.114 CCOc1ccc(cc1I)C#N 7a_100000725478_100000210202 [0,2,0,0,0,0|2,0,0]=4 21761 B12R1.114 CCOc1ccc(cc1N)C#N 34a_100000766272_100000210202 [0,2,0,0,0,0|2,0,0]=4 21762 B12R1.114 CCOc1ccc(cc1N)C#N 7a_100000766272_100000210202 [0,2,0,0,0,0|2,0,0]=4 21763 B12R1.114 CCOc1ccc(cc1N)CC 34a_100000765835_100000210202 [0,2,0,0,0,0|2,0,0]=4 21764 B12R1.114 CCOc1ccc(cc1N)CC 7a_100000765835_100000210202 [0,2,0,0,0,0|2,0,0]=4 21765 B12R1.114 CCOc1ccc(cc1N)CO 34a_100000123545_100000210202 [0,2,0,0,0,0|2,0,0]=4 21766 B12R1.114 CCOc1ccc(cc1N)OC 34a_100000188146_100000210202 [0,2,0,0,0,0|2,0,0]=4 21767 B12R1.114 CCOc1ccc(cc1N)SC 62a_100000751366_200000210301 [0,2,0,0,0,0|2,0,0]=4 21768 B12R1.114 CCOc1ccc(cc1N)S[13CH3] 62a_100000751366_200025704644 [0,2,0,0,0,0|2,0,0]=4 21769 B12R1.114 CCOc1ccc(cc1O)C#N 271570a_203496583355_100000189309 [0,2,0,0,0,0|1,0,0]=3 21770 B12R1.114 CCOc1ccc(cc1O)C=O 271570a_203496583355_100000173028 [0,2,0,0,0,0|1,0,0]=3 21771 B12R1.114 CCOc1ccc(cc1O)CO 271570a_203496583355_200011800839 [0,2,0,0,0,0|1,0,0]=3 21772 B12R1.114 CCSc1ccc(cc1Br)C#N 62a_100000210202_100012356348 [0,2,0,0,0,0|2,0,0]=4 21773 B12R1.114 CCSc1ccc(cc1Br)CC 62a_100000210202_200009997437 [0,2,0,0,0,0|2,0,0]=4 21774 B12R1.114 CCSc1ccc(cc1Br)CC 62a_200009997437_100000210202 [0,2,0,0,0,0|2,0,0]=4 21775 B12R1.114 CCSc1ccc(cc1Br)OC 62a_100000210202_100012349170 [0,2,0,0,0,0|2,0,0]=4 21776 B12R1.114 CCSc1ccc(cc1Br)OC 62a_100012349170_100000210202 [0,2,0,0,0,0|2,0,0]=4 21777 B12R1.114 CCSc1ccc(cc1C)C#N 62a_100000210202_100000212329 [0,2,0,0,0,0|2,0,0]=4 21778 B12R1.114 CCSc1ccc(cc1C)C=O 62a_100000210202_100000765772 [0,2,0,0,0,0|2,0,0]=4 21779 B12R1.114 CCSc1ccc(cc1C)C=O 62a_100000765772_100000210202 [0,2,0,0,0,0|2,0,0]=4 21780 B12R1.114 CCSc1ccc(cc1C)CN 62a_100000210202_100015205234 [0,2,0,0,0,0|2,0,0]=4 21781 B12R1.114 CCSc1ccc(cc1C)CN 62a_100015205234_100000210202 [0,2,0,0,0,0|2,0,0]=4 21782 B12R1.114 CCSc1ccc(cc1C)CO 62a_100000210202_100000718852 [0,2,0,0,0,0|2,0,0]=4 21783 B12R1.114 CCSc1ccc(cc1C)CO 62a_100000718852_100000210202 [0,2,0,0,0,0|2,0,0]=4 21784 B12R1.114 CCSc1ccc(cc1C)NC 62a_100000210202_100102888905 [0,2,0,0,0,0|2,0,0]=4 21785 B12R1.114 CCSc1ccc(cc1C)NC 62a_100102888905_100000210202 [0,2,0,0,0,0|2,0,0]=4 21786 B12R1.114 CCSc1ccc(cc1C)NN 62a_100000210202_100000745493 [0,2,0,0,0,0|2,0,0]=4 21787 B12R1.114 CCSc1ccc(cc1C)NN 62a_100000745493_100000210202 [0,2,0,0,0,0|2,0,0]=4 21788 B12R1.114 CCSc1ccc(cc1C)OC 62a_100000210202_100000759875 [0,2,0,0,0,0|2,0,0]=4 21789 B12R1.114 CCSc1ccc(cc1C)OC 62a_100000759875_100000210202 [0,2,0,0,0,0|2,0,0]=4 21790 B12R1.114 CCSc1ccc(cc1Cl)C#N 62a_100000210202_100012349663 [0,2,0,0,0,0|2,0,0]=4 21791 B12R1.114 CCSc1ccc(cc1Cl)CO 62a_100000210202_100000718186 [0,2,0,0,0,0|2,0,0]=4 21792 B12R1.114 CCSc1ccc(cc1Cl)CO 62a_100000718186_100000210202 [0,2,0,0,0,0|2,0,0]=4 21793 B12R1.114 CCSc1ccc(cc1F)C#N 62a_100000210202_100000050172 [0,2,0,0,0,0|2,0,0]=4 21794 B12R1.114 CCSc1ccc(cc1F)C=O 62a_100000210202_100000686674 [0,2,0,0,0,0|2,0,0]=4 21795 B12R1.114 CCSc1ccc(cc1F)C=O 62a_100000686674_100000210202 [0,2,0,0,0,0|2,0,0]=4 21796 B12R1.114 CCSc1ccc(cc1F)CC 62a_100000210202_200010339503 [0,2,0,0,0,0|2,0,0]=4 21797 B12R1.114 CCSc1ccc(cc1F)CC 62a_200010339503_100000210202 [0,2,0,0,0,0|2,0,0]=4 21798 B12R1.114 CCSc1ccc(cc1F)CN 62a_100000210202_100000755036 [0,2,0,0,0,0|2,0,0]=4 21799 B12R1.114 CCSc1ccc(cc1F)CN 62a_100000755036_100000210202 [0,2,0,0,0,0|2,0,0]=4 21800 B12R1.114 CCSc1ccc(cc1F)CO 62a_100000210202_100011533735 [0,2,0,0,0,0|2,0,0]=4 21801 B12R1.114 CCSc1ccc(cc1F)CO 62a_100011533735_100000210202 [0,2,0,0,0,0|2,0,0]=4 21802 B12R1.114 CCSc1ccc(cc1F)NC 62a_100000210202_100012285320 [0,2,0,0,0,0|2,0,0]=4 21803 B12R1.114 CCSc1ccc(cc1F)NC 62a_100012285320_100000210202 [0,2,0,0,0,0|2,0,0]=4 21804 B12R1.114 CCSc1ccc(cc1F)NN 62a_100000210202_100016992936 [0,2,0,0,0,0|2,0,0]=4 21805 B12R1.114 CCSc1ccc(cc1F)NN 62a_100016992936_100000210202 [0,2,0,0,0,0|2,0,0]=4 21806 B12R1.114 CCSc1ccc(cc1F)OC 62a_100000210202_100000753793 [0,2,0,0,0,0|2,0,0]=4 21807 B12R1.114 CCSc1ccc(cc1F)OC 62a_100000753793_100000210202 [0,2,0,0,0,0|2,0,0]=4 21808 B12R1.114 CCSc1ccc(cc1F)SC 62a_100000210202_100009816902 [0,2,0,0,0,0|2,0,0]=4 21809 B12R1.114 CCSc1ccc(cc1F)SC 62a_100009816902_100000210202 [0,2,0,0,0,0|2,0,0]=4 21810 B12R1.114 CCSc1ccc(cc1N)C#N 62a_100000210202_100012001879 [0,2,0,0,0,0|2,0,0]=4 21811 B12R1.114 CCSc1ccc(cc1N)CO 62a_100000210202_100012347568 [0,2,0,0,0,0|2,0,0]=4 21812 B12R1.114 CCSc1ccc(cc1N)CO 62a_100012347568_100000210202 [0,2,0,0,0,0|2,0,0]=4 21813 B12R1.114 CCSc1ccc(cc1N)OC 62a_100000210202_100000748021 [0,2,0,0,0,0|2,0,0]=4 21814 B12R1.114 CCSc1ccc(cc1N)OC 62a_100000748021_100000210202 [0,2,0,0,0,0|2,0,0]=4 21815 B12R1.114 CCSc1ccc(cc1O)C#N 62a_100000210202_100009877741 [0,2,0,0,0,0|1,0,0]=3 21816 B12R1.114 CCSc1ccc(cc1O)C=O 62a_100000041418_100000210202 [0,2,0,0,0,0|1,0,0]=3 21817 B12R1.114 CCSc1ccc(cc1O)C=O 62a_100000210202_100000041418 [0,2,0,0,0,0|1,0,0]=3 21818 B12R1.114 CCSc1ccc(cc1O)CO 62a_100000049605_100000210202 [0,2,0,0,0,0|1,0,0]=3 21819 B12R1.114 CCSc1ccc(cc1O)CO 62a_100000210202_100000049605 [0,2,0,0,0,0|1,0,0]=3 21820 B12R1.114 CCSc1ccc(cc1O)OC 62a_100000210202_100000719091 [0,2,0,0,0,0|1,0,0]=3 21821 B12R1.114 CCSc1ccc(nc1O)C#N 62a_100000210202_200011068624 [0,2,0,0,0,0|2,0,0]=4 21822 B12R1.114 CCSc1cnc(cc1O)C#N 62a_100000210202_100016221821 [0,2,0,0,0,0|2,0,0]=4 21823 B12R1.114 CCSc1cnc(cc1O)OC 62a_100000210202_100010738159 [0,2,0,0,0,0|2,0,0]=4 21824 B12R1.114 CCSc1cnc(cc1O)OC 62a_100010738159_100000210202 [0,2,0,0,0,0|2,0,0]=4 21825 B12R1.114 CCc1ccc(c(c1)Br)CNC 26a_100102657272_100012339963 [0,2,0,0,0,0|2,0,0]=4 21826 B12R1.114 CCc1ccc(c(c1)F)CNC 207a_100102657272_100011156597 [0,2,0,0,0,0|2,0,0]=4 21827 B12R1.114 CCc1ccc(c(c1)F)CNC 270004a_106832991635_100011156597 [0,2,0,0,0,0|2,0,0]=4 21828 B12R1.114 CCc1ccc(c(c1)O)NCF 34a_100000124328_100015361967 [0,2,0,0,0,0|2,0,0]=4 21829 B12R1.114 CNCc1ccc(cc1Br)C#N 207a_100102657272_100012355658 [0,2,0,0,0,0|2,0,0]=4 21830 B12R1.114 CNCc1ccc(cc1Br)C#N 2230a_106832991635_100000694769 [0,2,0,0,0,0|2,0,0]=4 21831 B12R1.114 CNCc1ccc(cc1Br)C#N 26a_100102657272_100011216086 [0,2,0,0,0,0|2,0,0]=4 21832 B12R1.114 CNCc1ccc(cc1Br)C#N 270004a_106832991635_100012355658 [0,2,0,0,0,0|2,0,0]=4 21833 B12R1.114 CNCc1ccc(cc1Br)C#N 34a_100102657272_100000694769 [0,2,0,0,0,0|2,0,0]=4 21834 B12R1.114 CNCc1ccc(cc1Br)C#N 34a_114948178924_200000210301 [0,2,0,0,0,0|2,0,0]=4 21835 B12R1.114 CNCc1ccc(cc1Br)C#N 7a_106832991635_100000694769 [0,2,0,0,0,0|2,0,0]=4 21836 B12R1.114 CNCc1ccc(cc1Br)CO 26a_100102657272_100011191544 [0,2,0,0,0,0|2,0,0]=4 21837 B12R1.114 CNCc1ccc(cc1Br)OC 207a_100102657272_100000723261 [0,2,0,0,0,0|2,0,0]=4 21838 B12R1.114 CNCc1ccc(cc1Br)OC 2230a_106832991635_100011982828 [0,2,0,0,0,0|2,0,0]=4 21839 B12R1.114 CNCc1ccc(cc1Br)OC 26a_100102657272_100000685887 [0,2,0,0,0,0|2,0,0]=4 21840 B12R1.114 CNCc1ccc(cc1Br)OC 270004a_106832991635_100000723261 [0,2,0,0,0,0|2,0,0]=4 21841 B12R1.114 CNCc1ccc(cc1Br)OC 34a_100102657272_100011982828 [0,2,0,0,0,0|2,0,0]=4 21842 B12R1.114 CNCc1ccc(cc1Br)OC 7a_106832991635_100011982828 [0,2,0,0,0,0|2,0,0]=4 21843 B12R1.114 CNCc1ccc(cc1C)C#N 207a_100102657272_100012187669 [0,2,0,0,0,0|2,0,0]=4 21844 B12R1.114 CNCc1ccc(cc1C)C#N 270004a_106832991635_100012187669 [0,2,0,0,0,0|2,0,0]=4 21845 B12R1.114 CNCc1ccc(cc1C)CO 207a_100102657272_100015695768 [0,2,0,0,0,0|2,0,0]=4 21846 B12R1.114 CNCc1ccc(cc1C)CO 270004a_106832991635_100015695768 [0,2,0,0,0,0|2,0,0]=4 21847 B12R1.114 CNCc1ccc(cc1C)OC 207a_100102657272_100011214997 [0,2,0,0,0,0|2,0,0]=4 21848 B12R1.114 CNCc1ccc(cc1C)OC 270004a_106832991635_100011214997 [0,2,0,0,0,0|2,0,0]=4 21849 B12R1.114 CNCc1ccc(cc1Cl)C#N 207a_100102657272_100012001878 [0,2,0,0,0,0|2,0,0]=4 21850 B12R1.114 CNCc1ccc(cc1Cl)C#N 2230a_106832991635_100000709902 [0,2,0,0,0,0|2,0,0]=4 21851 B12R1.114 CNCc1ccc(cc1Cl)C#N 26a_100102657272_100000205955 [0,2,0,0,0,0|2,0,0]=4 21852 B12R1.114 CNCc1ccc(cc1Cl)C#N 270004a_106832991635_100012001878 [0,2,0,0,0,0|2,0,0]=4 21853 B12R1.114 CNCc1ccc(cc1Cl)C#N 34a_100102657272_100000709902 [0,2,0,0,0,0|2,0,0]=4 21854 B12R1.114 CNCc1ccc(cc1Cl)C#N 7a_106832991635_100000709902 [0,2,0,0,0,0|2,0,0]=4 21855 B12R1.114 CNCc1ccc(cc1Cl)OC 207a_100102657272_100000235372 [0,2,0,0,0,0|2,0,0]=4 21856 B12R1.114 CNCc1ccc(cc1Cl)OC 2230a_106832991635_200011830453 [0,2,0,0,0,0|2,0,0]=4 21857 B12R1.114 CNCc1ccc(cc1Cl)OC 26a_100102657272_100000038596 [0,2,0,0,0,0|2,0,0]=4 21858 B12R1.114 CNCc1ccc(cc1Cl)OC 270004a_106832991635_100000235372 [0,2,0,0,0,0|2,0,0]=4 21859 B12R1.114 CNCc1ccc(cc1Cl)OC 34a_100102657272_200011830453 [0,2,0,0,0,0|2,0,0]=4 21860 B12R1.114 CNCc1ccc(cc1Cl)OC 34a_100138410423_200000210301 [0,2,0,0,0,0|2,0,0]=4 21861 B12R1.114 CNCc1ccc(cc1Cl)OC 7a_106832991635_200011830453 [0,2,0,0,0,0|2,0,0]=4 21862 B12R1.114 CNCc1ccc(cc1F)C#N 207a_100102657272_100000688119 [0,2,0,0,0,0|2,0,0]=4 21863 B12R1.114 CNCc1ccc(cc1F)C#N 2230a_106832991635_100000239720 [0,2,0,0,0,0|2,0,0]=4 21864 B12R1.114 CNCc1ccc(cc1F)C#N 26a_100102657272_100000751310 [0,2,0,0,0,0|2,0,0]=4 21865 B12R1.114 CNCc1ccc(cc1F)C#N 270004a_106832991635_100000688119 [0,2,0,0,0,0|2,0,0]=4 21866 B12R1.114 CNCc1ccc(cc1F)C#N 34a_100000749714_200000210301 [0,2,0,0,0,0|2,0,0]=4 21867 B12R1.114 CNCc1ccc(cc1F)C#N 34a_100102657272_100000239720 [0,2,0,0,0,0|2,0,0]=4 21868 B12R1.114 CNCc1ccc(cc1F)C#N 7a_106832991635_100000239720 [0,2,0,0,0,0|2,0,0]=4 21869 B12R1.114 CNCc1ccc(cc1F)OC 207a_100102657272_100011216087 [0,2,0,0,0,0|2,0,0]=4 21870 B12R1.114 CNCc1ccc(cc1F)OC 2230a_106832991635_100011260761 [0,2,0,0,0,0|2,0,0]=4 21871 B12R1.114 CNCc1ccc(cc1F)OC 26a_100102657272_100000036999 [0,2,0,0,0,0|2,0,0]=4 21872 B12R1.114 CNCc1ccc(cc1F)OC 270004a_106832991635_100011216087 [0,2,0,0,0,0|2,0,0]=4 21873 B12R1.114 CNCc1ccc(cc1F)OC 34a_100000687396_200000210301 [0,2,0,0,0,0|2,0,0]=4 21874 B12R1.114 CNCc1ccc(cc1F)OC 34a_100102657272_100011260761 [0,2,0,0,0,0|2,0,0]=4 21875 B12R1.114 CNCc1ccc(cc1F)OC 7a_106832991635_100011260761 [0,2,0,0,0,0|2,0,0]=4 21876 B12R1.114 CNCc1ccc(cc1I)C#N 2230a_106832991635_100010079267 [0,2,0,0,0,0|2,0,0]=4 21877 B12R1.114 CNCc1ccc(cc1I)C#N 34a_100102657272_100010079267 [0,2,0,0,0,0|2,0,0]=4 21878 B12R1.114 CNCc1ccc(cc1I)C#N 7a_106832991635_100010079267 [0,2,0,0,0,0|2,0,0]=4 21879 B12R1.114 CNCc1ccc(cc1I)OC 207a_100102657272_100010159643 [0,2,0,0,0,0|2,0,0]=4 21880 B12R1.114 CNCc1ccc(cc1I)OC 270004a_106832991635_100010159643 [0,2,0,0,0,0|2,0,0]=4 21881 B12R1.114 CNc1ccc(c(c1)F)COC 34a_100012145864_200000210301 [0,2,0,0,0,0|2,0,0]=4 21882 B12R1.114 CNc1ccc(c(c1)F)COC 7a_100012145864_200000210301 [0,2,0,0,0,0|2,0,0]=4 21883 B12R1.114 COCc1ccc(cc1Br)C#N 34a_100010214422_200000210301 [0,2,0,0,0,0|2,0,0]=4 21884 B12R1.114 COCc1ccc(cc1Br)C#N 34a_100138415774_100000694769 [0,2,0,0,0,0|2,0,0]=4 21885 B12R1.114 COCc1ccc(cc1Br)C#N 7a_100010214422_200000210301 [0,2,0,0,0,0|2,0,0]=4 21886 B12R1.114 COCc1ccc(cc1Br)OC 34a_100011982768_200000210301 [0,2,0,0,0,0|2,0,0]=4 21887 B12R1.114 COCc1ccc(cc1Br)OC 34a_100138415774_100011982828 [0,2,0,0,0,0|2,0,0]=4 21888 B12R1.114 COCc1ccc(cc1Br)OC 7a_100011982768_200000210301 [0,2,0,0,0,0|2,0,0]=4 21889 B12R1.114 COCc1ccc(cc1Cl)C#N 34a_100138415774_100000709902 [0,2,0,0,0,0|2,0,0]=4 21890 B12R1.114 COCc1ccc(cc1Cl)OC 34a_100011982767_200000210301 [0,2,0,0,0,0|2,0,0]=4 21891 B12R1.114 COCc1ccc(cc1Cl)OC 34a_100138415774_200011830453 [0,2,0,0,0,0|2,0,0]=4 21892 B12R1.114 COCc1ccc(cc1Cl)OC 7a_100011982767_200000210301 [0,2,0,0,0,0|2,0,0]=4 21893 B12R1.114 COCc1ccc(cc1F)C#N 34a_100000752871_200000210301 [0,2,0,0,0,0|2,0,0]=4 21894 B12R1.114 COCc1ccc(cc1F)C#N 34a_100138415774_100000239720 [0,2,0,0,0,0|2,0,0]=4 21895 B12R1.114 COCc1ccc(cc1F)C#N 7a_100000752871_200000210301 [0,2,0,0,0,0|2,0,0]=4 21896 B12R1.114 COCc1ccc(cc1F)N[13CH3] 34a_100012145864_200025704644 [0,2,0,0,0,0|2,0,0]=4 21897 B12R1.114 COCc1ccc(cc1F)N[13CH3] 7a_100012145864_200025704644 [0,2,0,0,0,0|2,0,0]=4 21898 B12R1.114 COCc1ccc(cc1F)OC 34a_100011830421_200000210301 [0,2,0,0,0,0|2,0,0]=4 21899 B12R1.114 COCc1ccc(cc1F)OC 34a_100138415774_100011260761 [0,2,0,0,0,0|2,0,0]=4 21900 B12R1.114 COCc1ccc(cc1F)OC 7a_100011830421_200000210301 [0,2,0,0,0,0|2,0,0]=4 21901 B12R1.114 COCc1ccc(cc1I)C#N 34a_100138415774_100010079267 [0,2,0,0,0,0|2,0,0]=4 21902 B12R1.114 COCc1ccc(cc1N)OC 34a_100011998734_200000210301 [0,2,0,0,0,0|2,0,0]=4 21903 B12R1.114 COCc1ccc(cc1N)SC 62a_100013084866_200000210301 [0,2,0,0,0,0|2,0,0]=4 21904 B12R1.114 COCc1ccc(cc1N)SC 62a_200000210301_100013084866 [0,2,0,0,0,0|2,0,0]=4 21905 B12R1.114 COCc1ccc(cc1N)S[13CH3] 62a_100013084866_200025704644 [0,2,0,0,0,0|2,0,0]=4 21906 B12R1.114 COCc1ccc(cc1N)S[13CH3] 62a_200025704644_100013084866 [0,2,0,0,0,0|2,0,0]=4 21907 B12R1.114 COc1ccc(c(c1)Br)CO[13CH3] 34a_100011982768_200025704644 [0,2,0,0,0,0|2,0,0]=4 21908 B12R1.114 COc1ccc(c(c1)Br)CO[13CH3] 7a_100011982768_200025704644 [0,2,0,0,0,0|2,0,0]=4 21909 B12R1.114 COc1ccc(c(c1)Br)CSC 62a_100011982828_200000210301 [0,2,0,0,0,0|2,0,0]=4 21910 B12R1.114 COc1ccc(c(c1)Br)CSC 62a_200000210301_100011982828 [0,2,0,0,0,0|2,0,0]=4 21911 B12R1.114 COc1ccc(c(c1)Br)CS[13CH3] 62a_100011982828_200025704644 [0,2,0,0,0,0|2,0,0]=4 21912 B12R1.114 COc1ccc(c(c1)Br)CS[13CH3] 62a_200025704644_100011982828 [0,2,0,0,0,0|2,0,0]=4 21913 B12R1.114 COc1ccc(c(c1)Cl)CN[13CH3] 34a_100138410423_200025704644 [0,2,0,0,0,0|2,0,0]=4 21914 B12R1.114 COc1ccc(c(c1)Cl)CO[13CH3] 34a_100011982767_200025704644 [0,2,0,0,0,0|2,0,0]=4 21915 B12R1.114 COc1ccc(c(c1)Cl)CO[13CH3] 7a_100011982767_200025704644 [0,2,0,0,0,0|2,0,0]=4 21916 B12R1.114 COc1ccc(c(c1)Cl)CSC 62a_200000210301_200011830453 [0,2,0,0,0,0|2,0,0]=4 21917 B12R1.114 COc1ccc(c(c1)Cl)CSC 62a_200011830453_200000210301 [0,2,0,0,0,0|2,0,0]=4 21918 B12R1.114 COc1ccc(c(c1)Cl)CS[13CH3] 62a_200011830453_200025704644 [0,2,0,0,0,0|2,0,0]=4 21919 B12R1.114 COc1ccc(c(c1)Cl)CS[13CH3] 62a_200025704644_200011830453 [0,2,0,0,0,0|2,0,0]=4 21920 B12R1.114 COc1ccc(c(c1)F)CN[13CH3] 34a_100000687396_200025704644 [0,2,0,0,0,0|2,0,0]=4 21921 B12R1.114 COc1ccc(c(c1)F)CO[13CH3] 34a_100011830421_200025704644 [0,2,0,0,0,0|2,0,0]=4 21922 B12R1.114 COc1ccc(c(c1)F)CO[13CH3] 7a_100011830421_200025704644 [0,2,0,0,0,0|2,0,0]=4 21923 B12R1.114 COc1ccc(c(c1)F)CSC 62a_100011260761_200000210301 [0,2,0,0,0,0|2,0,0]=4 21924 B12R1.114 COc1ccc(c(c1)F)CSC 62a_200000210301_100011260761 [0,2,0,0,0,0|2,0,0]=4 21925 B12R1.114 COc1ccc(c(c1)F)CS[13CH3] 62a_100011260761_200025704644 [0,2,0,0,0,0|2,0,0]=4 21926 B12R1.114 COc1ccc(c(c1)F)CS[13CH3] 62a_200025704644_100011260761 [0,2,0,0,0,0|2,0,0]=4 21927 B12R1.114 COc1ccc(c(c1)N)CO[13CH3] 34a_100011998734_200025704644 [0,2,0,0,0,0|2,0,0]=4 21928 B12R1.114 COc1ccc(c(c1)O)CC#N 271570a_203496583355_100010146818 [0,2,0,0,0,0|1,0,1]=4 21929 B12R1.114 COc1ccc(c(c1)O)NCF 34a_100016989039_100015361967 [0,2,0,0,0,0|2,0,0]=4 21930 B12R1.114 COc1ccc(c(c1)O)SCF 62a_100015361967_100000719091 [0,2,0,0,0,0|2,0,0]=4 21931 B12R1.114 CSCc1ccc(cc1Br)C#N 62a_100000694769_200000210301 [0,2,0,0,0,0|2,0,0]=4 21932 B12R1.114 CSCc1ccc(cc1Br)C#N 62a_200000210301_100000694769 [0,2,0,0,0,0|2,0,0]=4 21933 B12R1.114 CSCc1ccc(cc1Cl)C#N 62a_200000210301_100000709902 [0,2,0,0,0,0|2,0,0]=4 21934 B12R1.114 CSCc1ccc(cc1F)C#N 62a_200000210301_100000239720 [0,2,0,0,0,0|2,0,0]=4 21935 B12R1.114 CSCc1ccc(cc1I)C#N 62a_100010079267_200000210301 [0,2,0,0,0,0|2,0,0]=4 21936 B12R1.114 CSCc1ccc(cc1I)C#N 62a_200000210301_100010079267 [0,2,0,0,0,0|2,0,0]=4 21937 B12R1.114 CSc1ccc(c(c1)F)CCO 62a_100011962869_200000210301 [0,2,0,0,0,0|2,0,0]=4 21938 B12R1.114 CSc1ccc(c(c1)F)CCO 62a_200000210301_100011962869 [0,2,0,0,0,0|2,0,0]=4 21939 B12R1.114 N#Cc1ccc(c(c1)O)NCF 34a_100011997735_100015361967 [0,2,0,0,0,0|2,0,0]=4 21940 B12R1.114 N#Cc1ccc(c(c1)O)SCF 62a_100015361967_100009877741 [0,2,0,0,0,0|2,0,0]=4 21941 B12R1.114 O=Cc1ccc(c(c1)O)SCF 62a_100000041418_100015361967 [0,2,0,0,0,0|2,0,0]=4 21942 B12R1.114 O=Cc1ccc(c(c1)O)SCF 62a_100015361967_100000041418 [0,2,0,0,0,0|2,0,0]=4 21943 B12R1.114 OCc1ccc(c(c1)O)SCF 62a_100000049605_100015361967 [0,2,0,0,0,0|2,0,0]=4 21944 B12R1.114 OCc1ccc(c(c1)O)SCF 62a_100015361967_100000049605 [0,2,0,0,0,0|2,0,0]=4 21945 B12R1.114 [13CH3]NCc1ccc(cc1Br)C#N 34a_114948178924_200025704644 [0,2,0,0,0,0|2,0,0]=4 21946 B12R1.114 [13CH3]NCc1ccc(cc1F)C#N 34a_100000749714_200025704644 [0,2,0,0,0,0|2,0,0]=4 21947 B12R1.114 [13CH3]OCc1ccc(cc1Br)C#N 34a_100010214422_200025704644 [0,2,0,0,0,0|2,0,0]=4 21948 B12R1.114 [13CH3]OCc1ccc(cc1Br)C#N 7a_100010214422_200025704644 [0,2,0,0,0,0|2,0,0]=4 21949 B12R1.114 [13CH3]OCc1ccc(cc1F)C#N 34a_100000752871_200025704644 [0,2,0,0,0,0|2,0,0]=4 21950 B12R1.114 [13CH3]OCc1ccc(cc1F)C#N 7a_100000752871_200025704644 [0,2,0,0,0,0|2,0,0]=4 21951 B12R1.114 [13CH3]SCc1ccc(cc1Br)C#N 62a_100000694769_200025704644 [0,2,0,0,0,0|2,0,0]=4 21952 B12R1.114 [13CH3]SCc1ccc(cc1Br)C#N 62a_200025704644_100000694769 [0,2,0,0,0,0|2,0,0]=4 21953 B12R1.114 [13CH3]SCc1ccc(cc1Cl)C#N 62a_200025704644_100000709902 [0,2,0,0,0,0|2,0,0]=4 21954 B12R1.114 [13CH3]SCc1ccc(cc1F)C#N 62a_200025704644_100000239720 [0,2,0,0,0,0|2,0,0]=4 21955 B12R1.114 [13CH3]SCc1ccc(cc1I)C#N 62a_100010079267_200025704644 [0,2,0,0,0,0|2,0,0]=4 21956 B12R1.114 [13CH3]SCc1ccc(cc1I)C#N 62a_200025704644_100010079267 [0,2,0,0,0,0|2,0,0]=4 21957 B12R1.114 [13CH3]Sc1ccc(c(c1)F)CCO 62a_100011962869_200025704644 [0,2,0,0,0,0|2,0,0]=4 21958 B12R1.114 [13CH3]Sc1ccc(c(c1)F)CCO 62a_200025704644_100011962869 [0,2,0,0,0,0|2,0,0]=4 21959 B12R1.233 CC(=Cc1ccc(cc1O)Br)C 271570a_100102525489_100012344904 [0,2,0,0,0,0|0,0,2]=4 21960 B12R1.233 CC(=Cc1ccc(cc1O)C)C 271570a_100102525489_100012002257 [0,2,0,0,0,0|0,0,2]=4 21961 B12R1.233 CC(=Cc1ccc(cc1O)Cl)C 271570a_100102525489_100000050036 [0,2,0,0,0,0|0,0,2]=4 21962 B12R1.233 CC(=Cc1ccc(cc1O)F)C 271570a_100102525489_100000690578 [0,2,0,0,0,0|0,0,2]=4 21963 B12R1.233 CC(=Cc1ccc(cc1O)O)C 271570a_100102525489_100009813921 [0,2,0,0,0,0|0,0,2]=4 21964 B12R1.233 CC(=O)Cc1ccc(cc1Br)Br 1458a_100000070787_200012351560 [0,2,0,0,0,0|1,0,1]=4 21965 B12R1.233 CC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_200000210301 [0,2,0,0,0,0|1,0,1]=4 21966 B12R1.233 CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000070787_100000755608 [0,2,0,0,0,0|1,0,1]=4 21967 B12R1.233 CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_200000210301 [0,2,0,0,0,0|1,0,1]=4 21968 B12R1.233 CC(=O)Cc1ccc(cc1Br)F 1458a_100000070787_100000243222 [0,2,0,0,0,0|1,0,1]=4 21969 B12R1.233 CC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_200000210301 [0,2,0,0,0,0|1,0,1]=4 21970 B12R1.233 CC(=O)Cc1ccc(cc1Br)I 1458a_100000070787_100010146610 [0,2,0,0,0,0|1,0,1]=4 21971 B12R1.233 CC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200000210301 [0,2,0,0,0,0|1,0,1]=4 21972 B12R1.233 CC(=O)Cc1ccc(cc1C)Br 1458a_100000070787_100000708836 [0,2,0,0,0,0|1,0,1]=4 21973 B12R1.233 CC(=O)Cc1ccc(cc1C)Br 1458a_100000697930_200000210301 [0,2,0,0,0,0|1,0,1]=4 21974 B12R1.233 CC(=O)Cc1ccc(cc1C)C 1458a_100000070787_100011219618 [0,2,0,0,0,0|1,0,1]=4 21975 B12R1.233 CC(=O)Cc1ccc(cc1C)C 1458a_100011236500_200000210301 [0,2,0,0,0,0|1,0,1]=4 21976 B12R1.233 CC(=O)Cc1ccc(cc1C)Cl 1458a_100000070787_100012361307 [0,2,0,0,0,0|1,0,1]=4 21977 B12R1.233 CC(=O)Cc1ccc(cc1C)F 1458a_100000070787_100000700533 [0,2,0,0,0,0|1,0,1]=4 21978 B12R1.233 CC(=O)Cc1ccc(cc1C)F 1458a_100011667441_200000210301 [0,2,0,0,0,0|1,0,1]=4 21979 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Br 1458a_100000070787_100011740631 [0,2,0,0,0,0|1,0,1]=4 21980 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_200000210301 [0,2,0,0,0,0|1,0,1]=4 21981 B12R1.233 CC(=O)Cc1ccc(cc1Cl)C 1458a_100000070787_100012349684 [0,2,0,0,0,0|1,0,1]=4 21982 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000070787_100000188473 [0,2,0,0,0,0|1,0,1]=4 21983 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_200000210301 [0,2,0,0,0,0|1,0,1]=4 21984 B12R1.233 CC(=O)Cc1ccc(cc1Cl)F 1458a_100000070787_100011216360 [0,2,0,0,0,0|1,0,1]=4 21985 B12R1.233 CC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_200000210301 [0,2,0,0,0,0|1,0,1]=4 21986 B12R1.233 CC(=O)Cc1ccc(cc1F)Br 1458a_100000070787_100000211606 [0,2,0,0,0,0|1,0,1]=4 21987 B12R1.233 CC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_200000210301 [0,2,0,0,0,0|1,0,1]=4 21988 B12R1.233 CC(=O)Cc1ccc(cc1F)C 1458a_100000042674_200000210301 [0,2,0,0,0,0|1,0,1]=4 21989 B12R1.233 CC(=O)Cc1ccc(cc1F)C 1458a_100000070787_100012002367 [0,2,0,0,0,0|1,0,1]=4 21990 B12R1.233 CC(=O)Cc1ccc(cc1F)Cl 1458a_100000070787_100000709361 [0,2,0,0,0,0|1,0,1]=4 21991 B12R1.233 CC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_200000210301 [0,2,0,0,0,0|1,0,1]=4 21992 B12R1.233 CC(=O)Cc1ccc(cc1F)F 1458a_100000070787_100000748237 [0,2,0,0,0,0|1,0,1]=4 21993 B12R1.233 CC(=O)Cc1ccc(cc1F)F 1458a_100000684719_200000210301 [0,2,0,0,0,0|1,0,1]=4 21994 B12R1.233 CC(=O)Cc1ccc(cc1F)I 1458a_100000070787_100010244991 [0,2,0,0,0,0|1,0,1]=4 21995 B12R1.233 CC(=O)Cc1ccc(cc1F)I 1458a_100010149628_200000210301 [0,2,0,0,0,0|1,0,1]=4 21996 B12R1.233 CC(=O)Cc1ccc(cc1F)O 1458a_100000090534_200000210301 [0,2,0,0,0,0|1,0,1]=4 21997 B12R1.233 CC(=O)Cc1ccc(cc1I)Br 1458a_100000070787_100010146615 [0,2,0,0,0,0|1,0,1]=4 21998 B12R1.233 CC(=O)Cc1ccc(cc1I)Cl 1458a_100000070787_100010254388 [0,2,0,0,0,0|1,0,1]=4 21999 B12R1.233 CC(=O)Cc1ccc(cc1I)F 1458a_100000070787_100012354799 [0,2,0,0,0,0|1,0,1]=4 22000 B12R1.233 CC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_200000210301 [0,2,0,0,0,0|0,0,1]=3 22001 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000070787 [0,2,0,0,0,0|1,0,1]=4 22002 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 271570a_203496583355_100009813020 [0,2,0,0,0,0|1,0,1]=4 22003 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100103153847 [0,2,0,0,0,0|1,0,1]=4 22004 B12R1.233 CC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000070787 [0,2,0,0,0,0|1,0,1]=4 22005 B12R1.233 CC(=O)Nc1ccc(cc1O)C 271570a_203496583355_100000152032 [0,2,0,0,0,0|1,0,1]=4 22006 B12R1.233 CC(=O)Nc1ccc(cc1O)C 527a_100000211527_100103153847 [0,2,0,0,0,0|1,0,1]=4 22007 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000070787 [0,2,0,0,0,0|1,0,1]=4 22008 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100103153847 [0,2,0,0,0,0|1,0,1]=4 22009 B12R1.233 CC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000070787 [0,2,0,0,0,0|1,0,1]=4 22010 B12R1.233 CC(=O)Nc1ccc(cc1O)F 271570a_203496583355_100011215554 [0,2,0,0,0,0|1,0,1]=4 22011 B12R1.233 CC(=O)Nc1ccc(cc1O)F 527a_100000753323_100103153847 [0,2,0,0,0,0|1,0,1]=4 22012 B12R1.233 CC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000070787 [0,2,0,0,0,0|1,0,1]=4 22013 B12R1.233 CC(=O)Nc1ccc(cc1O)I 527a_100000057187_100103153847 [0,2,0,0,0,0|1,0,1]=4 22014 B12R1.233 CC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000070787 [0,2,0,0,0,0|1,0,1]=4 22015 B12R1.233 CC(=O)Nc1ccc(cc1O)O 527a_100000106777_100103153847 [0,2,0,0,0,0|1,0,1]=4 22016 B12R1.233 CC(C)Nc1ccc(cc1Br)Br 34a_100000211012_100000210206 [0,2,0,0,0,0|2,0,0]=4 22017 B12R1.233 CC(C)Nc1ccc(cc1Br)Cl 34a_100000752454_100000210206 [0,2,0,0,0,0|2,0,0]=4 22018 B12R1.233 CC(C)Nc1ccc(cc1Br)F 34a_100000738039_100000210206 [0,2,0,0,0,0|2,0,0]=4 22019 B12R1.233 CC(C)Nc1ccc(cc1Br)O 34a_100012001276_100000210206 [0,2,0,0,0,0|2,0,0]=4 22020 B12R1.233 CC(C)Nc1ccc(cc1Cl)Br 34a_100000211467_100000210206 [0,2,0,0,0,0|2,0,0]=4 22021 B12R1.233 CC(C)Nc1ccc(cc1Cl)Cl 34a_100000185861_100000210206 [0,2,0,0,0,0|2,0,0]=4 22022 B12R1.233 CC(C)Nc1ccc(cc1Cl)F 34a_100000212003_100000210206 [0,2,0,0,0,0|2,0,0]=4 22023 B12R1.233 CC(C)Nc1ccc(cc1Cl)I 34a_100011218065_100000210206 [0,2,0,0,0,0|2,0,0]=4 22024 B12R1.233 CC(C)Nc1ccc(cc1Cl)O 34a_100011215599_100000210206 [0,2,0,0,0,0|2,0,0]=4 22025 B12R1.233 CC(C)Nc1ccc(cc1F)Br 34a_100000210722_100000210206 [0,2,0,0,0,0|2,0,0]=4 22026 B12R1.233 CC(C)Nc1ccc(cc1F)Cl 34a_100000211020_100000210206 [0,2,0,0,0,0|2,0,0]=4 22027 B12R1.233 CC(C)Nc1ccc(cc1F)F 34a_100000210720_100000210206 [0,2,0,0,0,0|2,0,0]=4 22028 B12R1.233 CC(C)Nc1ccc(cc1F)I 34a_100011215594_100000210206 [0,2,0,0,0,0|2,0,0]=4 22029 B12R1.233 CC(C)Nc1ccc(cc1F)O 34a_100000759473_100000210206 [0,2,0,0,0,0|2,0,0]=4 22030 B12R1.233 CC(C)Nc1ccc(cc1I)Br 34a_100000187925_100000210206 [0,2,0,0,0,0|2,0,0]=4 22031 B12R1.233 CC(C)Nc1ccc(cc1I)Cl 34a_100000761889_100000210206 [0,2,0,0,0,0|2,0,0]=4 22032 B12R1.233 CC(C)Nc1ccc(cc1I)F 34a_100000760547_100000210206 [0,2,0,0,0,0|2,0,0]=4 22033 B12R1.233 CC(C)Nc1ccc(cc1I)O 34a_100010084370_100000210206 [0,2,0,0,0,0|2,0,0]=4 22034 B12R1.233 CC(C)Nc1ccc(cc1O)Br 34a_100000739049_100000210206 [0,2,0,0,0,0|1,0,0]=3 22035 B12R1.233 CC(C)Nc1ccc(cc1O)Cl 34a_100000185728_100000210206 [0,2,0,0,0,0|1,0,0]=3 22036 B12R1.233 CC(C)Nc1ccc(cc1O)F 34a_100000753323_100000210206 [0,2,0,0,0,0|1,0,0]=3 22037 B12R1.233 CC(C)Nc1ccc(cc1O)O 34a_100000106777_100000210206 [0,2,0,0,0,0|1,0,0]=3 22038 B12R1.233 CC(C)Oc1ccc(cc1Br)Br 34a_100000188717_100000210206 [0,2,0,0,0,0|2,0,0]=4 22039 B12R1.233 CC(C)Oc1ccc(cc1Br)Br 7a_100000188717_100000210206 [0,2,0,0,0,0|2,0,0]=4 22040 B12R1.233 CC(C)Oc1ccc(cc1Br)Cl 34a_100000211998_100000210206 [0,2,0,0,0,0|2,0,0]=4 22041 B12R1.233 CC(C)Oc1ccc(cc1Br)Cl 7a_100000211998_100000210206 [0,2,0,0,0,0|2,0,0]=4 22042 B12R1.233 CC(C)Oc1ccc(cc1Br)F 34a_100000211999_100000210206 [0,2,0,0,0,0|2,0,0]=4 22043 B12R1.233 CC(C)Oc1ccc(cc1Br)F 7a_100000211999_100000210206 [0,2,0,0,0,0|2,0,0]=4 22044 B12R1.233 CC(C)Oc1ccc(cc1Br)I 34a_100012361655_100000210206 [0,2,0,0,0,0|2,0,0]=4 22045 B12R1.233 CC(C)Oc1ccc(cc1Br)I 7a_100012361655_100000210206 [0,2,0,0,0,0|2,0,0]=4 22046 B12R1.233 CC(C)Oc1ccc(cc1Br)N 34a_100011534360_100000210206 [0,2,0,0,0,0|2,0,0]=4 22047 B12R1.233 CC(C)Oc1ccc(cc1Br)N 7a_100011534360_100000210206 [0,2,0,0,0,0|2,0,0]=4 22048 B12R1.233 CC(C)Oc1ccc(cc1Cl)Br 34a_100000186472_100000210206 [0,2,0,0,0,0|2,0,0]=4 22049 B12R1.233 CC(C)Oc1ccc(cc1Cl)Br 7a_100000186472_100000210206 [0,2,0,0,0,0|2,0,0]=4 22050 B12R1.233 CC(C)Oc1ccc(cc1Cl)Cl 34a_100015191787_100000210206 [0,2,0,0,0,0|2,0,0]=4 22051 B12R1.233 CC(C)Oc1ccc(cc1Cl)Cl 7a_100015191787_100000210206 [0,2,0,0,0,0|2,0,0]=4 22052 B12R1.233 CC(C)Oc1ccc(cc1Cl)F 34a_100000212004_100000210206 [0,2,0,0,0,0|2,0,0]=4 22053 B12R1.233 CC(C)Oc1ccc(cc1Cl)F 7a_100000212004_100000210206 [0,2,0,0,0,0|2,0,0]=4 22054 B12R1.233 CC(C)Oc1ccc(cc1Cl)I 34a_100012360047_100000210206 [0,2,0,0,0,0|2,0,0]=4 22055 B12R1.233 CC(C)Oc1ccc(cc1Cl)I 7a_100012360047_100000210206 [0,2,0,0,0,0|2,0,0]=4 22056 B12R1.233 CC(C)Oc1ccc(cc1Cl)N 34a_100000744943_100000210206 [0,2,0,0,0,0|2,0,0]=4 22057 B12R1.233 CC(C)Oc1ccc(cc1Cl)N 7a_100000744943_100000210206 [0,2,0,0,0,0|2,0,0]=4 22058 B12R1.233 CC(C)Oc1ccc(cc1F)Br 34a_100000185481_100000210206 [0,2,0,0,0,0|2,0,0]=4 22059 B12R1.233 CC(C)Oc1ccc(cc1F)Br 7a_100000185481_100000210206 [0,2,0,0,0,0|2,0,0]=4 22060 B12R1.233 CC(C)Oc1ccc(cc1F)Cl 34a_100000230166_100000210206 [0,2,0,0,0,0|2,0,0]=4 22061 B12R1.233 CC(C)Oc1ccc(cc1F)Cl 7a_100000230166_100000210206 [0,2,0,0,0,0|2,0,0]=4 22062 B12R1.233 CC(C)Oc1ccc(cc1F)F 34a_100000230127_100000210206 [0,2,0,0,0,0|2,0,0]=4 22063 B12R1.233 CC(C)Oc1ccc(cc1F)F 7a_100000230127_100000210206 [0,2,0,0,0,0|2,0,0]=4 22064 B12R1.233 CC(C)Oc1ccc(cc1F)I 34a_100011356965_100000210206 [0,2,0,0,0,0|2,0,0]=4 22065 B12R1.233 CC(C)Oc1ccc(cc1F)I 7a_100011356965_100000210206 [0,2,0,0,0,0|2,0,0]=4 22066 B12R1.233 CC(C)Oc1ccc(cc1F)N 34a_100011220035_100000210206 [0,2,0,0,0,0|2,0,0]=4 22067 B12R1.233 CC(C)Oc1ccc(cc1F)N 7a_100011220035_100000210206 [0,2,0,0,0,0|2,0,0]=4 22068 B12R1.233 CC(C)Oc1ccc(cc1F)O 271570a_203496583355_100009811877 [0,2,0,0,0,0|2,0,0]=4 22069 B12R1.233 CC(C)Oc1ccc(cc1I)Br 34a_100012355227_100000210206 [0,2,0,0,0,0|2,0,0]=4 22070 B12R1.233 CC(C)Oc1ccc(cc1I)Br 7a_100012355227_100000210206 [0,2,0,0,0,0|2,0,0]=4 22071 B12R1.233 CC(C)Oc1ccc(cc1I)Cl 34a_100011356953_100000210206 [0,2,0,0,0,0|2,0,0]=4 22072 B12R1.233 CC(C)Oc1ccc(cc1I)Cl 7a_100011356953_100000210206 [0,2,0,0,0,0|2,0,0]=4 22073 B12R1.233 CC(C)Oc1ccc(cc1I)F 34a_100012355409_100000210206 [0,2,0,0,0,0|2,0,0]=4 22074 B12R1.233 CC(C)Oc1ccc(cc1I)F 7a_100012355409_100000210206 [0,2,0,0,0,0|2,0,0]=4 22075 B12R1.233 CC(C)Oc1ccc(cc1I)I 7a_100010001573_100000210206 [0,2,0,0,0,0|2,0,0]=4 22076 B12R1.233 CC(C)Oc1ccc(cc1N)Br 34a_100000752626_100000210206 [0,2,0,0,0,0|2,0,0]=4 22077 B12R1.233 CC(C)Oc1ccc(cc1N)Br 7a_100000752626_100000210206 [0,2,0,0,0,0|2,0,0]=4 22078 B12R1.233 CC(C)Oc1ccc(cc1N)Cl 34a_100000210500_100000210206 [0,2,0,0,0,0|2,0,0]=4 22079 B12R1.233 CC(C)Oc1ccc(cc1N)Cl 7a_100000210500_100000210206 [0,2,0,0,0,0|2,0,0]=4 22080 B12R1.233 CC(C)Oc1ccc(cc1N)F 34a_100000759472_100000210206 [0,2,0,0,0,0|2,0,0]=4 22081 B12R1.233 CC(C)Oc1ccc(cc1N)F 7a_100000759472_100000210206 [0,2,0,0,0,0|2,0,0]=4 22082 B12R1.233 CC(C)Oc1ccc(cc1N)I 34a_100000753495_100000210206 [0,2,0,0,0,0|2,0,0]=4 22083 B12R1.233 CC(C)Oc1ccc(cc1N)I 7a_100000753495_100000210206 [0,2,0,0,0,0|2,0,0]=4 22084 B12R1.233 CC(C)Oc1ccc(cc1N)N 34a_100000725306_100000210206 [0,2,0,0,0,0|2,0,0]=4 22085 B12R1.233 CC(C)Oc1ccc(cc1N)O 271570a_203496583355_100000690130 [0,2,0,0,0,0|2,0,0]=4 22086 B12R1.233 CC(C)Oc1ccc(cc1O)F 271570a_203496583355_100000171696 [0,2,0,0,0,0|1,0,0]=3 22087 B12R1.233 CC(C)Oc1ccc(cc1O)N 271570a_203496583355_200000706018 [0,2,0,0,0,0|1,0,0]=3 22088 B12R1.233 CC(C)Oc1ncc(cc1O)Br 271570a_203496583355_200010177600 [0,2,0,0,0,0|2,0,0]=4 22089 B12R1.233 CC(C)Sc1ccc(cc1Br)Br 62a_100000210206_100011484698 [0,2,0,0,0,0|2,0,0]=4 22090 B12R1.233 CC(C)Sc1ccc(cc1Br)Br 62a_100011484698_100000210206 [0,2,0,0,0,0|2,0,0]=4 22091 B12R1.233 CC(C)Sc1ccc(cc1Br)Cl 62a_100000210206_100011219703 [0,2,0,0,0,0|2,0,0]=4 22092 B12R1.233 CC(C)Sc1ccc(cc1Br)Cl 62a_100011219703_100000210206 [0,2,0,0,0,0|2,0,0]=4 22093 B12R1.233 CC(C)Sc1ccc(cc1Br)F 62a_100000210206_100011217111 [0,2,0,0,0,0|2,0,0]=4 22094 B12R1.233 CC(C)Sc1ccc(cc1Br)F 62a_100011217111_100000210206 [0,2,0,0,0,0|2,0,0]=4 22095 B12R1.233 CC(C)Sc1ccc(cc1Br)N 62a_100000210206_100000750458 [0,2,0,0,0,0|2,0,0]=4 22096 B12R1.233 CC(C)Sc1ccc(cc1Br)N 62a_100000750458_100000210206 [0,2,0,0,0,0|2,0,0]=4 22097 B12R1.233 CC(C)Sc1ccc(cc1Br)O 62a_100000210206_100000701344 [0,2,0,0,0,0|2,0,0]=4 22098 B12R1.233 CC(C)Sc1ccc(cc1Br)O 62a_100000701344_100000210206 [0,2,0,0,0,0|2,0,0]=4 22099 B12R1.233 CC(C)Sc1ccc(cc1Cl)Br 62a_100000210206_100011216062 [0,2,0,0,0,0|2,0,0]=4 22100 B12R1.233 CC(C)Sc1ccc(cc1Cl)Br 62a_100011216062_100000210206 [0,2,0,0,0,0|2,0,0]=4 22101 B12R1.233 CC(C)Sc1ccc(cc1Cl)Cl 62a_100000210206_100000699841 [0,2,0,0,0,0|2,0,0]=4 22102 B12R1.233 CC(C)Sc1ccc(cc1Cl)Cl 62a_100000699841_100000210206 [0,2,0,0,0,0|2,0,0]=4 22103 B12R1.233 CC(C)Sc1ccc(cc1Cl)F 62a_100000210206_100000733362 [0,2,0,0,0,0|2,0,0]=4 22104 B12R1.233 CC(C)Sc1ccc(cc1Cl)F 62a_100000733362_100000210206 [0,2,0,0,0,0|2,0,0]=4 22105 B12R1.233 CC(C)Sc1ccc(cc1Cl)N 62a_100000210206_100000761885 [0,2,0,0,0,0|2,0,0]=4 22106 B12R1.233 CC(C)Sc1ccc(cc1Cl)N 62a_100000761885_100000210206 [0,2,0,0,0,0|2,0,0]=4 22107 B12R1.233 CC(C)Sc1ccc(cc1Cl)O 62a_100000047559_100000210206 [0,2,0,0,0,0|2,0,0]=4 22108 B12R1.233 CC(C)Sc1ccc(cc1Cl)O 62a_100000210206_100000047559 [0,2,0,0,0,0|2,0,0]=4 22109 B12R1.233 CC(C)Sc1ccc(cc1F)Br 62a_100000210206_100009814013 [0,2,0,0,0,0|2,0,0]=4 22110 B12R1.233 CC(C)Sc1ccc(cc1F)Br 62a_100009814013_100000210206 [0,2,0,0,0,0|2,0,0]=4 22111 B12R1.233 CC(C)Sc1ccc(cc1F)Cl 62a_100000210206_100011216042 [0,2,0,0,0,0|2,0,0]=4 22112 B12R1.233 CC(C)Sc1ccc(cc1F)Cl 62a_100011216042_100000210206 [0,2,0,0,0,0|2,0,0]=4 22113 B12R1.233 CC(C)Sc1ccc(cc1F)F 62a_100000210206_100000750030 [0,2,0,0,0,0|2,0,0]=4 22114 B12R1.233 CC(C)Sc1ccc(cc1F)F 62a_100000750030_100000210206 [0,2,0,0,0,0|2,0,0]=4 22115 B12R1.233 CC(C)Sc1ccc(cc1F)N 62a_100000210206_100011356925 [0,2,0,0,0,0|2,0,0]=4 22116 B12R1.233 CC(C)Sc1ccc(cc1F)N 62a_100011356925_100000210206 [0,2,0,0,0,0|2,0,0]=4 22117 B12R1.233 CC(C)Sc1ccc(cc1F)O 62a_100000210206_100000755031 [0,2,0,0,0,0|2,0,0]=4 22118 B12R1.233 CC(C)Sc1ccc(cc1F)O 62a_100000755031_100000210206 [0,2,0,0,0,0|2,0,0]=4 22119 B12R1.233 CC(C)Sc1ccc(cc1N)Br 62a_100000210206_100000743836 [0,2,0,0,0,0|2,0,0]=4 22120 B12R1.233 CC(C)Sc1ccc(cc1N)Br 62a_100000743836_100000210206 [0,2,0,0,0,0|2,0,0]=4 22121 B12R1.233 CC(C)Sc1ccc(cc1N)Cl 62a_100000210206_100000761886 [0,2,0,0,0,0|2,0,0]=4 22122 B12R1.233 CC(C)Sc1ccc(cc1N)Cl 62a_100000761886_100000210206 [0,2,0,0,0,0|2,0,0]=4 22123 B12R1.233 CC(C)Sc1ccc(cc1N)F 62a_100000210206_100000687223 [0,2,0,0,0,0|2,0,0]=4 22124 B12R1.233 CC(C)Sc1ccc(cc1N)F 62a_100000687223_100000210206 [0,2,0,0,0,0|2,0,0]=4 22125 B12R1.233 CC(C)Sc1ccc(cc1N)N 62a_100000210206_200012175722 [0,2,0,0,0,0|2,0,0]=4 22126 B12R1.233 CC(C)Sc1ccc(cc1N)N 62a_200012175722_100000210206 [0,2,0,0,0,0|2,0,0]=4 22127 B12R1.233 CC(C)Sc1ccc(cc1N)O 62a_100000210206_100011999798 [0,2,0,0,0,0|2,0,0]=4 22128 B12R1.233 CC(C)Sc1ccc(cc1N)O 62a_100011999798_100000210206 [0,2,0,0,0,0|2,0,0]=4 22129 B12R1.233 CC(C)Sc1ccc(cc1O)Br 62a_100000210206_100012344904 [0,2,0,0,0,0|1,0,0]=3 22130 B12R1.233 CC(C)Sc1ccc(cc1O)Br 62a_100012344904_100000210206 [0,2,0,0,0,0|1,0,0]=3 22131 B12R1.233 CC(C)Sc1ccc(cc1O)Cl 62a_100000050036_100000210206 [0,2,0,0,0,0|1,0,0]=3 22132 B12R1.233 CC(C)Sc1ccc(cc1O)Cl 62a_100000210206_100000050036 [0,2,0,0,0,0|1,0,0]=3 22133 B12R1.233 CC(C)Sc1ccc(cc1O)F 62a_100000210206_100000690578 [0,2,0,0,0,0|1,0,0]=3 22134 B12R1.233 CC(C)Sc1ccc(cc1O)F 62a_100000690578_100000210206 [0,2,0,0,0,0|1,0,0]=3 22135 B12R1.233 CC(C)Sc1ccc(cc1O)O 62a_100000210206_100009813921 [0,2,0,0,0,0|1,0,0]=3 22136 B12R1.233 CC(C)Sc1ncc(cc1O)Br 62a_100000210206_100010210634 [0,2,0,0,0,0|2,0,0]=4 22137 B12R1.233 CC(C)Sc1ncc(cc1O)Br 62a_100010210634_100000210206 [0,2,0,0,0,0|2,0,0]=4 22138 B12R1.233 CC(C)Sc1ncc(cc1O)Cl 62a_100000210206_100010233512 [0,2,0,0,0,0|2,0,0]=4 22139 B12R1.233 CC(C)Sc1ncc(cc1O)Cl 62a_100010233512_100000210206 [0,2,0,0,0,0|2,0,0]=4 22140 B12R1.233 CC(C)Sc1ncc(cc1O)F 62a_100000210206_100000079967 [0,2,0,0,0,0|2,0,0]=4 22141 B12R1.233 CC(C)Sc1ncc(cc1O)F 62a_100009820119_100000210206 [0,2,0,0,0,0|2,0,0]=4 22142 B12R1.233 CN(C)Cc1ccc(cc1Br)Br 2230a_100102631434_200012351560 [0,2,0,0,0,0|2,0,0]=4 22143 B12R1.233 CN(C)Cc1ccc(cc1Br)Br 269982a_100102631434_200012351560 [0,2,0,0,0,0|2,0,0]=4 22144 B12R1.233 CN(C)Cc1ccc(cc1Br)Br 270004a_100102631434_100012351556 [0,2,0,0,0,0|2,0,0]=4 22145 B12R1.233 CN(C)Cc1ccc(cc1Br)Cl 2230a_100102631434_100000755608 [0,2,0,0,0,0|2,0,0]=4 22146 B12R1.233 CN(C)Cc1ccc(cc1Br)Cl 269982a_100102631434_100000755608 [0,2,0,0,0,0|2,0,0]=4 22147 B12R1.233 CN(C)Cc1ccc(cc1Br)Cl 270004a_100102631434_100000687667 [0,2,0,0,0,0|2,0,0]=4 22148 B12R1.233 CN(C)Cc1ccc(cc1Br)F 2230a_100102631434_100000243222 [0,2,0,0,0,0|2,0,0]=4 22149 B12R1.233 CN(C)Cc1ccc(cc1Br)F 2230a_200011192132_200000210301 [0,2,0,0,0,0|2,0,0]=4 22150 B12R1.233 CN(C)Cc1ccc(cc1Br)F 269982a_100102631434_100000243222 [0,2,0,0,0,0|2,0,0]=4 22151 B12R1.233 CN(C)Cc1ccc(cc1Br)F 269982a_200011192132_200000210301 [0,2,0,0,0,0|2,0,0]=4 22152 B12R1.233 CN(C)Cc1ccc(cc1Br)F 270004a_100102631434_100000685661 [0,2,0,0,0,0|2,0,0]=4 22153 B12R1.233 CN(C)Cc1ccc(cc1Br)F 34a_200011192132_200000210301 [0,2,0,0,0,0|2,0,0]=4 22154 B12R1.233 CN(C)Cc1ccc(cc1Br)I 2230a_100102631434_100010146610 [0,2,0,0,0,0|2,0,0]=4 22155 B12R1.233 CN(C)Cc1ccc(cc1Br)I 269982a_100102631434_100010146610 [0,2,0,0,0,0|2,0,0]=4 22156 B12R1.233 CN(C)Cc1ccc(cc1Cl)Br 2230a_100102631434_100011740631 [0,2,0,0,0,0|2,0,0]=4 22157 B12R1.233 CN(C)Cc1ccc(cc1Cl)Br 269982a_100102631434_100011740631 [0,2,0,0,0,0|2,0,0]=4 22158 B12R1.233 CN(C)Cc1ccc(cc1Cl)Br 270004a_100102631434_100000764164 [0,2,0,0,0,0|2,0,0]=4 22159 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 2230a_100015189987_200000210301 [0,2,0,0,0,0|2,0,0]=4 22160 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 2230a_100102631434_100000188473 [0,2,0,0,0,0|2,0,0]=4 22161 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 269982a_100015189987_200000210301 [0,2,0,0,0,0|2,0,0]=4 22162 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 269982a_100102631434_100000188473 [0,2,0,0,0,0|2,0,0]=4 22163 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 270004a_100102631434_100000188887 [0,2,0,0,0,0|2,0,0]=4 22164 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 34a_100015189987_200000210301 [0,2,0,0,0,0|2,0,0]=4 22165 B12R1.233 CN(C)Cc1ccc(cc1Cl)F 2230a_100102631434_100011216360 [0,2,0,0,0,0|2,0,0]=4 22166 B12R1.233 CN(C)Cc1ccc(cc1Cl)F 269982a_100102631434_100011216360 [0,2,0,0,0,0|2,0,0]=4 22167 B12R1.233 CN(C)Cc1ccc(cc1Cl)F 270004a_100102631434_100000752949 [0,2,0,0,0,0|2,0,0]=4 22168 B12R1.233 CN(C)Cc1ccc(cc1F)Br 2230a_100102631434_100000211606 [0,2,0,0,0,0|2,0,0]=4 22169 B12R1.233 CN(C)Cc1ccc(cc1F)Br 269982a_100102631434_100000211606 [0,2,0,0,0,0|2,0,0]=4 22170 B12R1.233 CN(C)Cc1ccc(cc1F)Br 270004a_100102631434_100000211676 [0,2,0,0,0,0|2,0,0]=4 22171 B12R1.233 CN(C)Cc1ccc(cc1F)Cl 2230a_100102631434_100000709361 [0,2,0,0,0,0|2,0,0]=4 22172 B12R1.233 CN(C)Cc1ccc(cc1F)Cl 269982a_100102631434_100000709361 [0,2,0,0,0,0|2,0,0]=4 22173 B12R1.233 CN(C)Cc1ccc(cc1F)Cl 270004a_100102631434_100000697372 [0,2,0,0,0,0|2,0,0]=4 22174 B12R1.233 CN(C)Cc1ccc(cc1F)F 2230a_100000207661_200000210301 [0,2,0,0,0,0|2,0,0]=4 22175 B12R1.233 CN(C)Cc1ccc(cc1F)F 2230a_100102631434_100000748237 [0,2,0,0,0,0|2,0,0]=4 22176 B12R1.233 CN(C)Cc1ccc(cc1F)F 269982a_100000207661_200000210301 [0,2,0,0,0,0|2,0,0]=4 22177 B12R1.233 CN(C)Cc1ccc(cc1F)F 269982a_100102631434_100000748237 [0,2,0,0,0,0|2,0,0]=4 22178 B12R1.233 CN(C)Cc1ccc(cc1F)F 270004a_100102631434_100000211964 [0,2,0,0,0,0|2,0,0]=4 22179 B12R1.233 CN(C)Cc1ccc(cc1F)F 34a_100000207661_200000210301 [0,2,0,0,0,0|2,0,0]=4 22180 B12R1.233 CN(C)Cc1ccc(cc1F)I 2230a_100102631434_100010244991 [0,2,0,0,0,0|2,0,0]=4 22181 B12R1.233 CN(C)Cc1ccc(cc1F)I 269982a_100102631434_100010244991 [0,2,0,0,0,0|2,0,0]=4 22182 B12R1.233 CN(C)Cc1ccc(cc1F)O 271570a_203496583355_100000174744 [0,2,0,0,0,0|2,0,0]=4 22183 B12R1.233 CN(C)Cc1ccc(cc1I)Br 2230a_100102631434_100010146615 [0,2,0,0,0,0|2,0,0]=4 22184 B12R1.233 CN(C)Cc1ccc(cc1I)Br 269982a_100102631434_100010146615 [0,2,0,0,0,0|2,0,0]=4 22185 B12R1.233 CN(C)Cc1ccc(cc1I)Br 270004a_100102631434_100010146562 [0,2,0,0,0,0|2,0,0]=4 22186 B12R1.233 CN(C)Cc1ccc(cc1I)Cl 2230a_100102631434_100010254388 [0,2,0,0,0,0|2,0,0]=4 22187 B12R1.233 CN(C)Cc1ccc(cc1I)Cl 269982a_100102631434_100010254388 [0,2,0,0,0,0|2,0,0]=4 22188 B12R1.233 CN(C)Cc1ccc(cc1I)F 2230a_100102631434_100012354799 [0,2,0,0,0,0|2,0,0]=4 22189 B12R1.233 CN(C)Cc1ccc(cc1I)F 269982a_100102631434_100012354799 [0,2,0,0,0,0|2,0,0]=4 22190 B12R1.233 CN([13CH3])Cc1ccc(cc1Br)F 2230a_200011192132_200025704644 [0,2,0,0,0,0|2,0,0]=4 22191 B12R1.233 CN([13CH3])Cc1ccc(cc1Br)F 269982a_200011192132_200025704644 [0,2,0,0,0,0|2,0,0]=4 22192 B12R1.233 CN([13CH3])Cc1ccc(cc1Br)F 34a_200011192132_200025704644 [0,2,0,0,0,0|2,0,0]=4 22193 B12R1.233 CN([13CH3])Cc1ccc(cc1Cl)Cl 2230a_100015189987_200025704644 [0,2,0,0,0,0|2,0,0]=4 22194 B12R1.233 CN([13CH3])Cc1ccc(cc1Cl)Cl 269982a_100015189987_200025704644 [0,2,0,0,0,0|2,0,0]=4 22195 B12R1.233 CN([13CH3])Cc1ccc(cc1Cl)Cl 34a_100015189987_200025704644 [0,2,0,0,0,0|2,0,0]=4 22196 B12R1.233 CN([13CH3])Cc1ccc(cc1F)F 2230a_100000207661_200025704644 [0,2,0,0,0,0|2,0,0]=4 22197 B12R1.233 CN([13CH3])Cc1ccc(cc1F)F 269982a_100000207661_200025704644 [0,2,0,0,0,0|2,0,0]=4 22198 B12R1.233 CN([13CH3])Cc1ccc(cc1F)F 34a_100000207661_200025704644 [0,2,0,0,0,0|2,0,0]=4 22199 B12R1.233 Cc1cc(c(cn1)SC(C)C)O 62a_100000210206_100011016184 [0,2,0,0,0,0|2,0,0]=4 22200 B12R1.233 Cc1cc(c(cn1)SC(C)C)O 62a_100011016184_100000210206 [0,2,0,0,0,0|2,0,0]=4 22201 B12R1.233 Cc1cc(ccc1CC(=O)[13CH3])Br 1458a_100000697930_200025704644 [0,2,0,0,0,0|1,0,1]=4 22202 B12R1.233 Cc1cc(ccc1CC(=O)[13CH3])F 1458a_100011667441_200025704644 [0,2,0,0,0,0|1,0,1]=4 22203 B12R1.233 Cc1cc(ccc1CN(C)C)Br 2230a_100102631434_100000708836 [0,2,0,0,0,0|2,0,0]=4 22204 B12R1.233 Cc1cc(ccc1CN(C)C)Br 269982a_100102631434_100000708836 [0,2,0,0,0,0|2,0,0]=4 22205 B12R1.233 Cc1cc(ccc1CN(C)C)Br 270004a_100102631434_100000687586 [0,2,0,0,0,0|2,0,0]=4 22206 B12R1.233 Cc1cc(ccc1CN(C)C)Cl 2230a_100102631434_100012361307 [0,2,0,0,0,0|2,0,0]=4 22207 B12R1.233 Cc1cc(ccc1CN(C)C)Cl 269982a_100102631434_100012361307 [0,2,0,0,0,0|2,0,0]=4 22208 B12R1.233 Cc1cc(ccc1CN(C)C)Cl 270004a_100102631434_100000766358 [0,2,0,0,0,0|2,0,0]=4 22209 B12R1.233 Cc1cc(ccc1CN(C)C)F 2230a_100102631434_100000700533 [0,2,0,0,0,0|2,0,0]=4 22210 B12R1.233 Cc1cc(ccc1CN(C)C)F 269982a_100102631434_100000700533 [0,2,0,0,0,0|2,0,0]=4 22211 B12R1.233 Cc1cc(ccc1CN(C)C)F 270004a_100102631434_100000745986 [0,2,0,0,0,0|2,0,0]=4 22212 B12R1.233 Cc1cc(ccc1NC(C)C)Br 34a_100000211769_100000210206 [0,2,0,0,0,0|2,0,0]=4 22213 B12R1.233 Cc1cc(ccc1NC(C)C)Br 7a_100000211769_100000210206 [0,2,0,0,0,0|2,0,0]=4 22214 B12R1.233 Cc1cc(ccc1NC(C)C)Cl 34a_100000210418_100000210206 [0,2,0,0,0,0|2,0,0]=4 22215 B12R1.233 Cc1cc(ccc1NC(C)C)Cl 7a_100000210418_100000210206 [0,2,0,0,0,0|2,0,0]=4 22216 B12R1.233 Cc1cc(ccc1NC(C)C)F 34a_100000211637_100000210206 [0,2,0,0,0,0|2,0,0]=4 22217 B12R1.233 Cc1cc(ccc1NC(C)C)F 7a_100000211637_100000210206 [0,2,0,0,0,0|2,0,0]=4 22218 B12R1.233 Cc1cc(ccc1NC(C)C)I 34a_100000184554_100000210206 [0,2,0,0,0,0|2,0,0]=4 22219 B12R1.233 Cc1cc(ccc1NC(C)C)I 7a_100000184554_100000210206 [0,2,0,0,0,0|2,0,0]=4 22220 B12R1.233 Cc1cc(ccc1NC(C)C)O 34a_100000756630_100000210206 [0,2,0,0,0,0|2,0,0]=4 22221 B12R1.233 Cc1cc(ccc1OC(C)C)Br 34a_100000186361_100000210206 [0,2,0,0,0,0|2,0,0]=4 22222 B12R1.233 Cc1cc(ccc1OC(C)C)Br 7a_100000186361_100000210206 [0,2,0,0,0,0|2,0,0]=4 22223 B12R1.233 Cc1cc(ccc1OC(C)C)Cl 34a_100000211091_100000210206 [0,2,0,0,0,0|2,0,0]=4 22224 B12R1.233 Cc1cc(ccc1OC(C)C)Cl 7a_100000211091_100000210206 [0,2,0,0,0,0|2,0,0]=4 22225 B12R1.233 Cc1cc(ccc1OC(C)C)F 34a_100000764316_100000210206 [0,2,0,0,0,0|2,0,0]=4 22226 B12R1.233 Cc1cc(ccc1OC(C)C)F 7a_100000764316_100000210206 [0,2,0,0,0,0|2,0,0]=4 22227 B12R1.233 Cc1cc(ccc1OC(C)C)I 34a_100011218673_100000210206 [0,2,0,0,0,0|2,0,0]=4 22228 B12R1.233 Cc1cc(ccc1OC(C)C)I 7a_100011218673_100000210206 [0,2,0,0,0,0|2,0,0]=4 22229 B12R1.233 Cc1cc(ccc1OC(C)C)N 34a_100011218179_100000210206 [0,2,0,0,0,0|2,0,0]=4 22230 B12R1.233 Cc1cc(ccc1OC(C)C)N 7a_100011218179_100000210206 [0,2,0,0,0,0|2,0,0]=4 22231 B12R1.233 Cc1cc(ccc1OC(C)C)O 271570a_203496583355_200011825982 [0,2,0,0,0,0|2,0,0]=4 22232 B12R1.233 Cc1cc(ccc1SC(C)C)Br 62a_100000210206_100000701812 [0,2,0,0,0,0|2,0,0]=4 22233 B12R1.233 Cc1cc(ccc1SC(C)C)Br 62a_100000701812_100000210206 [0,2,0,0,0,0|2,0,0]=4 22234 B12R1.233 Cc1cc(ccc1SC(C)C)Cl 62a_100000210206_100011219607 [0,2,0,0,0,0|2,0,0]=4 22235 B12R1.233 Cc1cc(ccc1SC(C)C)Cl 62a_100011219607_100000210206 [0,2,0,0,0,0|2,0,0]=4 22236 B12R1.233 Cc1cc(ccc1SC(C)C)F 62a_100000210206_100011205405 [0,2,0,0,0,0|2,0,0]=4 22237 B12R1.233 Cc1cc(ccc1SC(C)C)F 62a_100011205405_100000210206 [0,2,0,0,0,0|2,0,0]=4 22238 B12R1.233 Cc1cc(ccc1SC(C)C)N 62a_100000210206_100000210723 [0,2,0,0,0,0|2,0,0]=4 22239 B12R1.233 Cc1cc(ccc1SC(C)C)N 62a_100000210723_100000210206 [0,2,0,0,0,0|2,0,0]=4 22240 B12R1.233 Cc1cc(ccc1SC(C)C)O 62a_100000210206_100000690111 [0,2,0,0,0,0|2,0,0]=4 22241 B12R1.233 Cc1ccc(c(c1)Br)CN(C)C 270004a_100102631434_100000692596 [0,2,0,0,0,0|2,0,0]=4 22242 B12R1.233 Cc1ccc(c(c1)Br)NC(C)C 34a_100000210942_100000210206 [0,2,0,0,0,0|2,0,0]=4 22243 B12R1.233 Cc1ccc(c(c1)Br)OC(C)C 34a_100000210800_100000210206 [0,2,0,0,0,0|2,0,0]=4 22244 B12R1.233 Cc1ccc(c(c1)Br)OC(C)C 7a_100000210800_100000210206 [0,2,0,0,0,0|2,0,0]=4 22245 B12R1.233 Cc1ccc(c(c1)Br)SC(C)C 62a_100000210206_100009813563 [0,2,0,0,0,0|2,0,0]=4 22246 B12R1.233 Cc1ccc(c(c1)Br)SC(C)C 62a_100009813563_100000210206 [0,2,0,0,0,0|2,0,0]=4 22247 B12R1.233 Cc1ccc(c(c1)C)CC(=O)[13CH3] 1458a_100011236500_200025704644 [0,2,0,0,0,0|1,0,1]=4 22248 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 2230a_100025771030_200000210301 [0,2,0,0,0,0|2,0,0]=4 22249 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 2230a_100102631434_100011219618 [0,2,0,0,0,0|2,0,0]=4 22250 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 269982a_100025771030_200000210301 [0,2,0,0,0,0|2,0,0]=4 22251 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 269982a_100102631434_100011219618 [0,2,0,0,0,0|2,0,0]=4 22252 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 270004a_100102631434_100000211342 [0,2,0,0,0,0|2,0,0]=4 22253 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 34a_100025771030_200000210301 [0,2,0,0,0,0|2,0,0]=4 22254 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 2230a_100025771030_200025704644 [0,2,0,0,0,0|2,0,0]=4 22255 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 269982a_100025771030_200025704644 [0,2,0,0,0,0|2,0,0]=4 22256 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 34a_100025771030_200025704644 [0,2,0,0,0,0|2,0,0]=4 22257 B12R1.233 Cc1ccc(c(c1)C)NC(C)C 34a_100000736561_100000210206 [0,2,0,0,0,0|2,0,0]=4 22258 B12R1.233 Cc1ccc(c(c1)C)NC(C)C 7a_100000736561_100000210206 [0,2,0,0,0,0|2,0,0]=4 22259 B12R1.233 Cc1ccc(c(c1)C)OC(C)C 34a_100000211776_100000210206 [0,2,0,0,0,0|2,0,0]=4 22260 B12R1.233 Cc1ccc(c(c1)C)OC(C)C 7a_100000211776_100000210206 [0,2,0,0,0,0|2,0,0]=4 22261 B12R1.233 Cc1ccc(c(c1)C)SC(C)C 62a_100000210206_100011217332 [0,2,0,0,0,0|2,0,0]=4 22262 B12R1.233 Cc1ccc(c(c1)C)SC(C)C 62a_100011217332_100000210206 [0,2,0,0,0,0|2,0,0]=4 22263 B12R1.233 Cc1ccc(c(c1)Cl)CN(C)C 2230a_100102631434_100012349684 [0,2,0,0,0,0|2,0,0]=4 22264 B12R1.233 Cc1ccc(c(c1)Cl)CN(C)C 269982a_100102631434_100012349684 [0,2,0,0,0,0|2,0,0]=4 22265 B12R1.233 Cc1ccc(c(c1)Cl)CN(C)C 270004a_100102631434_100011935181 [0,2,0,0,0,0|2,0,0]=4 22266 B12R1.233 Cc1ccc(c(c1)Cl)NC(C)C 34a_100000210522_100000210206 [0,2,0,0,0,0|2,0,0]=4 22267 B12R1.233 Cc1ccc(c(c1)Cl)OC(C)C 34a_100000749699_100000210206 [0,2,0,0,0,0|2,0,0]=4 22268 B12R1.233 Cc1ccc(c(c1)Cl)OC(C)C 7a_100000749699_100000210206 [0,2,0,0,0,0|2,0,0]=4 22269 B12R1.233 Cc1ccc(c(c1)Cl)SC(C)C 62a_100000210206_100011263221 [0,2,0,0,0,0|2,0,0]=4 22270 B12R1.233 Cc1ccc(c(c1)Cl)SC(C)C 62a_100011263221_100000210206 [0,2,0,0,0,0|2,0,0]=4 22271 B12R1.233 Cc1ccc(c(c1)F)CC(=O)[13CH3] 1458a_100000042674_200025704644 [0,2,0,0,0,0|1,0,1]=4 22272 B12R1.233 Cc1ccc(c(c1)F)CN(C)C 2230a_100102631434_100011217900 [0,2,0,0,0,0|2,0,0]=4 22273 B12R1.233 Cc1ccc(c(c1)F)CN(C)C 269982a_100102631434_100011217900 [0,2,0,0,0,0|2,0,0]=4 22274 B12R1.233 Cc1ccc(c(c1)F)CN(C)C 270004a_100102631434_100011217368 [0,2,0,0,0,0|2,0,0]=4 22275 B12R1.233 Cc1ccc(c(c1)F)NC(C)C 34a_100000211023_100000210206 [0,2,0,0,0,0|2,0,0]=4 22276 B12R1.233 Cc1ccc(c(c1)F)OC(C)C 34a_100011216688_100000210206 [0,2,0,0,0,0|2,0,0]=4 22277 B12R1.233 Cc1ccc(c(c1)F)OC(C)C 7a_100011216688_100000210206 [0,2,0,0,0,0|2,0,0]=4 22278 B12R1.233 Cc1ccc(c(c1)F)SC(C)C 62a_100000210206_100011216119 [0,2,0,0,0,0|2,0,0]=4 22279 B12R1.233 Cc1ccc(c(c1)F)SC(C)C 62a_100011216119_100000210206 [0,2,0,0,0,0|2,0,0]=4 22280 B12R1.233 Cc1ccc(c(c1)I)CN(C)C 270004a_100102631434_100010150104 [0,2,0,0,0,0|2,0,0]=4 22281 B12R1.233 Cc1ccc(c(c1)I)NC(C)C 34a_100011356834_100000210206 [0,2,0,0,0,0|2,0,0]=4 22282 B12R1.233 Cc1ccc(c(c1)I)OC(C)C 34a_100000765521_100000210206 [0,2,0,0,0,0|2,0,0]=4 22283 B12R1.233 Cc1ccc(c(c1)I)OC(C)C 7a_100000765521_100000210206 [0,2,0,0,0,0|2,0,0]=4 22284 B12R1.233 Cc1ccc(c(c1)N)OC(C)C 34a_100011215204_100000210206 [0,2,0,0,0,0|2,0,0]=4 22285 B12R1.233 Cc1ccc(c(c1)N)OC(C)C 7a_100011215204_100000210206 [0,2,0,0,0,0|2,0,0]=4 22286 B12R1.233 Cc1ccc(c(c1)N)SC(C)C 62a_100000210206_100011216686 [0,2,0,0,0,0|2,0,0]=4 22287 B12R1.233 Cc1ccc(c(c1)N)SC(C)C 62a_100011216686_100000210206 [0,2,0,0,0,0|2,0,0]=4 22288 B12R1.233 Cc1ccc(c(c1)O)NC(C)C 34a_100000211527_100000210206 [0,2,0,0,0,0|1,0,0]=3 22289 B12R1.233 Cc1ccc(c(c1)O)SC(C)C 62a_100000210206_100012002257 [0,2,0,0,0,0|1,0,0]=3 22290 B12R1.233 Cc1ccc(c(c1)O)SC(C)C 62a_100012002257_100000210206 [0,2,0,0,0,0|1,0,0]=3 22291 B12R1.233 Cc1ccc(c(n1)O)SC(C)C 62a_100000210206_100009817604 [0,2,0,0,0,0|2,0,0]=4 22292 B12R1.233 Cc1ccc(c(n1)O)SC(C)C 62a_100009817604_100000210206 [0,2,0,0,0,0|2,0,0]=4 22293 B12R1.233 Cc1cnc(c(c1)O)OC(C)C 271570a_203496583355_200012348018 [0,2,0,0,0,0|2,0,0]=4 22294 B12R1.233 Cc1cnc(c(c1)O)SC(C)C 62a_100000210206_100012000487 [0,2,0,0,0,0|2,0,0]=4 22295 B12R1.233 Oc1cc(ccc1OC(F)F)F 271570a_203496583355_100000179093 [0,2,0,0,0,0|2,0,0]=4 22296 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_200025704644 [0,2,0,0,0,0|1,0,1]=4 22297 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_200025704644 [0,2,0,0,0,0|1,0,1]=4 22298 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)F 1458a_100000708238_200025704644 [0,2,0,0,0,0|1,0,1]=4 22299 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200025704644 [0,2,0,0,0,0|1,0,1]=4 22300 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_200025704644 [0,2,0,0,0,0|1,0,1]=4 22301 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_200025704644 [0,2,0,0,0,0|1,0,1]=4 22302 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_200025704644 [0,2,0,0,0,0|1,0,1]=4 22303 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)Br 1458a_100011295475_200025704644 [0,2,0,0,0,0|1,0,1]=4 22304 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_200025704644 [0,2,0,0,0,0|1,0,1]=4 22305 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)F 1458a_100000684719_200025704644 [0,2,0,0,0,0|1,0,1]=4 22306 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)I 1458a_100010149628_200025704644 [0,2,0,0,0,0|1,0,1]=4 22307 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)O 1458a_100000090534_200025704644 [0,2,0,0,0,0|1,0,1]=4 22308 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1O)Br 1458a_100000707504_200025704644 [0,2,0,0,0,0|0,0,1]=3 22309 B12R1.1095 CC=Cc1c(cc(cc1F)F)O 271570a_100016259895_100009815984 [0,2,0,0,0,0|0,0,2]=4 22310 B12R1.1095 CC=Cc1c(cc(cc1O)C)C 271570a_100016259895_100010342985 [0,2,0,0,0,0|0,0,2]=4 22311 B12R1.1095 CC=Cc1c(cc(cc1O)Cl)C 271570a_100016259895_100010254216 [0,2,0,0,0,0|0,0,2]=4 22312 B12R1.1095 CC=Cc1c(cc(cc1O)O)O 271570a_100016259895_200010341185 [0,2,0,0,0,0|0,0,2]=4 22313 B12R1.1095 CCNc1c(cc(cc1Br)Br)C 34a_100012047207_100000210202 [0,2,0,0,0,0|2,0,0]=4 22314 B12R1.1095 CCNc1c(cc(cc1Br)Br)C 7a_100012047207_100000210202 [0,2,0,0,0,0|2,0,0]=4 22315 B12R1.1095 CCNc1c(cc(cc1Br)Br)Cl 34a_100011216035_100000210202 [0,2,0,0,0,0|2,0,0]=4 22316 B12R1.1095 CCNc1c(cc(cc1Br)Br)F 34a_100011215609_100000210202 [0,2,0,0,0,0|2,0,0]=4 22317 B12R1.1095 CCNc1c(cc(cc1Br)C)Br 34a_100000184052_100000210202 [0,2,0,0,0,0|2,0,0]=4 22318 B12R1.1095 CCNc1c(cc(cc1Br)C)C 34a_100000688863_100000210202 [0,2,0,0,0,0|2,0,0]=4 22319 B12R1.1095 CCNc1c(cc(cc1Br)C)Cl 34a_100012339639_100000210202 [0,2,0,0,0,0|2,0,0]=4 22320 B12R1.1095 CCNc1c(cc(cc1Br)C)F 34a_100012353694_100000210202 [0,2,0,0,0,0|2,0,0]=4 22321 B12R1.1095 CCNc1c(cc(cc1Br)Cl)Br 34a_100000724118_100000210202 [0,2,0,0,0,0|2,0,0]=4 22322 B12R1.1095 CCNc1c(cc(cc1Br)Cl)C 34a_100012353696_100000210202 [0,2,0,0,0,0|2,0,0]=4 22323 B12R1.1095 CCNc1c(cc(cc1Br)Cl)C 7a_100012353696_100000210202 [0,2,0,0,0,0|2,0,0]=4 22324 B12R1.1095 CCNc1c(cc(cc1Br)Cl)Cl 34a_100011218119_100000210202 [0,2,0,0,0,0|2,0,0]=4 22325 B12R1.1095 CCNc1c(cc(cc1Br)Cl)F 34a_100011217455_100000210202 [0,2,0,0,0,0|2,0,0]=4 22326 B12R1.1095 CCNc1c(cc(cc1Br)F)Br 34a_100000211720_100000210202 [0,2,0,0,0,0|2,0,0]=4 22327 B12R1.1095 CCNc1c(cc(cc1Br)F)C 34a_100011216670_100000210202 [0,2,0,0,0,0|2,0,0]=4 22328 B12R1.1095 CCNc1c(cc(cc1Br)F)C 7a_100011216670_100000210202 [0,2,0,0,0,0|2,0,0]=4 22329 B12R1.1095 CCNc1c(cc(cc1Br)F)Cl 34a_100000694656_100000210202 [0,2,0,0,0,0|2,0,0]=4 22330 B12R1.1095 CCNc1c(cc(cc1Br)F)F 34a_100000211602_100000210202 [0,2,0,0,0,0|2,0,0]=4 22331 B12R1.1095 CCNc1c(cc(cc1C)Br)C 34a_100000737279_100000210202 [0,2,0,0,0,0|2,0,0]=4 22332 B12R1.1095 CCNc1c(cc(cc1C)Br)C 7a_100000737279_100000210202 [0,2,0,0,0,0|2,0,0]=4 22333 B12R1.1095 CCNc1c(cc(cc1C)C)C 34a_100000210045_100000210202 [0,2,0,0,0,0|2,0,0]=4 22334 B12R1.1095 CCNc1c(cc(cc1C)C)C 7a_100000210045_100000210202 [0,2,0,0,0,0|2,0,0]=4 22335 B12R1.1095 CCNc1c(cc(cc1C)Cl)C 34a_100000692879_100000210202 [0,2,0,0,0,0|2,0,0]=4 22336 B12R1.1095 CCNc1c(cc(cc1C)Cl)C 7a_100000692879_100000210202 [0,2,0,0,0,0|2,0,0]=4 22337 B12R1.1095 CCNc1c(cc(cc1C)F)C 34a_100011290887_100000210202 [0,2,0,0,0,0|2,0,0]=4 22338 B12R1.1095 CCNc1c(cc(cc1C)F)C 7a_100011290887_100000210202 [0,2,0,0,0,0|2,0,0]=4 22339 B12R1.1095 CCNc1c(cc(cc1C)I)C 7a_100011356821_100000210202 [0,2,0,0,0,0|2,0,0]=4 22340 B12R1.1095 CCNc1c(cc(cc1C)O)C 34a_100011934200_100000210202 [0,2,0,0,0,0|2,0,0]=4 22341 B12R1.1095 CCNc1c(cc(cc1Cl)Br)C 34a_100000741131_100000210202 [0,2,0,0,0,0|2,0,0]=4 22342 B12R1.1095 CCNc1c(cc(cc1Cl)Br)C 7a_100000741131_100000210202 [0,2,0,0,0,0|2,0,0]=4 22343 B12R1.1095 CCNc1c(cc(cc1Cl)Br)Cl 34a_100000211608_100000210202 [0,2,0,0,0,0|2,0,0]=4 22344 B12R1.1095 CCNc1c(cc(cc1Cl)Br)F 34a_100000725741_100000210202 [0,2,0,0,0,0|2,0,0]=4 22345 B12R1.1095 CCNc1c(cc(cc1Cl)Br)F 7a_100000725741_100000210202 [0,2,0,0,0,0|2,0,0]=4 22346 B12R1.1095 CCNc1c(cc(cc1Cl)C)C 34a_100000211461_100000210202 [0,2,0,0,0,0|2,0,0]=4 22347 B12R1.1095 CCNc1c(cc(cc1Cl)C)C 7a_100000211461_100000210202 [0,2,0,0,0,0|2,0,0]=4 22348 B12R1.1095 CCNc1c(cc(cc1Cl)C)Cl 34a_100011996032_100000210202 [0,2,0,0,0,0|2,0,0]=4 22349 B12R1.1095 CCNc1c(cc(cc1Cl)C)O 34a_100015906060_100000210202 [0,2,0,0,0,0|1,0,0]=3 22350 B12R1.1095 CCNc1c(cc(cc1Cl)Cl)C 34a_100011215104_100000210202 [0,2,0,0,0,0|2,0,0]=4 22351 B12R1.1095 CCNc1c(cc(cc1Cl)Cl)C 7a_100011215104_100000210202 [0,2,0,0,0,0|2,0,0]=4 22352 B12R1.1095 CCNc1c(cc(cc1Cl)Cl)Cl 34a_100000210601_100000210202 [0,2,0,0,0,0|2,0,0]=4 22353 B12R1.1095 CCNc1c(cc(cc1Cl)Cl)F 34a_100000688862_100000210202 [0,2,0,0,0,0|2,0,0]=4 22354 B12R1.1095 CCNc1c(cc(cc1Cl)Cl)F 7a_100000688862_100000210202 [0,2,0,0,0,0|2,0,0]=4 22355 B12R1.1095 CCNc1c(cc(cc1Cl)F)C 34a_100000725997_100000210202 [0,2,0,0,0,0|2,0,0]=4 22356 B12R1.1095 CCNc1c(cc(cc1Cl)F)C 7a_100000725997_100000210202 [0,2,0,0,0,0|2,0,0]=4 22357 B12R1.1095 CCNc1c(cc(cc1Cl)F)Cl 34a_100000688861_100000210202 [0,2,0,0,0,0|2,0,0]=4 22358 B12R1.1095 CCNc1c(cc(cc1Cl)F)F 34a_100000688773_100000210202 [0,2,0,0,0,0|2,0,0]=4 22359 B12R1.1095 CCNc1c(cc(cc1F)Br)C 34a_100000709789_100000210202 [0,2,0,0,0,0|2,0,0]=4 22360 B12R1.1095 CCNc1c(cc(cc1F)Br)C 7a_100000709789_100000210202 [0,2,0,0,0,0|2,0,0]=4 22361 B12R1.1095 CCNc1c(cc(cc1F)Br)F 34a_100000758902_100000210202 [0,2,0,0,0,0|2,0,0]=4 22362 B12R1.1095 CCNc1c(cc(cc1F)Br)F 7a_100000758902_100000210202 [0,2,0,0,0,0|2,0,0]=4 22363 B12R1.1095 CCNc1c(cc(cc1F)Br)O 34a_100015475841_100000210202 [0,2,0,0,0,0|1,0,0]=3 22364 B12R1.1095 CCNc1c(cc(cc1F)Cl)C 34a_100012017672_100000210202 [0,2,0,0,0,0|2,0,0]=4 22365 B12R1.1095 CCNc1c(cc(cc1F)Cl)C 7a_100012017672_100000210202 [0,2,0,0,0,0|2,0,0]=4 22366 B12R1.1095 CCNc1c(cc(cc1F)Cl)F 34a_100000695146_100000210202 [0,2,0,0,0,0|2,0,0]=4 22367 B12R1.1095 CCNc1c(cc(cc1F)Cl)F 7a_100000695146_100000210202 [0,2,0,0,0,0|2,0,0]=4 22368 B12R1.1095 CCNc1c(cc(cc1F)Cl)O 34a_100010883250_100000210202 [0,2,0,0,0,0|1,0,0]=3 22369 B12R1.1095 CCNc1c(cc(cc1F)Cl)O 7a_100010883250_100000210202 [0,2,0,0,0,0|1,0,0]=3 22370 B12R1.1095 CCNc1c(cc(cc1F)F)F 34a_100000760425_100000210202 [0,2,0,0,0,0|2,0,0]=4 22371 B12R1.1095 CCNc1c(cc(cc1F)F)O 34a_100011217947_100000210202 [0,2,0,0,0,0|1,0,0]=3 22372 B12R1.1095 CCNc1c(cc(cc1F)F)O 7a_100011217947_100000210202 [0,2,0,0,0,0|1,0,0]=3 22373 B12R1.1095 CCNc1c(cc(cc1F)I)F 34a_100012353610_100000210202 [0,2,0,0,0,0|2,0,0]=4 22374 B12R1.1095 CCNc1c(cc(cc1F)O)F 34a_100000036573_100000210202 [0,2,0,0,0,0|2,0,0]=4 22375 B12R1.1095 CCNc1c(cc(cc1I)Br)C 7a_200000690823_100000210202 [0,2,0,0,0,0|2,0,0]=4 22376 B12R1.1095 CCNc1c(cc(cc1I)Cl)C 7a_100012344046_100000210202 [0,2,0,0,0,0|2,0,0]=4 22377 B12R1.1095 CCNc1c(cc(cc1I)F)F 34a_100102885649_100000210202 [0,2,0,0,0,0|2,0,0]=4 22378 B12R1.1095 CCNc1c(cc(cc1O)Br)C 34a_100010371313_100000210202 [0,2,0,0,0,0|1,0,0]=3 22379 B12R1.1095 CCNc1c(cc(cc1O)Br)C 7a_100010371313_100000210202 [0,2,0,0,0,0|1,0,0]=3 22380 B12R1.1095 CCOc1c(cc(cc1Br)Br)Br 34a_100000210219_100000210202 [0,2,0,0,0,0|2,0,0]=4 22381 B12R1.1095 CCOc1c(cc(cc1Br)Br)Br 7a_100000210219_100000210202 [0,2,0,0,0,0|2,0,0]=4 22382 B12R1.1095 CCOc1c(cc(cc1Br)Br)C 34a_100000186369_100000210202 [0,2,0,0,0,0|2,0,0]=4 22383 B12R1.1095 CCOc1c(cc(cc1Br)Br)C 7a_100000186369_100000210202 [0,2,0,0,0,0|2,0,0]=4 22384 B12R1.1095 CCOc1c(cc(cc1Br)Br)Cl 34a_100012337755_100000210202 [0,2,0,0,0,0|2,0,0]=4 22385 B12R1.1095 CCOc1c(cc(cc1Br)Br)Cl 7a_100012337755_100000210202 [0,2,0,0,0,0|2,0,0]=4 22386 B12R1.1095 CCOc1c(cc(cc1Br)Br)F 34a_100011216695_100000210202 [0,2,0,0,0,0|2,0,0]=4 22387 B12R1.1095 CCOc1c(cc(cc1Br)Br)F 7a_100011216695_100000210202 [0,2,0,0,0,0|2,0,0]=4 22388 B12R1.1095 CCOc1c(cc(cc1Br)Br)N 34a_100010781877_100000210202 [0,2,0,0,0,0|2,0,0]=4 22389 B12R1.1095 CCOc1c(cc(cc1Br)Br)N 7a_100010781877_100000210202 [0,2,0,0,0,0|2,0,0]=4 22390 B12R1.1095 CCOc1c(cc(cc1Br)C)Br 34a_100000203795_100000210202 [0,2,0,0,0,0|2,0,0]=4 22391 B12R1.1095 CCOc1c(cc(cc1Br)C)Br 7a_100000203795_100000210202 [0,2,0,0,0,0|2,0,0]=4 22392 B12R1.1095 CCOc1c(cc(cc1Br)C)C 34a_100011934984_100000210202 [0,2,0,0,0,0|2,0,0]=4 22393 B12R1.1095 CCOc1c(cc(cc1Br)C)C 7a_100011934984_100000210202 [0,2,0,0,0,0|2,0,0]=4 22394 B12R1.1095 CCOc1c(cc(cc1Br)C)F 34a_200010713133_100000210202 [0,2,0,0,0,0|2,0,0]=4 22395 B12R1.1095 CCOc1c(cc(cc1Br)C)F 7a_200010713133_100000210202 [0,2,0,0,0,0|2,0,0]=4 22396 B12R1.1095 CCOc1c(cc(cc1Br)Cl)Br 34a_100012337757_100000210202 [0,2,0,0,0,0|2,0,0]=4 22397 B12R1.1095 CCOc1c(cc(cc1Br)Cl)Br 7a_100012337757_100000210202 [0,2,0,0,0,0|2,0,0]=4 22398 B12R1.1095 CCOc1c(cc(cc1Br)Cl)C 34a_100012337756_100000210202 [0,2,0,0,0,0|2,0,0]=4 22399 B12R1.1095 CCOc1c(cc(cc1Br)Cl)C 7a_100012337756_100000210202 [0,2,0,0,0,0|2,0,0]=4 22400 B12R1.1095 CCOc1c(cc(cc1Br)Cl)Cl 34a_200000243811_100000210202 [0,2,0,0,0,0|2,0,0]=4 22401 B12R1.1095 CCOc1c(cc(cc1Br)Cl)Cl 7a_200000243811_100000210202 [0,2,0,0,0,0|2,0,0]=4 22402 B12R1.1095 CCOc1c(cc(cc1Br)Cl)F 34a_100011830412_100000210202 [0,2,0,0,0,0|2,0,0]=4 22403 B12R1.1095 CCOc1c(cc(cc1Br)Cl)F 7a_100011830412_100000210202 [0,2,0,0,0,0|2,0,0]=4 22404 B12R1.1095 CCOc1c(cc(cc1Br)Cl)N 34a_106741647128_100000210202 [0,2,0,0,0,0|2,0,0]=4 22405 B12R1.1095 CCOc1c(cc(cc1Br)Cl)N 7a_106741647128_100000210202 [0,2,0,0,0,0|2,0,0]=4 22406 B12R1.1095 CCOc1c(cc(cc1Br)F)Br 34a_100011215434_100000210202 [0,2,0,0,0,0|2,0,0]=4 22407 B12R1.1095 CCOc1c(cc(cc1Br)F)Br 7a_100011215434_100000210202 [0,2,0,0,0,0|2,0,0]=4 22408 B12R1.1095 CCOc1c(cc(cc1Br)F)Cl 34a_100011830411_100000210202 [0,2,0,0,0,0|2,0,0]=4 22409 B12R1.1095 CCOc1c(cc(cc1Br)F)Cl 7a_100011830411_100000210202 [0,2,0,0,0,0|2,0,0]=4 22410 B12R1.1095 CCOc1c(cc(cc1Br)F)F 34a_100000688693_100000210202 [0,2,0,0,0,0|2,0,0]=4 22411 B12R1.1095 CCOc1c(cc(cc1Br)F)F 7a_100000688693_100000210202 [0,2,0,0,0,0|2,0,0]=4 22412 B12R1.1095 CCOc1c(cc(cc1Br)F)N 34a_200011217456_100000210202 [0,2,0,0,0,0|2,0,0]=4 22413 B12R1.1095 CCOc1c(cc(cc1Br)F)N 7a_200011217456_100000210202 [0,2,0,0,0,0|2,0,0]=4 22414 B12R1.1095 CCOc1c(cc(cc1Br)I)C 34a_100010982682_100000210202 [0,2,0,0,0,0|2,0,0]=4 22415 B12R1.1095 CCOc1c(cc(cc1Br)I)C 7a_100010982682_100000210202 [0,2,0,0,0,0|2,0,0]=4 22416 B12R1.1095 CCOc1c(cc(cc1Br)N)Br 34a_200000186426_100000210202 [0,2,0,0,0,0|2,0,0]=4 22417 B12R1.1095 CCOc1c(cc(cc1Br)N)C 34a_100010064301_100000210202 [0,2,0,0,0,0|2,0,0]=4 22418 B12R1.1095 CCOc1c(cc(cc1Br)N)C 7a_100010064301_100000210202 [0,2,0,0,0,0|2,0,0]=4 22419 B12R1.1095 CCOc1c(cc(cc1C)Br)C 34a_100000187306_100000210202 [0,2,0,0,0,0|2,0,0]=4 22420 B12R1.1095 CCOc1c(cc(cc1C)Br)C 7a_100000187306_100000210202 [0,2,0,0,0,0|2,0,0]=4 22421 B12R1.1095 CCOc1c(cc(cc1C)C)C 34a_100000212074_100000210202 [0,2,0,0,0,0|2,0,0]=4 22422 B12R1.1095 CCOc1c(cc(cc1C)C)C 7a_100000212074_100000210202 [0,2,0,0,0,0|2,0,0]=4 22423 B12R1.1095 CCOc1c(cc(cc1C)Cl)C 34a_100000211519_100000210202 [0,2,0,0,0,0|2,0,0]=4 22424 B12R1.1095 CCOc1c(cc(cc1C)Cl)C 7a_100000211519_100000210202 [0,2,0,0,0,0|2,0,0]=4 22425 B12R1.1095 CCOc1c(cc(cc1C)F)C 34a_100000081862_100000210202 [0,2,0,0,0,0|2,0,0]=4 22426 B12R1.1095 CCOc1c(cc(cc1C)F)C 7a_100000081862_100000210202 [0,2,0,0,0,0|2,0,0]=4 22427 B12R1.1095 CCOc1c(cc(cc1C)I)C 34a_100011216129_100000210202 [0,2,0,0,0,0|2,0,0]=4 22428 B12R1.1095 CCOc1c(cc(cc1C)I)C 7a_100011216129_100000210202 [0,2,0,0,0,0|2,0,0]=4 22429 B12R1.1095 CCOc1c(cc(cc1C)N)C 34a_100000703291_100000210202 [0,2,0,0,0,0|2,0,0]=4 22430 B12R1.1095 CCOc1c(cc(cc1C)N)C 7a_100000703291_100000210202 [0,2,0,0,0,0|2,0,0]=4 22431 B12R1.1095 CCOc1c(cc(cc1Cl)Br)C 34a_100000211485_100000210202 [0,2,0,0,0,0|2,0,0]=4 22432 B12R1.1095 CCOc1c(cc(cc1Cl)Br)C 7a_100000211485_100000210202 [0,2,0,0,0,0|2,0,0]=4 22433 B12R1.1095 CCOc1c(cc(cc1Cl)Br)Cl 34a_100000753780_100000210202 [0,2,0,0,0,0|2,0,0]=4 22434 B12R1.1095 CCOc1c(cc(cc1Cl)Br)Cl 7a_100000753780_100000210202 [0,2,0,0,0,0|2,0,0]=4 22435 B12R1.1095 CCOc1c(cc(cc1Cl)Br)F 34a_100011216646_100000210202 [0,2,0,0,0,0|2,0,0]=4 22436 B12R1.1095 CCOc1c(cc(cc1Cl)Br)F 7a_100011216646_100000210202 [0,2,0,0,0,0|2,0,0]=4 22437 B12R1.1095 CCOc1c(cc(cc1Cl)Br)N 34a_100000694353_100000210202 [0,2,0,0,0,0|2,0,0]=4 22438 B12R1.1095 CCOc1c(cc(cc1Cl)Br)N 7a_100000694353_100000210202 [0,2,0,0,0,0|2,0,0]=4 22439 B12R1.1095 CCOc1c(cc(cc1Cl)C)Cl 34a_100000034925_100000210202 [0,2,0,0,0,0|2,0,0]=4 22440 B12R1.1095 CCOc1c(cc(cc1Cl)C)Cl 7a_100000034925_100000210202 [0,2,0,0,0,0|2,0,0]=4 22441 B12R1.1095 CCOc1c(cc(cc1Cl)Cl)C 34a_100011218458_100000210202 [0,2,0,0,0,0|2,0,0]=4 22442 B12R1.1095 CCOc1c(cc(cc1Cl)Cl)C 7a_100011218458_100000210202 [0,2,0,0,0,0|2,0,0]=4 22443 B12R1.1095 CCOc1c(cc(cc1Cl)Cl)Cl 34a_100000210218_100000210202 [0,2,0,0,0,0|2,0,0]=4 22444 B12R1.1095 CCOc1c(cc(cc1Cl)Cl)Cl 7a_100000210218_100000210202 [0,2,0,0,0,0|2,0,0]=4 22445 B12R1.1095 CCOc1c(cc(cc1Cl)Cl)N 34a_100000695819_100000210202 [0,2,0,0,0,0|2,0,0]=4 22446 B12R1.1095 CCOc1c(cc(cc1Cl)Cl)N 7a_100000695819_100000210202 [0,2,0,0,0,0|2,0,0]=4 22447 B12R1.1095 CCOc1c(cc(cc1Cl)F)Cl 34a_100011217724_100000210202 [0,2,0,0,0,0|2,0,0]=4 22448 B12R1.1095 CCOc1c(cc(cc1Cl)F)Cl 7a_100011217724_100000210202 [0,2,0,0,0,0|2,0,0]=4 22449 B12R1.1095 CCOc1c(cc(cc1Cl)F)F 34a_100011935252_100000210202 [0,2,0,0,0,0|2,0,0]=4 22450 B12R1.1095 CCOc1c(cc(cc1Cl)F)F 7a_100011935252_100000210202 [0,2,0,0,0,0|2,0,0]=4 22451 B12R1.1095 CCOc1c(cc(cc1Cl)F)O 271570a_203496583355_100135264980 [0,2,0,0,0,0|1,0,0]=3 22452 B12R1.1095 CCOc1c(cc(cc1Cl)I)C 34a_200015900153_100000210202 [0,2,0,0,0,0|2,0,0]=4 22453 B12R1.1095 CCOc1c(cc(cc1Cl)I)C 7a_200015900153_100000210202 [0,2,0,0,0,0|2,0,0]=4 22454 B12R1.1095 CCOc1c(cc(cc1Cl)I)Cl 7a_100012339652_100000210202 [0,2,0,0,0,0|2,0,0]=4 22455 B12R1.1095 CCOc1c(cc(cc1Cl)N)Cl 34a_100000695418_100000210202 [0,2,0,0,0,0|2,0,0]=4 22456 B12R1.1095 CCOc1c(cc(cc1Cl)N)Cl 7a_100000695418_100000210202 [0,2,0,0,0,0|2,0,0]=4 22457 B12R1.1095 CCOc1c(cc(cc1F)Br)F 34a_100011216917_100000210202 [0,2,0,0,0,0|2,0,0]=4 22458 B12R1.1095 CCOc1c(cc(cc1F)Br)F 7a_100011216917_100000210202 [0,2,0,0,0,0|2,0,0]=4 22459 B12R1.1095 CCOc1c(cc(cc1F)Br)N 34a_100011217383_100000210202 [0,2,0,0,0,0|2,0,0]=4 22460 B12R1.1095 CCOc1c(cc(cc1F)Br)N 7a_100011217383_100000210202 [0,2,0,0,0,0|2,0,0]=4 22461 B12R1.1095 CCOc1c(cc(cc1F)Cl)F 34a_100011830429_100000210202 [0,2,0,0,0,0|2,0,0]=4 22462 B12R1.1095 CCOc1c(cc(cc1F)Cl)F 7a_100011830429_100000210202 [0,2,0,0,0,0|2,0,0]=4 22463 B12R1.1095 CCOc1c(cc(cc1F)F)F 34a_100011218396_100000210202 [0,2,0,0,0,0|2,0,0]=4 22464 B12R1.1095 CCOc1c(cc(cc1F)F)F 7a_100011218396_100000210202 [0,2,0,0,0,0|2,0,0]=4 22465 B12R1.1095 CCOc1c(cc(cc1F)F)N 34a_100015205836_100000210202 [0,2,0,0,0,0|2,0,0]=4 22466 B12R1.1095 CCOc1c(cc(cc1F)F)N 7a_100015205836_100000210202 [0,2,0,0,0,0|2,0,0]=4 22467 B12R1.1095 CCOc1c(cc(cc1F)I)F 34a_200011830255_100000210202 [0,2,0,0,0,0|2,0,0]=4 22468 B12R1.1095 CCOc1c(cc(cc1F)I)F 7a_200011830255_100000210202 [0,2,0,0,0,0|2,0,0]=4 22469 B12R1.1095 CCOc1c(cc(cc1F)N)F 34a_100016987357_100000210202 [0,2,0,0,0,0|2,0,0]=4 22470 B12R1.1095 CCOc1c(cc(cc1F)N)F 7a_100016987357_100000210202 [0,2,0,0,0,0|2,0,0]=4 22471 B12R1.1095 CCOc1c(cc(cc1F)O)F 271570a_203496583355_200010078527 [0,2,0,0,0,0|2,0,0]=4 22472 B12R1.1095 CCOc1c(cc(cc1I)Br)F 34a_100013354677_100000210202 [0,2,0,0,0,0|2,0,0]=4 22473 B12R1.1095 CCOc1c(cc(cc1I)Br)F 7a_100013354677_100000210202 [0,2,0,0,0,0|2,0,0]=4 22474 B12R1.1095 CCOc1c(cc(cc1I)Br)I 7a_100009997433_100000210202 [0,2,0,0,0,0|2,0,0]=4 22475 B12R1.1095 CCOc1c(cc(cc1I)Br)N 7a_100016071998_100000210202 [0,2,0,0,0,0|2,0,0]=4 22476 B12R1.1095 CCOc1c(cc(cc1I)C)F 34a_200135191068_100000210202 [0,2,0,0,0,0|2,0,0]=4 22477 B12R1.1095 CCOc1c(cc(cc1I)C)F 7a_200135191068_100000210202 [0,2,0,0,0,0|2,0,0]=4 22478 B12R1.1095 CCOc1c(cc(cc1I)Cl)C 34a_100012343667_100000210202 [0,2,0,0,0,0|2,0,0]=4 22479 B12R1.1095 CCOc1c(cc(cc1I)Cl)C 7a_100012343667_100000210202 [0,2,0,0,0,0|2,0,0]=4 22480 B12R1.1095 CCOc1c(cc(cc1I)Cl)Cl 34a_200012339341_100000210202 [0,2,0,0,0,0|2,0,0]=4 22481 B12R1.1095 CCOc1c(cc(cc1I)Cl)Cl 7a_200012339341_100000210202 [0,2,0,0,0,0|2,0,0]=4 22482 B12R1.1095 CCOc1c(cc(cc1I)Cl)I 7a_100000730656_100000210202 [0,2,0,0,0,0|2,0,0]=4 22483 B12R1.1095 CCOc1c(cc(cc1I)F)Br 34a_200013085147_100000210202 [0,2,0,0,0,0|2,0,0]=4 22484 B12R1.1095 CCOc1c(cc(cc1I)F)Br 7a_200013085147_100000210202 [0,2,0,0,0,0|2,0,0]=4 22485 B12R1.1095 CCOc1c(cc(cc1I)F)F 34a_200013204775_100000210202 [0,2,0,0,0,0|2,0,0]=4 22486 B12R1.1095 CCOc1c(cc(cc1I)F)F 7a_200013204775_100000210202 [0,2,0,0,0,0|2,0,0]=4 22487 B12R1.1095 CCOc1c(cc(cc1I)I)Cl 7a_100009997439_100000210202 [0,2,0,0,0,0|2,0,0]=4 22488 B12R1.1095 CCOc1c(cc(cc1I)I)I 7a_100000210296_100000210202 [0,2,0,0,0,0|2,0,0]=4 22489 B12R1.1095 CCOc1c(cc(cc1N)Br)C 34a_100011825904_100000210202 [0,2,0,0,0,0|2,0,0]=4 22490 B12R1.1095 CCOc1c(cc(cc1N)Br)C 7a_100011825904_100000210202 [0,2,0,0,0,0|2,0,0]=4 22491 B12R1.1095 CCOc1c(cc(cc1N)C)C 34a_100011216242_100000210202 [0,2,0,0,0,0|2,0,0]=4 22492 B12R1.1095 CCOc1c(cc(cc1N)C)C 7a_100011216242_100000210202 [0,2,0,0,0,0|2,0,0]=4 22493 B12R1.1095 CCOc1c(cc(cc1N)F)C 34a_100000130126_100000210202 [0,2,0,0,0,0|2,0,0]=4 22494 B12R1.1095 CCOc1c(cc(cc1N)F)C 7a_100000130126_100000210202 [0,2,0,0,0,0|2,0,0]=4 22495 B12R1.1095 CCOc1c(cc(cc1O)F)N 271570a_203496583355_100011190658 [0,2,0,0,0,0|1,0,0]=3 22496 B12R1.1095 CCSc1c(cc(cc1Br)Br)Br 62a_100000210202_100011263223 [0,2,0,0,0,0|2,0,0]=4 22497 B12R1.1095 CCSc1c(cc(cc1Br)Br)Br 62a_100011263223_100000210202 [0,2,0,0,0,0|2,0,0]=4 22498 B12R1.1095 CCSc1c(cc(cc1Br)Br)C 62a_100000210202_200010208242 [0,2,0,0,0,0|2,0,0]=4 22499 B12R1.1095 CCSc1c(cc(cc1Br)Br)C 62a_200010208242_100000210202 [0,2,0,0,0,0|2,0,0]=4 22500 B12R1.1095 CCSc1c(cc(cc1Br)Br)F 62a_100000210202_100000708766 [0,2,0,0,0,0|2,0,0]=4 22501 B12R1.1095 CCSc1c(cc(cc1Br)Br)F 62a_100000708766_100000210202 [0,2,0,0,0,0|2,0,0]=4 22502 B12R1.1095 CCSc1c(cc(cc1Br)C)Br 62a_100000210202_200011219743 [0,2,0,0,0,0|2,0,0]=4 22503 B12R1.1095 CCSc1c(cc(cc1Br)C)Br 62a_200011219743_100000210202 [0,2,0,0,0,0|2,0,0]=4 22504 B12R1.1095 CCSc1c(cc(cc1Br)C)C 62a_100000210202_200012353697 [0,2,0,0,0,0|2,0,0]=4 22505 B12R1.1095 CCSc1c(cc(cc1Br)C)C 62a_200012353697_100000210202 [0,2,0,0,0,0|2,0,0]=4 22506 B12R1.1095 CCSc1c(cc(cc1Br)C)F 62a_100000210202_100010208195 [0,2,0,0,0,0|2,0,0]=4 22507 B12R1.1095 CCSc1c(cc(cc1Br)C)F 62a_100010208195_100000210202 [0,2,0,0,0,0|2,0,0]=4 22508 B12R1.1095 CCSc1c(cc(cc1Br)Cl)Cl 62a_100000210202_200009992027 [0,2,0,0,0,0|2,0,0]=4 22509 B12R1.1095 CCSc1c(cc(cc1Br)Cl)Cl 62a_200009992027_100000210202 [0,2,0,0,0,0|2,0,0]=4 22510 B12R1.1095 CCSc1c(cc(cc1Br)Cl)F 62a_100000210202_100009993495 [0,2,0,0,0,0|2,0,0]=4 22511 B12R1.1095 CCSc1c(cc(cc1Br)Cl)F 62a_100009993495_100000210202 [0,2,0,0,0,0|2,0,0]=4 22512 B12R1.1095 CCSc1c(cc(cc1Br)Cl)N 62a_100000210202_100011155807 [0,2,0,0,0,0|2,0,0]=4 22513 B12R1.1095 CCSc1c(cc(cc1Br)Cl)N 62a_100011155807_100000210202 [0,2,0,0,0,0|2,0,0]=4 22514 B12R1.1095 CCSc1c(cc(cc1Br)F)Br 62a_100000210202_100009813983 [0,2,0,0,0,0|2,0,0]=4 22515 B12R1.1095 CCSc1c(cc(cc1Br)F)Br 62a_100009813983_100000210202 [0,2,0,0,0,0|2,0,0]=4 22516 B12R1.1095 CCSc1c(cc(cc1Br)F)C 62a_100000210202_100010208209 [0,2,0,0,0,0|2,0,0]=4 22517 B12R1.1095 CCSc1c(cc(cc1Br)F)C 62a_100010208209_100000210202 [0,2,0,0,0,0|2,0,0]=4 22518 B12R1.1095 CCSc1c(cc(cc1Br)F)Cl 62a_100000210202_100012356682 [0,2,0,0,0,0|2,0,0]=4 22519 B12R1.1095 CCSc1c(cc(cc1Br)F)Cl 62a_100012356682_100000210202 [0,2,0,0,0,0|2,0,0]=4 22520 B12R1.1095 CCSc1c(cc(cc1Br)F)F 62a_100000210202_100000720994 [0,2,0,0,0,0|2,0,0]=4 22521 B12R1.1095 CCSc1c(cc(cc1Br)F)F 62a_100000720994_100000210202 [0,2,0,0,0,0|2,0,0]=4 22522 B12R1.1095 CCSc1c(cc(cc1Br)F)N 62a_100000210202_200010740111 [0,2,0,0,0,0|2,0,0]=4 22523 B12R1.1095 CCSc1c(cc(cc1Br)F)N 62a_200010740111_100000210202 [0,2,0,0,0,0|2,0,0]=4 22524 B12R1.1095 CCSc1c(cc(cc1C)Br)C 62a_100000210202_100009814048 [0,2,0,0,0,0|2,0,0]=4 22525 B12R1.1095 CCSc1c(cc(cc1C)Br)C 62a_100009814048_100000210202 [0,2,0,0,0,0|2,0,0]=4 22526 B12R1.1095 CCSc1c(cc(cc1C)C)C 62a_100000210202_100011204320 [0,2,0,0,0,0|2,0,0]=4 22527 B12R1.1095 CCSc1c(cc(cc1C)C)C 62a_100011204320_100000210202 [0,2,0,0,0,0|2,0,0]=4 22528 B12R1.1095 CCSc1c(cc(cc1C)Cl)C 62a_100000210202_100010244930 [0,2,0,0,0,0|2,0,0]=4 22529 B12R1.1095 CCSc1c(cc(cc1C)Cl)C 62a_100010244930_100000210202 [0,2,0,0,0,0|2,0,0]=4 22530 B12R1.1095 CCSc1c(cc(cc1C)F)C 62a_100000210202_100012356666 [0,2,0,0,0,0|2,0,0]=4 22531 B12R1.1095 CCSc1c(cc(cc1C)F)C 62a_100012356666_100000210202 [0,2,0,0,0,0|2,0,0]=4 22532 B12R1.1095 CCSc1c(cc(cc1C)N)C 62a_100000210202_100000215964 [0,2,0,0,0,0|2,0,0]=4 22533 B12R1.1095 CCSc1c(cc(cc1C)N)C 62a_100000215964_100000210202 [0,2,0,0,0,0|2,0,0]=4 22534 B12R1.1095 CCSc1c(cc(cc1C)O)C 62a_100000210202_100000243743 [0,2,0,0,0,0|2,0,0]=4 22535 B12R1.1095 CCSc1c(cc(cc1C)O)C 62a_100000243743_100000210202 [0,2,0,0,0,0|2,0,0]=4 22536 B12R1.1095 CCSc1c(cc(cc1Cl)Br)Cl 62a_100000210202_200011263224 [0,2,0,0,0,0|2,0,0]=4 22537 B12R1.1095 CCSc1c(cc(cc1Cl)Br)Cl 62a_200011263224_100000210202 [0,2,0,0,0,0|2,0,0]=4 22538 B12R1.1095 CCSc1c(cc(cc1Cl)Br)F 62a_100000210202_100010212234 [0,2,0,0,0,0|2,0,0]=4 22539 B12R1.1095 CCSc1c(cc(cc1Cl)Br)F 62a_100010212234_100000210202 [0,2,0,0,0,0|2,0,0]=4 22540 B12R1.1095 CCSc1c(cc(cc1Cl)Cl)C 62a_100000210202_200000035511 [0,2,0,0,0,0|2,0,0]=4 22541 B12R1.1095 CCSc1c(cc(cc1Cl)Cl)C 62a_200000035511_100000210202 [0,2,0,0,0,0|2,0,0]=4 22542 B12R1.1095 CCSc1c(cc(cc1Cl)Cl)Cl 62a_100000210202_200011216440 [0,2,0,0,0,0|2,0,0]=4 22543 B12R1.1095 CCSc1c(cc(cc1Cl)Cl)Cl 62a_200011216440_100000210202 [0,2,0,0,0,0|2,0,0]=4 22544 B12R1.1095 CCSc1c(cc(cc1Cl)F)C 62a_100000210202_100010079234 [0,2,0,0,0,0|2,0,0]=4 22545 B12R1.1095 CCSc1c(cc(cc1Cl)F)C 62a_100010079234_100000210202 [0,2,0,0,0,0|2,0,0]=4 22546 B12R1.1095 CCSc1c(cc(cc1Cl)F)Cl 62a_100000210202_100010175091 [0,2,0,0,0,0|2,0,0]=4 22547 B12R1.1095 CCSc1c(cc(cc1Cl)F)Cl 62a_100010175091_100000210202 [0,2,0,0,0,0|2,0,0]=4 22548 B12R1.1095 CCSc1c(cc(cc1Cl)N)F 62a_100000210202_100014833993 [0,2,0,0,0,0|2,0,0]=4 22549 B12R1.1095 CCSc1c(cc(cc1Cl)N)F 62a_100014833993_100000210202 [0,2,0,0,0,0|2,0,0]=4 22550 B12R1.1095 CCSc1c(cc(cc1F)Br)F 62a_100000210202_100009813614 [0,2,0,0,0,0|2,0,0]=4 22551 B12R1.1095 CCSc1c(cc(cc1F)Br)F 62a_100009813614_100000210202 [0,2,0,0,0,0|2,0,0]=4 22552 B12R1.1095 CCSc1c(cc(cc1F)C)F 62a_100000210202_100015306127 [0,2,0,0,0,0|2,0,0]=4 22553 B12R1.1095 CCSc1c(cc(cc1F)C)F 62a_100015306127_100000210202 [0,2,0,0,0,0|2,0,0]=4 22554 B12R1.1095 CCSc1c(cc(cc1F)C)N 62a_100000210202_100021129147 [0,2,0,0,0,0|2,0,0]=4 22555 B12R1.1095 CCSc1c(cc(cc1F)C)N 62a_100021129147_100000210202 [0,2,0,0,0,0|2,0,0]=4 22556 B12R1.1095 CCSc1c(cc(cc1F)Cl)N 62a_100000210202_200021297760 [0,2,0,0,0,0|2,0,0]=4 22557 B12R1.1095 CCSc1c(cc(cc1F)Cl)N 62a_200021297760_100000210202 [0,2,0,0,0,0|2,0,0]=4 22558 B12R1.1095 CCSc1c(cc(cc1F)F)C 62a_100000210202_100015332101 [0,2,0,0,0,0|2,0,0]=4 22559 B12R1.1095 CCSc1c(cc(cc1F)F)C 62a_100015332101_100000210202 [0,2,0,0,0,0|2,0,0]=4 22560 B12R1.1095 CCSc1c(cc(cc1F)F)F 62a_100000210202_100000243675 [0,2,0,0,0,0|2,0,0]=4 22561 B12R1.1095 CCSc1c(cc(cc1F)F)F 62a_100000243675_100000210202 [0,2,0,0,0,0|2,0,0]=4 22562 B12R1.1095 CCSc1c(cc(cc1F)F)N 62a_100000210202_100000716482 [0,2,0,0,0,0|2,0,0]=4 22563 B12R1.1095 CCSc1c(cc(cc1F)F)N 62a_100000716482_100000210202 [0,2,0,0,0,0|2,0,0]=4 22564 B12R1.1095 CCSc1c(cc(cc1F)F)O 62a_100000210202_100009815984 [0,2,0,0,0,0|1,0,0]=3 22565 B12R1.1095 CCSc1c(cc(cc1F)F)O 62a_100009815984_100000210202 [0,2,0,0,0,0|1,0,0]=3 22566 B12R1.1095 CCSc1c(cc(cc1F)N)C 62a_100000210202_100010115923 [0,2,0,0,0,0|2,0,0]=4 22567 B12R1.1095 CCSc1c(cc(cc1F)N)C 62a_100010115923_100000210202 [0,2,0,0,0,0|2,0,0]=4 22568 B12R1.1095 CCSc1c(cc(cc1F)N)F 62a_100000057532_100000210202 [0,2,0,0,0,0|2,0,0]=4 22569 B12R1.1095 CCSc1c(cc(cc1F)N)F 62a_100000210202_100000057532 [0,2,0,0,0,0|2,0,0]=4 22570 B12R1.1095 CCSc1c(cc(cc1F)O)F 62a_100000210202_100009816007 [0,2,0,0,0,0|2,0,0]=4 22571 B12R1.1095 CCSc1c(cc(cc1F)O)F 62a_100009816007_100000210202 [0,2,0,0,0,0|2,0,0]=4 22572 B12R1.1095 CCSc1c(cc(cc1N)Cl)C 62a_100000210202_100000698757 [0,2,0,0,0,0|2,0,0]=4 22573 B12R1.1095 CCSc1c(cc(cc1N)Cl)C 62a_100000698757_100000210202 [0,2,0,0,0,0|2,0,0]=4 22574 B12R1.1095 CCSc1c(cc(cc1O)C)C 62a_100000210202_100010342985 [0,2,0,0,0,0|1,0,0]=3 22575 B12R1.1095 CCSc1c(cc(cc1O)C)C 62a_100010342985_100000210202 [0,2,0,0,0,0|1,0,0]=3 22576 B12R1.1095 CCSc1c(cc(cc1O)Cl)C 62a_100000210202_100010254216 [0,2,0,0,0,0|1,0,0]=3 22577 B12R1.1095 CCSc1c(cc(cc1O)Cl)C 62a_100010254216_100000210202 [0,2,0,0,0,0|1,0,0]=3 22578 B12R1.1095 CCSc1c(cc(cc1O)O)O 62a_100000210202_200010341185 [0,2,0,0,0,0|1,0,0]=3 22579 B12R1.1095 CNCc1c(cc(cc1Br)Br)Br 207a_100102657272_200010171659 [0,2,0,0,0,0|2,0,0]=4 22580 B12R1.1095 CNCc1c(cc(cc1Br)Br)Br 26a_100102657272_100000210219 [0,2,0,0,0,0|2,0,0]=4 22581 B12R1.1095 CNCc1c(cc(cc1Br)Br)Br 270004a_106832991635_200010171659 [0,2,0,0,0,0|2,0,0]=4 22582 B12R1.1095 CNCc1c(cc(cc1Br)Br)C 26a_100102657272_100000186369 [0,2,0,0,0,0|2,0,0]=4 22583 B12R1.1095 CNCc1c(cc(cc1Br)Br)Cl 26a_100102657272_100012337755 [0,2,0,0,0,0|2,0,0]=4 22584 B12R1.1095 CNCc1c(cc(cc1Br)Br)F 207a_100102657272_100009814462 [0,2,0,0,0,0|2,0,0]=4 22585 B12R1.1095 CNCc1c(cc(cc1Br)Br)F 26a_100102657272_100011216695 [0,2,0,0,0,0|2,0,0]=4 22586 B12R1.1095 CNCc1c(cc(cc1Br)Br)F 270004a_106832991635_100009814462 [0,2,0,0,0,0|2,0,0]=4 22587 B12R1.1095 CNCc1c(cc(cc1Br)C)Br 207a_100102657272_100010233045 [0,2,0,0,0,0|2,0,0]=4 22588 B12R1.1095 CNCc1c(cc(cc1Br)C)Br 26a_100102657272_100000203795 [0,2,0,0,0,0|2,0,0]=4 22589 B12R1.1095 CNCc1c(cc(cc1Br)C)Br 270004a_106832991635_100010233045 [0,2,0,0,0,0|2,0,0]=4 22590 B12R1.1095 CNCc1c(cc(cc1Br)C)C 26a_100102657272_100011934984 [0,2,0,0,0,0|2,0,0]=4 22591 B12R1.1095 CNCc1c(cc(cc1Br)C)F 207a_100102657272_100010341274 [0,2,0,0,0,0|2,0,0]=4 22592 B12R1.1095 CNCc1c(cc(cc1Br)C)F 26a_100102657272_200010713133 [0,2,0,0,0,0|2,0,0]=4 22593 B12R1.1095 CNCc1c(cc(cc1Br)C)F 270004a_106832991635_100010341274 [0,2,0,0,0,0|2,0,0]=4 22594 B12R1.1095 CNCc1c(cc(cc1Br)Cl)Br 26a_100102657272_100012337757 [0,2,0,0,0,0|2,0,0]=4 22595 B12R1.1095 CNCc1c(cc(cc1Br)Cl)C 26a_100102657272_100012337756 [0,2,0,0,0,0|2,0,0]=4 22596 B12R1.1095 CNCc1c(cc(cc1Br)Cl)Cl 26a_100102657272_200000243811 [0,2,0,0,0,0|2,0,0]=4 22597 B12R1.1095 CNCc1c(cc(cc1Br)Cl)F 207a_100102657272_100010063709 [0,2,0,0,0,0|2,0,0]=4 22598 B12R1.1095 CNCc1c(cc(cc1Br)Cl)F 26a_100102657272_100011830412 [0,2,0,0,0,0|2,0,0]=4 22599 B12R1.1095 CNCc1c(cc(cc1Br)Cl)F 270004a_106832991635_100010063709 [0,2,0,0,0,0|2,0,0]=4 22600 B12R1.1095 CNCc1c(cc(cc1Br)F)Br 207a_100102657272_100010173017 [0,2,0,0,0,0|2,0,0]=4 22601 B12R1.1095 CNCc1c(cc(cc1Br)F)Br 26a_100102657272_100011215434 [0,2,0,0,0,0|2,0,0]=4 22602 B12R1.1095 CNCc1c(cc(cc1Br)F)Br 270004a_106832991635_100010173017 [0,2,0,0,0,0|2,0,0]=4 22603 B12R1.1095 CNCc1c(cc(cc1Br)F)Cl 207a_100102657272_100016221765 [0,2,0,0,0,0|2,0,0]=4 22604 B12R1.1095 CNCc1c(cc(cc1Br)F)Cl 26a_100102657272_100011830411 [0,2,0,0,0,0|2,0,0]=4 22605 B12R1.1095 CNCc1c(cc(cc1Br)F)Cl 270004a_106832991635_100016221765 [0,2,0,0,0,0|2,0,0]=4 22606 B12R1.1095 CNCc1c(cc(cc1Br)F)F 207a_100102657272_100010009843 [0,2,0,0,0,0|2,0,0]=4 22607 B12R1.1095 CNCc1c(cc(cc1Br)F)F 2230a_106832991635_100015786123 [0,2,0,0,0,0|2,0,0]=4 22608 B12R1.1095 CNCc1c(cc(cc1Br)F)F 26a_100102657272_100000688693 [0,2,0,0,0,0|2,0,0]=4 22609 B12R1.1095 CNCc1c(cc(cc1Br)F)F 270004a_106832991635_100010009843 [0,2,0,0,0,0|2,0,0]=4 22610 B12R1.1095 CNCc1c(cc(cc1Br)F)F 34a_100102657272_100015786123 [0,2,0,0,0,0|2,0,0]=4 22611 B12R1.1095 CNCc1c(cc(cc1Br)F)F 7a_106832991635_100015786123 [0,2,0,0,0,0|2,0,0]=4 22612 B12R1.1095 CNCc1c(cc(cc1Br)I)C 26a_100102657272_100010982682 [0,2,0,0,0,0|2,0,0]=4 22613 B12R1.1095 CNCc1c(cc(cc1Br)N)Br 26a_100102657272_200000186426 [0,2,0,0,0,0|2,0,0]=4 22614 B12R1.1095 CNCc1c(cc(cc1C)Br)C 207a_100102657272_100010238521 [0,2,0,0,0,0|2,0,0]=4 22615 B12R1.1095 CNCc1c(cc(cc1C)Br)C 26a_100102657272_100000187306 [0,2,0,0,0,0|2,0,0]=4 22616 B12R1.1095 CNCc1c(cc(cc1C)Br)C 270004a_106832991635_100010238521 [0,2,0,0,0,0|2,0,0]=4 22617 B12R1.1095 CNCc1c(cc(cc1C)C)C 207a_100102657272_100000211105 [0,2,0,0,0,0|2,0,0]=4 22618 B12R1.1095 CNCc1c(cc(cc1C)C)C 2230a_100000737526_200000210301 [0,2,0,0,0,0|2,0,0]=4 22619 B12R1.1095 CNCc1c(cc(cc1C)C)C 2230a_106832991635_100000749405 [0,2,0,0,0,0|2,0,0]=4 22620 B12R1.1095 CNCc1c(cc(cc1C)C)C 270004a_106832991635_100000211105 [0,2,0,0,0,0|2,0,0]=4 22621 B12R1.1095 CNCc1c(cc(cc1C)C)C 34a_100000737526_200000210301 [0,2,0,0,0,0|2,0,0]=4 22622 B12R1.1095 CNCc1c(cc(cc1C)C)C 34a_100102657272_100000749405 [0,2,0,0,0,0|2,0,0]=4 22623 B12R1.1095 CNCc1c(cc(cc1C)C)C 7a_106832991635_100000749405 [0,2,0,0,0,0|2,0,0]=4 22624 B12R1.1095 CNCc1c(cc(cc1C)Cl)C 207a_100102657272_100000693520 [0,2,0,0,0,0|2,0,0]=4 22625 B12R1.1095 CNCc1c(cc(cc1C)Cl)C 270004a_106832991635_100000693520 [0,2,0,0,0,0|2,0,0]=4 22626 B12R1.1095 CNCc1c(cc(cc1C)F)C 207a_100102657272_100012179923 [0,2,0,0,0,0|2,0,0]=4 22627 B12R1.1095 CNCc1c(cc(cc1C)F)C 270004a_106832991635_100012179923 [0,2,0,0,0,0|2,0,0]=4 22628 B12R1.1095 CNCc1c(cc(cc1C)O)C 207a_100102657272_100011827661 [0,2,0,0,0,0|2,0,0]=4 22629 B12R1.1095 CNCc1c(cc(cc1Cl)Br)C 26a_100102657272_100000211485 [0,2,0,0,0,0|2,0,0]=4 22630 B12R1.1095 CNCc1c(cc(cc1Cl)Br)Cl 207a_100102657272_100010238519 [0,2,0,0,0,0|2,0,0]=4 22631 B12R1.1095 CNCc1c(cc(cc1Cl)Br)Cl 26a_100102657272_100000753780 [0,2,0,0,0,0|2,0,0]=4 22632 B12R1.1095 CNCc1c(cc(cc1Cl)Br)Cl 270004a_106832991635_100010238519 [0,2,0,0,0,0|2,0,0]=4 22633 B12R1.1095 CNCc1c(cc(cc1Cl)Br)F 207a_100102657272_100010827746 [0,2,0,0,0,0|2,0,0]=4 22634 B12R1.1095 CNCc1c(cc(cc1Cl)Br)F 26a_100102657272_100011216646 [0,2,0,0,0,0|2,0,0]=4 22635 B12R1.1095 CNCc1c(cc(cc1Cl)Br)F 270004a_106832991635_100010827746 [0,2,0,0,0,0|2,0,0]=4 22636 B12R1.1095 CNCc1c(cc(cc1Cl)C)Cl 207a_100102657272_100000093335 [0,2,0,0,0,0|2,0,0]=4 22637 B12R1.1095 CNCc1c(cc(cc1Cl)C)Cl 26a_100102657272_100000034925 [0,2,0,0,0,0|2,0,0]=4 22638 B12R1.1095 CNCc1c(cc(cc1Cl)C)Cl 270004a_106832991635_100000093335 [0,2,0,0,0,0|2,0,0]=4 22639 B12R1.1095 CNCc1c(cc(cc1Cl)Cl)C 34a_200000031571_200000210301 [0,2,0,0,0,0|2,0,0]=4 22640 B12R1.1095 CNCc1c(cc(cc1Cl)Cl)Cl 207a_100102657272_100012362488 [0,2,0,0,0,0|2,0,0]=4 22641 B12R1.1095 CNCc1c(cc(cc1Cl)Cl)Cl 2230a_106832991635_100012339996 [0,2,0,0,0,0|2,0,0]=4 22642 B12R1.1095 CNCc1c(cc(cc1Cl)Cl)Cl 26a_100102657272_100000210218 [0,2,0,0,0,0|2,0,0]=4 22643 B12R1.1095 CNCc1c(cc(cc1Cl)Cl)Cl 270004a_106832991635_100012362488 [0,2,0,0,0,0|2,0,0]=4 22644 B12R1.1095 CNCc1c(cc(cc1Cl)Cl)Cl 34a_100102657272_100012339996 [0,2,0,0,0,0|2,0,0]=4 22645 B12R1.1095 CNCc1c(cc(cc1Cl)Cl)Cl 7a_106832991635_100012339996 [0,2,0,0,0,0|2,0,0]=4 22646 B12R1.1095 CNCc1c(cc(cc1Cl)Cl)F 207a_100102657272_100000117891 [0,2,0,0,0,0|2,0,0]=4 22647 B12R1.1095 CNCc1c(cc(cc1Cl)Cl)F 270004a_106832991635_100000117891 [0,2,0,0,0,0|2,0,0]=4 22648 B12R1.1095 CNCc1c(cc(cc1Cl)Cl)O 270004a_106832991635_100011827663 [0,2,0,0,0,0|1,0,0]=3 22649 B12R1.1095 CNCc1c(cc(cc1Cl)F)C 207a_100102657272_200015781908 [0,2,0,0,0,0|2,0,0]=4 22650 B12R1.1095 CNCc1c(cc(cc1Cl)F)C 270004a_106832991635_200015781908 [0,2,0,0,0,0|2,0,0]=4 22651 B12R1.1095 CNCc1c(cc(cc1Cl)F)Cl 207a_100102657272_100010271666 [0,2,0,0,0,0|2,0,0]=4 22652 B12R1.1095 CNCc1c(cc(cc1Cl)F)Cl 26a_100102657272_100011217724 [0,2,0,0,0,0|2,0,0]=4 22653 B12R1.1095 CNCc1c(cc(cc1Cl)F)Cl 270004a_106832991635_100010271666 [0,2,0,0,0,0|2,0,0]=4 22654 B12R1.1095 CNCc1c(cc(cc1Cl)F)F 207a_100102657272_100009880014 [0,2,0,0,0,0|2,0,0]=4 22655 B12R1.1095 CNCc1c(cc(cc1Cl)F)F 270004a_106832991635_100009880014 [0,2,0,0,0,0|2,0,0]=4 22656 B12R1.1095 CNCc1c(cc(cc1Cl)I)Cl 207a_100102657272_200011001975 [0,2,0,0,0,0|2,0,0]=4 22657 B12R1.1095 CNCc1c(cc(cc1Cl)I)Cl 26a_100102657272_100012339652 [0,2,0,0,0,0|2,0,0]=4 22658 B12R1.1095 CNCc1c(cc(cc1F)Br)F 207a_100102657272_100011216854 [0,2,0,0,0,0|2,0,0]=4 22659 B12R1.1095 CNCc1c(cc(cc1F)Br)F 2230a_106832991635_100012355225 [0,2,0,0,0,0|2,0,0]=4 22660 B12R1.1095 CNCc1c(cc(cc1F)Br)F 26a_100102657272_100011216917 [0,2,0,0,0,0|2,0,0]=4 22661 B12R1.1095 CNCc1c(cc(cc1F)Br)F 270004a_106832991635_100011216854 [0,2,0,0,0,0|2,0,0]=4 22662 B12R1.1095 CNCc1c(cc(cc1F)Br)F 34a_100000709252_200000210301 [0,2,0,0,0,0|2,0,0]=4 22663 B12R1.1095 CNCc1c(cc(cc1F)Br)F 34a_100102657272_100012355225 [0,2,0,0,0,0|2,0,0]=4 22664 B12R1.1095 CNCc1c(cc(cc1F)Br)F 7a_106832991635_100012355225 [0,2,0,0,0,0|2,0,0]=4 22665 B12R1.1095 CNCc1c(cc(cc1F)C)F 207a_100102657272_100009880303 [0,2,0,0,0,0|2,0,0]=4 22666 B12R1.1095 CNCc1c(cc(cc1F)C)F 270004a_106832991635_100009880303 [0,2,0,0,0,0|2,0,0]=4 22667 B12R1.1095 CNCc1c(cc(cc1F)Cl)F 207a_100102657272_100000036707 [0,2,0,0,0,0|2,0,0]=4 22668 B12R1.1095 CNCc1c(cc(cc1F)Cl)F 2230a_106832991635_100009813723 [0,2,0,0,0,0|2,0,0]=4 22669 B12R1.1095 CNCc1c(cc(cc1F)Cl)F 270004a_106832991635_100000036707 [0,2,0,0,0,0|2,0,0]=4 22670 B12R1.1095 CNCc1c(cc(cc1F)Cl)F 34a_100000062228_200000210301 [0,2,0,0,0,0|2,0,0]=4 22671 B12R1.1095 CNCc1c(cc(cc1F)Cl)F 34a_100102657272_100009813723 [0,2,0,0,0,0|2,0,0]=4 22672 B12R1.1095 CNCc1c(cc(cc1F)Cl)F 7a_106832991635_100009813723 [0,2,0,0,0,0|2,0,0]=4 22673 B12R1.1095 CNCc1c(cc(cc1F)F)F 207a_100102657272_100011215106 [0,2,0,0,0,0|2,0,0]=4 22674 B12R1.1095 CNCc1c(cc(cc1F)F)F 2230a_106832991635_100011216150 [0,2,0,0,0,0|2,0,0]=4 22675 B12R1.1095 CNCc1c(cc(cc1F)F)F 270004a_106832991635_100011215106 [0,2,0,0,0,0|2,0,0]=4 22676 B12R1.1095 CNCc1c(cc(cc1F)F)F 34a_100015196675_200000210301 [0,2,0,0,0,0|2,0,0]=4 22677 B12R1.1095 CNCc1c(cc(cc1F)F)F 34a_100102657272_100011216150 [0,2,0,0,0,0|2,0,0]=4 22678 B12R1.1095 CNCc1c(cc(cc1F)F)F 7a_106832991635_100011216150 [0,2,0,0,0,0|2,0,0]=4 22679 B12R1.1095 CNCc1c(cc(cc1F)I)F 207a_100102657272_100010244567 [0,2,0,0,0,0|2,0,0]=4 22680 B12R1.1095 CNCc1c(cc(cc1F)O)F 207a_100102657272_100000061967 [0,2,0,0,0,0|2,0,0]=4 22681 B12R1.1095 CNCc1c(cc(cc1I)Br)F 26a_100102657272_100013354677 [0,2,0,0,0,0|2,0,0]=4 22682 B12R1.1095 CNCc1c(cc(cc1I)F)Br 26a_100102657272_200013085147 [0,2,0,0,0,0|2,0,0]=4 22683 B12R1.1095 COCc1c(cc(cc1Br)Br)F 34a_100009813783_200000210301 [0,2,0,0,0,0|2,0,0]=4 22684 B12R1.1095 COCc1c(cc(cc1Br)Br)F 7a_100009813783_200000210301 [0,2,0,0,0,0|2,0,0]=4 22685 B12R1.1095 COCc1c(cc(cc1Br)C)F 34a_100016175008_200000210301 [0,2,0,0,0,0|2,0,0]=4 22686 B12R1.1095 COCc1c(cc(cc1Br)C)F 7a_100016175008_200000210301 [0,2,0,0,0,0|2,0,0]=4 22687 B12R1.1095 COCc1c(cc(cc1Br)F)Br 34a_100015902593_200000210301 [0,2,0,0,0,0|2,0,0]=4 22688 B12R1.1095 COCc1c(cc(cc1Br)F)Br 7a_100015902593_200000210301 [0,2,0,0,0,0|2,0,0]=4 22689 B12R1.1095 COCc1c(cc(cc1Br)F)F 34a_100015506809_200000210301 [0,2,0,0,0,0|2,0,0]=4 22690 B12R1.1095 COCc1c(cc(cc1Br)F)F 34a_100138415774_100015786123 [0,2,0,0,0,0|2,0,0]=4 22691 B12R1.1095 COCc1c(cc(cc1Br)F)F 7a_100015506809_200000210301 [0,2,0,0,0,0|2,0,0]=4 22692 B12R1.1095 COCc1c(cc(cc1C)Br)C 34a_100010128451_200000210301 [0,2,0,0,0,0|2,0,0]=4 22693 B12R1.1095 COCc1c(cc(cc1C)Br)C 7a_100010128451_200000210301 [0,2,0,0,0,0|2,0,0]=4 22694 B12R1.1095 COCc1c(cc(cc1C)C)C 34a_100011215277_200000210301 [0,2,0,0,0,0|2,0,0]=4 22695 B12R1.1095 COCc1c(cc(cc1C)C)C 34a_100138415774_100000749405 [0,2,0,0,0,0|2,0,0]=4 22696 B12R1.1095 COCc1c(cc(cc1C)C)C 7a_100011215277_200000210301 [0,2,0,0,0,0|2,0,0]=4 22697 B12R1.1095 COCc1c(cc(cc1Cl)Br)Cl 34a_100010009727_200000210301 [0,2,0,0,0,0|2,0,0]=4 22698 B12R1.1095 COCc1c(cc(cc1Cl)Br)Cl 7a_100010009727_200000210301 [0,2,0,0,0,0|2,0,0]=4 22699 B12R1.1095 COCc1c(cc(cc1Cl)Cl)Cl 34a_100000067030_200000210301 [0,2,0,0,0,0|2,0,0]=4 22700 B12R1.1095 COCc1c(cc(cc1Cl)Cl)Cl 34a_100138415774_100012339996 [0,2,0,0,0,0|2,0,0]=4 22701 B12R1.1095 COCc1c(cc(cc1Cl)Cl)Cl 7a_100000067030_200000210301 [0,2,0,0,0,0|2,0,0]=4 22702 B12R1.1095 COCc1c(cc(cc1Cl)I)Cl 7a_200011001976_200000210301 [0,2,0,0,0,0|2,0,0]=4 22703 B12R1.1095 COCc1c(cc(cc1F)Br)F 34a_100011219983_200000210301 [0,2,0,0,0,0|2,0,0]=4 22704 B12R1.1095 COCc1c(cc(cc1F)Br)F 34a_100138415774_100012355225 [0,2,0,0,0,0|2,0,0]=4 22705 B12R1.1095 COCc1c(cc(cc1F)Br)F 7a_100011219983_200000210301 [0,2,0,0,0,0|2,0,0]=4 22706 B12R1.1095 COCc1c(cc(cc1F)Cl)F 34a_100000043065_200000210301 [0,2,0,0,0,0|2,0,0]=4 22707 B12R1.1095 COCc1c(cc(cc1F)Cl)F 34a_100138415774_100009813723 [0,2,0,0,0,0|2,0,0]=4 22708 B12R1.1095 COCc1c(cc(cc1F)Cl)F 7a_100000043065_200000210301 [0,2,0,0,0,0|2,0,0]=4 22709 B12R1.1095 COCc1c(cc(cc1F)F)F 34a_100011216010_200000210301 [0,2,0,0,0,0|2,0,0]=4 22710 B12R1.1095 COCc1c(cc(cc1F)F)F 34a_100138415774_100011216150 [0,2,0,0,0,0|2,0,0]=4 22711 B12R1.1095 COCc1c(cc(cc1F)F)F 7a_100011216010_200000210301 [0,2,0,0,0,0|2,0,0]=4 22712 B12R1.1095 COCc1c(cc(cc1F)I)F 34a_100020934948_200000210301 [0,2,0,0,0,0|2,0,0]=4 22713 B12R1.1095 COCc1c(cc(cc1F)I)F 7a_100020934948_200000210301 [0,2,0,0,0,0|2,0,0]=4 22714 B12R1.1095 COCc1c(cc(cc1F)O)F 271570a_203496583355_202126162168 [0,2,0,0,0,0|2,0,0]=4 22715 B12R1.1095 CSCc1c(cc(cc1Br)F)F 62a_100015786123_200000210301 [0,2,0,0,0,0|2,0,0]=4 22716 B12R1.1095 CSCc1c(cc(cc1Br)F)F 62a_200000210301_100015786123 [0,2,0,0,0,0|2,0,0]=4 22717 B12R1.1095 CSCc1c(cc(cc1C)C)C 62a_100000749405_200000210301 [0,2,0,0,0,0|2,0,0]=4 22718 B12R1.1095 CSCc1c(cc(cc1C)C)C 62a_200000210301_100000749405 [0,2,0,0,0,0|2,0,0]=4 22719 B12R1.1095 CSCc1c(cc(cc1Cl)Cl)Cl 62a_100012339996_200000210301 [0,2,0,0,0,0|2,0,0]=4 22720 B12R1.1095 CSCc1c(cc(cc1Cl)Cl)Cl 62a_200000210301_100012339996 [0,2,0,0,0,0|2,0,0]=4 22721 B12R1.1095 CSCc1c(cc(cc1F)Br)F 62a_100012355225_200000210301 [0,2,0,0,0,0|2,0,0]=4 22722 B12R1.1095 CSCc1c(cc(cc1F)Br)F 62a_200000210301_100012355225 [0,2,0,0,0,0|2,0,0]=4 22723 B12R1.1095 CSCc1c(cc(cc1F)Cl)F 62a_100009813723_200000210301 [0,2,0,0,0,0|2,0,0]=4 22724 B12R1.1095 CSCc1c(cc(cc1F)Cl)F 62a_200000210301_100009813723 [0,2,0,0,0,0|2,0,0]=4 22725 B12R1.1095 CSCc1c(cc(cc1F)F)F 62a_100011216150_200000210301 [0,2,0,0,0,0|2,0,0]=4 22726 B12R1.1095 CSCc1c(cc(cc1F)F)F 62a_200000210301_100011216150 [0,2,0,0,0,0|2,0,0]=4 22727 B12R1.1095 Cc1cc(c(c(c1)Br)CO[13CH3])F 34a_100016175008_200025704644 [0,2,0,0,0,0|2,0,0]=4 22728 B12R1.1095 Cc1cc(c(c(c1)Br)CO[13CH3])F 7a_100016175008_200025704644 [0,2,0,0,0,0|2,0,0]=4 22729 B12R1.1095 Cc1cc(c(c(c1)C)CN[13CH3])C 2230a_100000737526_200025704644 [0,2,0,0,0,0|2,0,0]=4 22730 B12R1.1095 Cc1cc(c(c(c1)C)CN[13CH3])C 34a_100000737526_200025704644 [0,2,0,0,0,0|2,0,0]=4 22731 B12R1.1095 Cc1cc(c(c(c1)C)CO[13CH3])C 34a_100011215277_200025704644 [0,2,0,0,0,0|2,0,0]=4 22732 B12R1.1095 Cc1cc(c(c(c1)C)CO[13CH3])C 7a_100011215277_200025704644 [0,2,0,0,0,0|2,0,0]=4 22733 B12R1.1095 Cc1cc(c(c(c1)C)CS[13CH3])C 62a_100000749405_200025704644 [0,2,0,0,0,0|2,0,0]=4 22734 B12R1.1095 Cc1cc(c(c(c1)C)CS[13CH3])C 62a_200025704644_100000749405 [0,2,0,0,0,0|2,0,0]=4 22735 B12R1.1095 Cc1cc(c(c(c1)Cl)NCF)O 34a_100015906060_100015361967 [0,2,0,0,0,0|2,0,0]=4 22736 B12R1.1095 Cc1cc(c(c(c1)O)SCF)C 62a_100010342985_100015361967 [0,2,0,0,0,0|2,0,0]=4 22737 B12R1.1095 Cc1cc(c(c(c1)O)SCF)C 62a_100015361967_100010342985 [0,2,0,0,0,0|2,0,0]=4 22738 B12R1.1095 Cc1cc(cc(c1CN[13CH3])Cl)Cl 34a_200000031571_200025704644 [0,2,0,0,0,0|2,0,0]=4 22739 B12R1.1095 Cc1cc(cc(c1CO[13CH3])C)Br 34a_100010128451_200025704644 [0,2,0,0,0,0|2,0,0]=4 22740 B12R1.1095 Cc1cc(cc(c1CO[13CH3])C)Br 7a_100010128451_200025704644 [0,2,0,0,0,0|2,0,0]=4 22741 B12R1.1095 Cc1cc(cc(c1NCF)O)Br 34a_100010371313_100015361967 [0,2,0,0,0,0|2,0,0]=4 22742 B12R1.1095 Cc1cc(cc(c1NCF)O)Br 7a_100010371313_100015361967 [0,2,0,0,0,0|2,0,0]=4 22743 B12R1.1095 Cc1cc(cc(c1SCF)O)Cl 62a_100010254216_100015361967 [0,2,0,0,0,0|2,0,0]=4 22744 B12R1.1095 Cc1cc(cc(c1SCF)O)Cl 62a_100015361967_100010254216 [0,2,0,0,0,0|2,0,0]=4 22745 B12R1.1095 Oc1cc(c(c(c1)O)SCF)O 62a_100015361967_200010341185 [0,2,0,0,0,0|2,0,0]=4 22746 B12R1.1095 Oc1cc(cc(c1NCF)F)Br 34a_100015475841_100015361967 [0,2,0,0,0,0|2,0,0]=4 22747 B12R1.1095 Oc1cc(cc(c1NCF)F)Cl 34a_100010883250_100015361967 [0,2,0,0,0,0|2,0,0]=4 22748 B12R1.1095 Oc1cc(cc(c1NCF)F)Cl 7a_100010883250_100015361967 [0,2,0,0,0,0|2,0,0]=4 22749 B12R1.1095 Oc1cc(cc(c1NCF)F)F 34a_100011217947_100015361967 [0,2,0,0,0,0|2,0,0]=4 22750 B12R1.1095 Oc1cc(cc(c1NCF)F)F 7a_100011217947_100015361967 [0,2,0,0,0,0|2,0,0]=4 22751 B12R1.1095 Oc1cc(cc(c1SCF)F)F 62a_100009815984_100015361967 [0,2,0,0,0,0|2,0,0]=4 22752 B12R1.1095 Oc1cc(cc(c1SCF)F)F 62a_100015361967_100009815984 [0,2,0,0,0,0|2,0,0]=4 22753 B12R1.1095 [13CH3]NCc1c(cc(cc1F)Br)F 34a_100000709252_200025704644 [0,2,0,0,0,0|2,0,0]=4 22754 B12R1.1095 [13CH3]NCc1c(cc(cc1F)Cl)F 34a_100000062228_200025704644 [0,2,0,0,0,0|2,0,0]=4 22755 B12R1.1095 [13CH3]NCc1c(cc(cc1F)F)F 34a_100015196675_200025704644 [0,2,0,0,0,0|2,0,0]=4 22756 B12R1.1095 [13CH3]OCc1c(cc(cc1Br)Br)F 34a_100009813783_200025704644 [0,2,0,0,0,0|2,0,0]=4 22757 B12R1.1095 [13CH3]OCc1c(cc(cc1Br)Br)F 7a_100009813783_200025704644 [0,2,0,0,0,0|2,0,0]=4 22758 B12R1.1095 [13CH3]OCc1c(cc(cc1Br)F)Br 34a_100015902593_200025704644 [0,2,0,0,0,0|2,0,0]=4 22759 B12R1.1095 [13CH3]OCc1c(cc(cc1Br)F)Br 7a_100015902593_200025704644 [0,2,0,0,0,0|2,0,0]=4 22760 B12R1.1095 [13CH3]OCc1c(cc(cc1Br)F)F 34a_100015506809_200025704644 [0,2,0,0,0,0|2,0,0]=4 22761 B12R1.1095 [13CH3]OCc1c(cc(cc1Br)F)F 7a_100015506809_200025704644 [0,2,0,0,0,0|2,0,0]=4 22762 B12R1.1095 [13CH3]OCc1c(cc(cc1Cl)Br)Cl 34a_100010009727_200025704644 [0,2,0,0,0,0|2,0,0]=4 22763 B12R1.1095 [13CH3]OCc1c(cc(cc1Cl)Br)Cl 7a_100010009727_200025704644 [0,2,0,0,0,0|2,0,0]=4 22764 B12R1.1095 [13CH3]OCc1c(cc(cc1Cl)Cl)Cl 34a_100000067030_200025704644 [0,2,0,0,0,0|2,0,0]=4 22765 B12R1.1095 [13CH3]OCc1c(cc(cc1Cl)Cl)Cl 7a_100000067030_200025704644 [0,2,0,0,0,0|2,0,0]=4 22766 B12R1.1095 [13CH3]OCc1c(cc(cc1Cl)I)Cl 7a_200011001976_200025704644 [0,2,0,0,0,0|2,0,0]=4 22767 B12R1.1095 [13CH3]OCc1c(cc(cc1F)Br)F 34a_100011219983_200025704644 [0,2,0,0,0,0|2,0,0]=4 22768 B12R1.1095 [13CH3]OCc1c(cc(cc1F)Br)F 7a_100011219983_200025704644 [0,2,0,0,0,0|2,0,0]=4 22769 B12R1.1095 [13CH3]OCc1c(cc(cc1F)Cl)F 34a_100000043065_200025704644 [0,2,0,0,0,0|2,0,0]=4 22770 B12R1.1095 [13CH3]OCc1c(cc(cc1F)Cl)F 7a_100000043065_200025704644 [0,2,0,0,0,0|2,0,0]=4 22771 B12R1.1095 [13CH3]OCc1c(cc(cc1F)F)F 34a_100011216010_200025704644 [0,2,0,0,0,0|2,0,0]=4 22772 B12R1.1095 [13CH3]OCc1c(cc(cc1F)F)F 7a_100011216010_200025704644 [0,2,0,0,0,0|2,0,0]=4 22773 B12R1.1095 [13CH3]OCc1c(cc(cc1F)I)F 34a_100020934948_200025704644 [0,2,0,0,0,0|2,0,0]=4 22774 B12R1.1095 [13CH3]OCc1c(cc(cc1F)I)F 7a_100020934948_200025704644 [0,2,0,0,0,0|2,0,0]=4 22775 B12R1.1095 [13CH3]SCc1c(cc(cc1Br)F)F 62a_100015786123_200025704644 [0,2,0,0,0,0|2,0,0]=4 22776 B12R1.1095 [13CH3]SCc1c(cc(cc1Br)F)F 62a_200025704644_100015786123 [0,2,0,0,0,0|2,0,0]=4 22777 B12R1.1095 [13CH3]SCc1c(cc(cc1Cl)Cl)Cl 62a_100012339996_200025704644 [0,2,0,0,0,0|2,0,0]=4 22778 B12R1.1095 [13CH3]SCc1c(cc(cc1Cl)Cl)Cl 62a_200025704644_100012339996 [0,2,0,0,0,0|2,0,0]=4 22779 B12R1.1095 [13CH3]SCc1c(cc(cc1F)Br)F 62a_100012355225_200025704644 [0,2,0,0,0,0|2,0,0]=4 22780 B12R1.1095 [13CH3]SCc1c(cc(cc1F)Br)F 62a_200025704644_100012355225 [0,2,0,0,0,0|2,0,0]=4 22781 B12R1.1095 [13CH3]SCc1c(cc(cc1F)Cl)F 62a_100009813723_200025704644 [0,2,0,0,0,0|2,0,0]=4 22782 B12R1.1095 [13CH3]SCc1c(cc(cc1F)Cl)F 62a_200025704644_100009813723 [0,2,0,0,0,0|2,0,0]=4 22783 B12R1.1095 [13CH3]SCc1c(cc(cc1F)F)F 62a_100011216150_200025704644 [0,2,0,0,0,0|2,0,0]=4 22784 B12R1.1095 [13CH3]SCc1c(cc(cc1F)F)F 62a_200025704644_100011216150 [0,2,0,0,0,0|2,0,0]=4 22785 B12R1.1123 CC=Cc1cc(c(cc1O)C)C 271570a_100016259895_100009814663 [0,2,0,0,0,0|0,0,2]=4 22786 B12R1.1123 CC=Cc1cc(c(cc1O)F)F 271570a_100016259895_100009813768 [0,2,0,0,0,0|0,0,2]=4 22787 B12R1.1123 CCNc1cc(c(cc1Br)Br)Br 34a_100009998182_100000210202 [0,2,0,0,0,0|2,0,0]=4 22788 B12R1.1123 CCNc1cc(c(cc1Br)Br)Br 7a_100009998182_100000210202 [0,2,0,0,0,0|2,0,0]=4 22789 B12R1.1123 CCNc1cc(c(cc1Br)Br)C 34a_100009995518_100000210202 [0,2,0,0,0,0|2,0,0]=4 22790 B12R1.1123 CCNc1cc(c(cc1Br)Br)C 7a_100009995518_100000210202 [0,2,0,0,0,0|2,0,0]=4 22791 B12R1.1123 CCNc1cc(c(cc1Br)Br)F 34a_100010212202_100000210202 [0,2,0,0,0,0|2,0,0]=4 22792 B12R1.1123 CCNc1cc(c(cc1Br)Br)F 7a_100010212202_100000210202 [0,2,0,0,0,0|2,0,0]=4 22793 B12R1.1123 CCNc1cc(c(cc1Br)C)Br 34a_100012348304_100000210202 [0,2,0,0,0,0|2,0,0]=4 22794 B12R1.1123 CCNc1cc(c(cc1Br)C)Br 7a_100012348304_100000210202 [0,2,0,0,0,0|2,0,0]=4 22795 B12R1.1123 CCNc1cc(c(cc1Br)C)C 34a_100012337760_100000210202 [0,2,0,0,0,0|2,0,0]=4 22796 B12R1.1123 CCNc1cc(c(cc1Br)C)C 7a_100012337760_100000210202 [0,2,0,0,0,0|2,0,0]=4 22797 B12R1.1123 CCNc1cc(c(cc1Br)C)Cl 34a_100000702286_100000210202 [0,2,0,0,0,0|2,0,0]=4 22798 B12R1.1123 CCNc1cc(c(cc1Br)C)Cl 7a_100000702286_100000210202 [0,2,0,0,0,0|2,0,0]=4 22799 B12R1.1123 CCNc1cc(c(cc1Br)C)F 34a_100011218008_100000210202 [0,2,0,0,0,0|2,0,0]=4 22800 B12R1.1123 CCNc1cc(c(cc1Br)C)F 7a_100011218008_100000210202 [0,2,0,0,0,0|2,0,0]=4 22801 B12R1.1123 CCNc1cc(c(cc1Br)Cl)F 34a_100010254744_100000210202 [0,2,0,0,0,0|2,0,0]=4 22802 B12R1.1123 CCNc1cc(c(cc1Br)Cl)F 7a_100010254744_100000210202 [0,2,0,0,0,0|2,0,0]=4 22803 B12R1.1123 CCNc1cc(c(cc1Br)F)Br 34a_100010131408_100000210202 [0,2,0,0,0,0|2,0,0]=4 22804 B12R1.1123 CCNc1cc(c(cc1Br)F)Br 7a_100010131408_100000210202 [0,2,0,0,0,0|2,0,0]=4 22805 B12R1.1123 CCNc1cc(c(cc1Br)F)C 34a_100010233353_100000210202 [0,2,0,0,0,0|2,0,0]=4 22806 B12R1.1123 CCNc1cc(c(cc1Br)F)C 7a_100010233353_100000210202 [0,2,0,0,0,0|2,0,0]=4 22807 B12R1.1123 CCNc1cc(c(cc1Br)F)Cl 34a_100009817155_100000210202 [0,2,0,0,0,0|2,0,0]=4 22808 B12R1.1123 CCNc1cc(c(cc1Br)F)Cl 7a_100009817155_100000210202 [0,2,0,0,0,0|2,0,0]=4 22809 B12R1.1123 CCNc1cc(c(cc1Br)F)F 34a_100000690790_100000210202 [0,2,0,0,0,0|2,0,0]=4 22810 B12R1.1123 CCNc1cc(c(cc1Br)F)F 7a_100000690790_100000210202 [0,2,0,0,0,0|2,0,0]=4 22811 B12R1.1123 CCNc1cc(c(cc1Br)O)Br 34a_100011080774_100000210202 [0,2,0,0,0,0|2,0,0]=4 22812 B12R1.1123 CCNc1cc(c(cc1Br)O)Br 7a_100011080774_100000210202 [0,2,0,0,0,0|2,0,0]=4 22813 B12R1.1123 CCNc1cc(c(cc1C)Br)C 2230a_100011934712_100000210202 [0,2,0,0,0,0|2,0,0]=4 22814 B12R1.1123 CCNc1cc(c(cc1C)Br)C 34a_100011934712_100000210202 [0,2,0,0,0,0|2,0,0]=4 22815 B12R1.1123 CCNc1cc(c(cc1C)Br)C 7a_100011934712_100000210202 [0,2,0,0,0,0|2,0,0]=4 22816 B12R1.1123 CCNc1cc(c(cc1C)Br)Cl 2230a_100012353740_100000210202 [0,2,0,0,0,0|2,0,0]=4 22817 B12R1.1123 CCNc1cc(c(cc1C)Br)Cl 34a_100012353740_100000210202 [0,2,0,0,0,0|2,0,0]=4 22818 B12R1.1123 CCNc1cc(c(cc1C)Br)Cl 7a_100012353740_100000210202 [0,2,0,0,0,0|2,0,0]=4 22819 B12R1.1123 CCNc1cc(c(cc1C)Br)F 2230a_100000695870_100000210202 [0,2,0,0,0,0|2,0,0]=4 22820 B12R1.1123 CCNc1cc(c(cc1C)Br)F 34a_100000695870_100000210202 [0,2,0,0,0,0|2,0,0]=4 22821 B12R1.1123 CCNc1cc(c(cc1C)Br)F 7a_100000695870_100000210202 [0,2,0,0,0,0|2,0,0]=4 22822 B12R1.1123 CCNc1cc(c(cc1C)C)Br 2230a_100000703630_100000210202 [0,2,0,0,0,0|2,0,0]=4 22823 B12R1.1123 CCNc1cc(c(cc1C)C)Br 34a_100000703630_100000210202 [0,2,0,0,0,0|2,0,0]=4 22824 B12R1.1123 CCNc1cc(c(cc1C)C)Br 7a_100000703630_100000210202 [0,2,0,0,0,0|2,0,0]=4 22825 B12R1.1123 CCNc1cc(c(cc1C)C)C 2230a_100011217141_100000210202 [0,2,0,0,0,0|2,0,0]=4 22826 B12R1.1123 CCNc1cc(c(cc1C)C)C 34a_100011217141_100000210202 [0,2,0,0,0,0|2,0,0]=4 22827 B12R1.1123 CCNc1cc(c(cc1C)C)C 7a_100011217141_100000210202 [0,2,0,0,0,0|2,0,0]=4 22828 B12R1.1123 CCNc1cc(c(cc1C)Cl)Br 2230a_100010244688_100000210202 [0,2,0,0,0,0|2,0,0]=4 22829 B12R1.1123 CCNc1cc(c(cc1C)Cl)Br 34a_100010244688_100000210202 [0,2,0,0,0,0|2,0,0]=4 22830 B12R1.1123 CCNc1cc(c(cc1C)Cl)Br 7a_100010244688_100000210202 [0,2,0,0,0,0|2,0,0]=4 22831 B12R1.1123 CCNc1cc(c(cc1C)Cl)C 2230a_100011830454_100000210202 [0,2,0,0,0,0|2,0,0]=4 22832 B12R1.1123 CCNc1cc(c(cc1C)Cl)C 34a_100011830454_100000210202 [0,2,0,0,0,0|2,0,0]=4 22833 B12R1.1123 CCNc1cc(c(cc1C)Cl)C 7a_100011830454_100000210202 [0,2,0,0,0,0|2,0,0]=4 22834 B12R1.1123 CCNc1cc(c(cc1C)Cl)Cl 34a_100012017293_100000210202 [0,2,0,0,0,0|2,0,0]=4 22835 B12R1.1123 CCNc1cc(c(cc1C)Cl)Cl 7a_100012017293_100000210202 [0,2,0,0,0,0|2,0,0]=4 22836 B12R1.1123 CCNc1cc(c(cc1C)Cl)O 34a_100009961766_100000210202 [0,2,0,0,0,0|2,0,0]=4 22837 B12R1.1123 CCNc1cc(c(cc1C)Cl)O 7a_100009961766_100000210202 [0,2,0,0,0,0|2,0,0]=4 22838 B12R1.1123 CCNc1cc(c(cc1C)F)Br 2230a_100000717900_100000210202 [0,2,0,0,0,0|2,0,0]=4 22839 B12R1.1123 CCNc1cc(c(cc1C)F)Br 34a_100000717900_100000210202 [0,2,0,0,0,0|2,0,0]=4 22840 B12R1.1123 CCNc1cc(c(cc1C)F)Br 7a_100000717900_100000210202 [0,2,0,0,0,0|2,0,0]=4 22841 B12R1.1123 CCNc1cc(c(cc1C)F)Cl 2230a_100012017673_100000210202 [0,2,0,0,0,0|2,0,0]=4 22842 B12R1.1123 CCNc1cc(c(cc1C)F)Cl 34a_100012017673_100000210202 [0,2,0,0,0,0|2,0,0]=4 22843 B12R1.1123 CCNc1cc(c(cc1C)F)Cl 7a_100012017673_100000210202 [0,2,0,0,0,0|2,0,0]=4 22844 B12R1.1123 CCNc1cc(c(cc1C)F)F 2230a_100011830416_100000210202 [0,2,0,0,0,0|2,0,0]=4 22845 B12R1.1123 CCNc1cc(c(cc1C)F)F 34a_100011830416_100000210202 [0,2,0,0,0,0|2,0,0]=4 22846 B12R1.1123 CCNc1cc(c(cc1C)F)F 7a_100011830416_100000210202 [0,2,0,0,0,0|2,0,0]=4 22847 B12R1.1123 CCNc1cc(c(cc1C)I)F 34a_100010291052_100000210202 [0,2,0,0,0,0|2,0,0]=4 22848 B12R1.1123 CCNc1cc(c(cc1C)I)F 7a_100010291052_100000210202 [0,2,0,0,0,0|2,0,0]=4 22849 B12R1.1123 CCNc1cc(c(cc1C)O)C 34a_100000720036_100000210202 [0,2,0,0,0,0|2,0,0]=4 22850 B12R1.1123 CCNc1cc(c(cc1C)O)C 7a_100000720036_100000210202 [0,2,0,0,0,0|2,0,0]=4 22851 B12R1.1123 CCNc1cc(c(cc1Cl)Br)Cl 34a_100000246133_100000210202 [0,2,0,0,0,0|2,0,0]=4 22852 B12R1.1123 CCNc1cc(c(cc1Cl)Br)Cl 7a_100000246133_100000210202 [0,2,0,0,0,0|2,0,0]=4 22853 B12R1.1123 CCNc1cc(c(cc1Cl)Br)F 34a_100000688864_100000210202 [0,2,0,0,0,0|2,0,0]=4 22854 B12R1.1123 CCNc1cc(c(cc1Cl)Br)F 7a_100000688864_100000210202 [0,2,0,0,0,0|2,0,0]=4 22855 B12R1.1123 CCNc1cc(c(cc1Cl)C)C 34a_100012183282_100000210202 [0,2,0,0,0,0|2,0,0]=4 22856 B12R1.1123 CCNc1cc(c(cc1Cl)C)C 7a_100012183282_100000210202 [0,2,0,0,0,0|2,0,0]=4 22857 B12R1.1123 CCNc1cc(c(cc1Cl)C)O 34a_100000092876_100000210202 [0,2,0,0,0,0|2,0,0]=4 22858 B12R1.1123 CCNc1cc(c(cc1Cl)C)O 7a_100000092876_100000210202 [0,2,0,0,0,0|2,0,0]=4 22859 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)Br 34a_200012360370_100000210202 [0,2,0,0,0,0|2,0,0]=4 22860 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)Br 7a_200012360370_100000210202 [0,2,0,0,0,0|2,0,0]=4 22861 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)C 34a_100012000392_100000210202 [0,2,0,0,0,0|2,0,0]=4 22862 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)C 7a_100012000392_100000210202 [0,2,0,0,0,0|2,0,0]=4 22863 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)Cl 34a_100000211015_100000210202 [0,2,0,0,0,0|2,0,0]=4 22864 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)Cl 7a_100000211015_100000210202 [0,2,0,0,0,0|2,0,0]=4 22865 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)F 34a_100012017157_100000210202 [0,2,0,0,0,0|2,0,0]=4 22866 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)F 7a_100012017157_100000210202 [0,2,0,0,0,0|2,0,0]=4 22867 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)I 7a_100016224655_100000210202 [0,2,0,0,0,0|2,0,0]=4 22868 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)O 34a_100000037174_100000210202 [0,2,0,0,0,0|2,0,0]=4 22869 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)O 7a_100000037174_100000210202 [0,2,0,0,0,0|2,0,0]=4 22870 B12R1.1123 CCNc1cc(c(cc1Cl)F)Br 34a_100000685351_100000210202 [0,2,0,0,0,0|2,0,0]=4 22871 B12R1.1123 CCNc1cc(c(cc1Cl)F)Br 7a_100000685351_100000210202 [0,2,0,0,0,0|2,0,0]=4 22872 B12R1.1123 CCNc1cc(c(cc1Cl)F)C 34a_100000729549_100000210202 [0,2,0,0,0,0|2,0,0]=4 22873 B12R1.1123 CCNc1cc(c(cc1Cl)F)C 7a_100000729549_100000210202 [0,2,0,0,0,0|2,0,0]=4 22874 B12R1.1123 CCNc1cc(c(cc1Cl)F)Cl 34a_100000085081_100000210202 [0,2,0,0,0,0|2,0,0]=4 22875 B12R1.1123 CCNc1cc(c(cc1Cl)F)Cl 7a_100000085081_100000210202 [0,2,0,0,0,0|2,0,0]=4 22876 B12R1.1123 CCNc1cc(c(cc1Cl)F)F 34a_100000766337_100000210202 [0,2,0,0,0,0|2,0,0]=4 22877 B12R1.1123 CCNc1cc(c(cc1Cl)F)F 7a_100000766337_100000210202 [0,2,0,0,0,0|2,0,0]=4 22878 B12R1.1123 CCNc1cc(c(cc1Cl)O)Cl 34a_100012000071_100000210202 [0,2,0,0,0,0|2,0,0]=4 22879 B12R1.1123 CCNc1cc(c(cc1Cl)O)Cl 7a_100012000071_100000210202 [0,2,0,0,0,0|2,0,0]=4 22880 B12R1.1123 CCNc1cc(c(cc1Cl)O)F 34a_100009886023_100000210202 [0,2,0,0,0,0|2,0,0]=4 22881 B12R1.1123 CCNc1cc(c(cc1Cl)O)F 7a_100009886023_100000210202 [0,2,0,0,0,0|2,0,0]=4 22882 B12R1.1123 CCNc1cc(c(cc1F)Br)Br 34a_200010212207_100000210202 [0,2,0,0,0,0|2,0,0]=4 22883 B12R1.1123 CCNc1cc(c(cc1F)Br)Br 7a_200010212207_100000210202 [0,2,0,0,0,0|2,0,0]=4 22884 B12R1.1123 CCNc1cc(c(cc1F)Br)C 2230a_100000691575_100000210202 [0,2,0,0,0,0|2,0,0]=4 22885 B12R1.1123 CCNc1cc(c(cc1F)Br)C 34a_100000691575_100000210202 [0,2,0,0,0,0|2,0,0]=4 22886 B12R1.1123 CCNc1cc(c(cc1F)Br)C 7a_100000691575_100000210202 [0,2,0,0,0,0|2,0,0]=4 22887 B12R1.1123 CCNc1cc(c(cc1F)Br)Cl 34a_100012356688_100000210202 [0,2,0,0,0,0|2,0,0]=4 22888 B12R1.1123 CCNc1cc(c(cc1F)Br)Cl 7a_100012356688_100000210202 [0,2,0,0,0,0|2,0,0]=4 22889 B12R1.1123 CCNc1cc(c(cc1F)Br)F 2230a_100000690247_100000210202 [0,2,0,0,0,0|2,0,0]=4 22890 B12R1.1123 CCNc1cc(c(cc1F)Br)F 34a_100000690247_100000210202 [0,2,0,0,0,0|2,0,0]=4 22891 B12R1.1123 CCNc1cc(c(cc1F)Br)F 7a_100000690247_100000210202 [0,2,0,0,0,0|2,0,0]=4 22892 B12R1.1123 CCNc1cc(c(cc1F)C)Br 2230a_100010239588_100000210202 [0,2,0,0,0,0|2,0,0]=4 22893 B12R1.1123 CCNc1cc(c(cc1F)C)Br 34a_100010239588_100000210202 [0,2,0,0,0,0|2,0,0]=4 22894 B12R1.1123 CCNc1cc(c(cc1F)C)Br 7a_100010239588_100000210202 [0,2,0,0,0,0|2,0,0]=4 22895 B12R1.1123 CCNc1cc(c(cc1F)C)F 2230a_100012002673_100000210202 [0,2,0,0,0,0|2,0,0]=4 22896 B12R1.1123 CCNc1cc(c(cc1F)C)F 34a_100012002673_100000210202 [0,2,0,0,0,0|2,0,0]=4 22897 B12R1.1123 CCNc1cc(c(cc1F)C)F 7a_100012002673_100000210202 [0,2,0,0,0,0|2,0,0]=4 22898 B12R1.1123 CCNc1cc(c(cc1F)C)I 34a_100011014115_100000210202 [0,2,0,0,0,0|2,0,0]=4 22899 B12R1.1123 CCNc1cc(c(cc1F)C)I 7a_100011014115_100000210202 [0,2,0,0,0,0|2,0,0]=4 22900 B12R1.1123 CCNc1cc(c(cc1F)C)O 34a_100000117193_100000210202 [0,2,0,0,0,0|2,0,0]=4 22901 B12R1.1123 CCNc1cc(c(cc1F)C)O 7a_100000117193_100000210202 [0,2,0,0,0,0|2,0,0]=4 22902 B12R1.1123 CCNc1cc(c(cc1F)Cl)Br 34a_100013023876_100000210202 [0,2,0,0,0,0|2,0,0]=4 22903 B12R1.1123 CCNc1cc(c(cc1F)Cl)Br 7a_100013023876_100000210202 [0,2,0,0,0,0|2,0,0]=4 22904 B12R1.1123 CCNc1cc(c(cc1F)Cl)C 34a_100000091823_100000210202 [0,2,0,0,0,0|2,0,0]=4 22905 B12R1.1123 CCNc1cc(c(cc1F)Cl)C 7a_100000091823_100000210202 [0,2,0,0,0,0|2,0,0]=4 22906 B12R1.1123 CCNc1cc(c(cc1F)Cl)Cl 34a_100000724578_100000210202 [0,2,0,0,0,0|2,0,0]=4 22907 B12R1.1123 CCNc1cc(c(cc1F)Cl)Cl 7a_100000724578_100000210202 [0,2,0,0,0,0|2,0,0]=4 22908 B12R1.1123 CCNc1cc(c(cc1F)Cl)F 34a_100011998097_100000210202 [0,2,0,0,0,0|2,0,0]=4 22909 B12R1.1123 CCNc1cc(c(cc1F)Cl)F 7a_100011998097_100000210202 [0,2,0,0,0,0|2,0,0]=4 22910 B12R1.1123 CCNc1cc(c(cc1F)Cl)O 34a_100000042052_100000210202 [0,2,0,0,0,0|2,0,0]=4 22911 B12R1.1123 CCNc1cc(c(cc1F)Cl)O 7a_100000042052_100000210202 [0,2,0,0,0,0|2,0,0]=4 22912 B12R1.1123 CCNc1cc(c(cc1F)F)Br 2230a_100000700208_100000210202 [0,2,0,0,0,0|2,0,0]=4 22913 B12R1.1123 CCNc1cc(c(cc1F)F)Br 34a_100000700208_100000210202 [0,2,0,0,0,0|2,0,0]=4 22914 B12R1.1123 CCNc1cc(c(cc1F)F)Br 7a_100000700208_100000210202 [0,2,0,0,0,0|2,0,0]=4 22915 B12R1.1123 CCNc1cc(c(cc1F)F)Cl 2230a_100011998096_100000210202 [0,2,0,0,0,0|2,0,0]=4 22916 B12R1.1123 CCNc1cc(c(cc1F)F)Cl 34a_100011998096_100000210202 [0,2,0,0,0,0|2,0,0]=4 22917 B12R1.1123 CCNc1cc(c(cc1F)F)Cl 7a_100011998096_100000210202 [0,2,0,0,0,0|2,0,0]=4 22918 B12R1.1123 CCNc1cc(c(cc1F)F)F 2230a_100000750162_100000210202 [0,2,0,0,0,0|2,0,0]=4 22919 B12R1.1123 CCNc1cc(c(cc1F)F)F 34a_100000750162_100000210202 [0,2,0,0,0,0|2,0,0]=4 22920 B12R1.1123 CCNc1cc(c(cc1F)F)F 7a_100000750162_100000210202 [0,2,0,0,0,0|2,0,0]=4 22921 B12R1.1123 CCNc1cc(c(cc1F)F)O 34a_100011219470_100000210202 [0,2,0,0,0,0|2,0,0]=4 22922 B12R1.1123 CCNc1cc(c(cc1F)F)O 7a_100011219470_100000210202 [0,2,0,0,0,0|2,0,0]=4 22923 B12R1.1123 CCNc1cc(c(cc1F)I)F 34a_100010185194_100000210202 [0,2,0,0,0,0|2,0,0]=4 22924 B12R1.1123 CCNc1cc(c(cc1F)I)F 7a_100010185194_100000210202 [0,2,0,0,0,0|2,0,0]=4 22925 B12R1.1123 CCNc1cc(c(cc1F)O)F 34a_100020635945_100000210202 [0,2,0,0,0,0|2,0,0]=4 22926 B12R1.1123 CCNc1cc(c(cc1F)O)F 7a_100020635945_100000210202 [0,2,0,0,0,0|2,0,0]=4 22927 B12R1.1123 CCNc1cc(c(cc1I)Br)F 34a_100010888672_100000210202 [0,2,0,0,0,0|2,0,0]=4 22928 B12R1.1123 CCNc1cc(c(cc1I)Br)F 7a_100010888672_100000210202 [0,2,0,0,0,0|2,0,0]=4 22929 B12R1.1123 CCNc1cc(c(cc1I)C)Br 34a_200015600912_100000210202 [0,2,0,0,0,0|2,0,0]=4 22930 B12R1.1123 CCNc1cc(c(cc1I)C)Br 7a_200015600912_100000210202 [0,2,0,0,0,0|2,0,0]=4 22931 B12R1.1123 CCNc1cc(c(cc1I)C)C 34a_100012353678_100000210202 [0,2,0,0,0,0|2,0,0]=4 22932 B12R1.1123 CCNc1cc(c(cc1I)C)C 7a_100012353678_100000210202 [0,2,0,0,0,0|2,0,0]=4 22933 B12R1.1123 CCNc1cc(c(cc1I)Cl)Cl 7a_200011093942_100000210202 [0,2,0,0,0,0|2,0,0]=4 22934 B12R1.1123 CCNc1cc(c(cc1I)Cl)F 34a_100010892166_100000210202 [0,2,0,0,0,0|2,0,0]=4 22935 B12R1.1123 CCNc1cc(c(cc1I)Cl)F 7a_100010892166_100000210202 [0,2,0,0,0,0|2,0,0]=4 22936 B12R1.1123 CCNc1cc(c(cc1I)F)Br 34a_200021016574_100000210202 [0,2,0,0,0,0|2,0,0]=4 22937 B12R1.1123 CCNc1cc(c(cc1I)F)Br 7a_200021016574_100000210202 [0,2,0,0,0,0|2,0,0]=4 22938 B12R1.1123 CCNc1cc(c(cc1I)F)C 34a_100010238302_100000210202 [0,2,0,0,0,0|2,0,0]=4 22939 B12R1.1123 CCNc1cc(c(cc1I)F)C 7a_100010238302_100000210202 [0,2,0,0,0,0|2,0,0]=4 22940 B12R1.1123 CCNc1cc(c(cc1I)F)Cl 34a_200010992381_100000210202 [0,2,0,0,0,0|2,0,0]=4 22941 B12R1.1123 CCNc1cc(c(cc1I)F)Cl 7a_200010992381_100000210202 [0,2,0,0,0,0|2,0,0]=4 22942 B12R1.1123 CCNc1cc(c(cc1I)F)F 34a_100000765032_100000210202 [0,2,0,0,0,0|2,0,0]=4 22943 B12R1.1123 CCNc1cc(c(cc1I)F)F 7a_100000765032_100000210202 [0,2,0,0,0,0|2,0,0]=4 22944 B12R1.1123 CCNc1cc(c(cc1O)Br)Br 7a_200010781931_100000210202 [0,2,0,0,0,0|1,0,0]=3 22945 B12R1.1123 CCNc1cc(c(cc1O)Br)C 34a_200010107346_100000210202 [0,2,0,0,0,0|1,0,0]=3 22946 B12R1.1123 CCNc1cc(c(cc1O)Br)F 34a_100013038943_100000210202 [0,2,0,0,0,0|1,0,0]=3 22947 B12R1.1123 CCNc1cc(c(cc1O)Br)F 7a_100013038943_100000210202 [0,2,0,0,0,0|1,0,0]=3 22948 B12R1.1123 CCNc1cc(c(cc1O)C)Br 34a_200010235796_100000210202 [0,2,0,0,0,0|1,0,0]=3 22949 B12R1.1123 CCNc1cc(c(cc1O)C)Br 7a_200010235796_100000210202 [0,2,0,0,0,0|1,0,0]=3 22950 B12R1.1123 CCNc1cc(c(cc1O)C)C 34a_100133014134_100000210202 [0,2,0,0,0,0|1,0,0]=3 22951 B12R1.1123 CCNc1cc(c(cc1O)C)C 7a_100133014134_100000210202 [0,2,0,0,0,0|1,0,0]=3 22952 B12R1.1123 CCNc1cc(c(cc1O)C)Cl 34a_100000091707_100000210202 [0,2,0,0,0,0|1,0,0]=3 22953 B12R1.1123 CCNc1cc(c(cc1O)Cl)Br 34a_100013488937_100000210202 [0,2,0,0,0,0|1,0,0]=3 22954 B12R1.1123 CCNc1cc(c(cc1O)Cl)Br 7a_100013488937_100000210202 [0,2,0,0,0,0|1,0,0]=3 22955 B12R1.1123 CCNc1cc(c(cc1O)Cl)Cl 34a_100000696747_100000210202 [0,2,0,0,0,0|1,0,0]=3 22956 B12R1.1123 CCNc1cc(c(cc1O)Cl)Cl 7a_100000696747_100000210202 [0,2,0,0,0,0|1,0,0]=3 22957 B12R1.1123 CCNc1cc(c(cc1O)F)Br 34a_100012359894_100000210202 [0,2,0,0,0,0|1,0,0]=3 22958 B12R1.1123 CCNc1cc(c(cc1O)F)Br 7a_100012359894_100000210202 [0,2,0,0,0,0|1,0,0]=3 22959 B12R1.1123 CCNc1cc(c(cc1O)F)C 34a_100012022779_100000210202 [0,2,0,0,0,0|1,0,0]=3 22960 B12R1.1123 CCNc1cc(c(cc1O)F)C 7a_100012022779_100000210202 [0,2,0,0,0,0|1,0,0]=3 22961 B12R1.1123 CCNc1cc(c(cc1O)F)F 2230a_106722365970_100000210202 [0,2,0,0,0,0|1,0,0]=3 22962 B12R1.1123 CCNc1cc(c(cc1O)F)F 34a_106722365970_100000210202 [0,2,0,0,0,0|1,0,0]=3 22963 B12R1.1123 CCNc1cc(c(cc1O)F)F 7a_106722365970_100000210202 [0,2,0,0,0,0|1,0,0]=3 22964 B12R1.1123 CCOc1cc(c(cc1Br)C)C 34a_100009814663_100000210202 [0,2,0,0,0,0|2,0,0]=4 22965 B12R1.1123 CCOc1cc(c(cc1Br)C)C 7a_100009814663_100000210202 [0,2,0,0,0,0|2,0,0]=4 22966 B12R1.1123 CCOc1cc(c(cc1Br)Cl)C 34a_100022700756_100000210202 [0,2,0,0,0,0|2,0,0]=4 22967 B12R1.1123 CCOc1cc(c(cc1Br)Cl)C 7a_100022700756_100000210202 [0,2,0,0,0,0|2,0,0]=4 22968 B12R1.1123 CCOc1cc(c(cc1Br)F)F 34a_100009813768_100000210202 [0,2,0,0,0,0|2,0,0]=4 22969 B12R1.1123 CCOc1cc(c(cc1Br)F)F 7a_100009813768_100000210202 [0,2,0,0,0,0|2,0,0]=4 22970 B12R1.1123 CCOc1cc(c(cc1Br)N)Br 34a_100011080774_100000210202 [0,2,0,0,0,0|2,0,0]=4 22971 B12R1.1123 CCOc1cc(c(cc1Br)N)Br 7a_100011080774_100000210202 [0,2,0,0,0,0|2,0,0]=4 22972 B12R1.1123 CCOc1cc(c(cc1C)Br)C 34a_100000698207_100000210202 [0,2,0,0,0,0|2,0,0]=4 22973 B12R1.1123 CCOc1cc(c(cc1C)Br)C 7a_100000698207_100000210202 [0,2,0,0,0,0|2,0,0]=4 22974 B12R1.1123 CCOc1cc(c(cc1C)C)C 34a_200000047129_100000210202 [0,2,0,0,0,0|2,0,0]=4 22975 B12R1.1123 CCOc1cc(c(cc1C)C)C 7a_200000047129_100000210202 [0,2,0,0,0,0|2,0,0]=4 22976 B12R1.1123 CCOc1cc(c(cc1C)Cl)N 34a_100000092876_100000210202 [0,2,0,0,0,0|2,0,0]=4 22977 B12R1.1123 CCOc1cc(c(cc1C)Cl)N 7a_100000092876_100000210202 [0,2,0,0,0,0|2,0,0]=4 22978 B12R1.1123 CCOc1cc(c(cc1C)F)Br 34a_100014242602_100000210202 [0,2,0,0,0,0|2,0,0]=4 22979 B12R1.1123 CCOc1cc(c(cc1C)F)Br 7a_100014242602_100000210202 [0,2,0,0,0,0|2,0,0]=4 22980 B12R1.1123 CCOc1cc(c(cc1C)F)C 34a_100010674473_100000210202 [0,2,0,0,0,0|2,0,0]=4 22981 B12R1.1123 CCOc1cc(c(cc1C)F)C 7a_100010674473_100000210202 [0,2,0,0,0,0|2,0,0]=4 22982 B12R1.1123 CCOc1cc(c(cc1C)F)F 34a_100000728840_100000210202 [0,2,0,0,0,0|2,0,0]=4 22983 B12R1.1123 CCOc1cc(c(cc1C)F)F 7a_100000728840_100000210202 [0,2,0,0,0,0|2,0,0]=4 22984 B12R1.1123 CCOc1cc(c(cc1C)F)I 34a_100010080512_100000210202 [0,2,0,0,0,0|2,0,0]=4 22985 B12R1.1123 CCOc1cc(c(cc1C)F)I 7a_100010080512_100000210202 [0,2,0,0,0,0|2,0,0]=4 22986 B12R1.1123 CCOc1cc(c(cc1C)F)N 34a_100000117193_100000210202 [0,2,0,0,0,0|2,0,0]=4 22987 B12R1.1123 CCOc1cc(c(cc1C)F)N 7a_100000117193_100000210202 [0,2,0,0,0,0|2,0,0]=4 22988 B12R1.1123 CCOc1cc(c(cc1C)I)C 34a_200011215153_100000210202 [0,2,0,0,0,0|2,0,0]=4 22989 B12R1.1123 CCOc1cc(c(cc1C)I)C 7a_200011215153_100000210202 [0,2,0,0,0,0|2,0,0]=4 22990 B12R1.1123 CCOc1cc(c(cc1C)N)C 34a_100000720036_100000210202 [0,2,0,0,0,0|2,0,0]=4 22991 B12R1.1123 CCOc1cc(c(cc1C)N)C 7a_100000720036_100000210202 [0,2,0,0,0,0|2,0,0]=4 22992 B12R1.1123 CCOc1cc(c(cc1Cl)Br)C 34a_200012350488_100000210202 [0,2,0,0,0,0|2,0,0]=4 22993 B12R1.1123 CCOc1cc(c(cc1Cl)Br)C 7a_200012350488_100000210202 [0,2,0,0,0,0|2,0,0]=4 22994 B12R1.1123 CCOc1cc(c(cc1Cl)Br)Cl 34a_100000719705_100000210202 [0,2,0,0,0,0|2,0,0]=4 22995 B12R1.1123 CCOc1cc(c(cc1Cl)Br)Cl 7a_100000719705_100000210202 [0,2,0,0,0,0|2,0,0]=4 22996 B12R1.1123 CCOc1cc(c(cc1Cl)Br)F 34a_100000726166_100000210202 [0,2,0,0,0,0|2,0,0]=4 22997 B12R1.1123 CCOc1cc(c(cc1Cl)Br)F 7a_100000726166_100000210202 [0,2,0,0,0,0|2,0,0]=4 22998 B12R1.1123 CCOc1cc(c(cc1Cl)Br)I 34a_100021297947_100000210202 [0,2,0,0,0,0|2,0,0]=4 22999 B12R1.1123 CCOc1cc(c(cc1Cl)Br)I 7a_100021297947_100000210202 [0,2,0,0,0,0|2,0,0]=4 23000 B12R1.1123 CCOc1cc(c(cc1Cl)C)C 34a_100000031796_100000210202 [0,2,0,0,0,0|2,0,0]=4 23001 B12R1.1123 CCOc1cc(c(cc1Cl)C)C 7a_100000031796_100000210202 [0,2,0,0,0,0|2,0,0]=4 23002 B12R1.1123 CCOc1cc(c(cc1Cl)C)N 34a_100009961766_100000210202 [0,2,0,0,0,0|2,0,0]=4 23003 B12R1.1123 CCOc1cc(c(cc1Cl)C)N 7a_100009961766_100000210202 [0,2,0,0,0,0|2,0,0]=4 23004 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)Br 34a_100010203734_100000210202 [0,2,0,0,0,0|2,0,0]=4 23005 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)Br 7a_100010203734_100000210202 [0,2,0,0,0,0|2,0,0]=4 23006 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)C 34a_100012002691_100000210202 [0,2,0,0,0,0|2,0,0]=4 23007 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)C 7a_100012002691_100000210202 [0,2,0,0,0,0|2,0,0]=4 23008 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)Cl 34a_100000211312_100000210202 [0,2,0,0,0,0|2,0,0]=4 23009 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)Cl 7a_100000211312_100000210202 [0,2,0,0,0,0|2,0,0]=4 23010 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)N 34a_100000037174_100000210202 [0,2,0,0,0,0|2,0,0]=4 23011 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)N 7a_100000037174_100000210202 [0,2,0,0,0,0|2,0,0]=4 23012 B12R1.1123 CCOc1cc(c(cc1Cl)F)Br 34a_100010189047_100000210202 [0,2,0,0,0,0|2,0,0]=4 23013 B12R1.1123 CCOc1cc(c(cc1Cl)F)Br 7a_100010189047_100000210202 [0,2,0,0,0,0|2,0,0]=4 23014 B12R1.1123 CCOc1cc(c(cc1Cl)F)F 34a_100009848785_100000210202 [0,2,0,0,0,0|2,0,0]=4 23015 B12R1.1123 CCOc1cc(c(cc1Cl)F)F 7a_100009848785_100000210202 [0,2,0,0,0,0|2,0,0]=4 23016 B12R1.1123 CCOc1cc(c(cc1Cl)F)I 34a_100010735246_100000210202 [0,2,0,0,0,0|2,0,0]=4 23017 B12R1.1123 CCOc1cc(c(cc1Cl)F)I 7a_100010735246_100000210202 [0,2,0,0,0,0|2,0,0]=4 23018 B12R1.1123 CCOc1cc(c(cc1Cl)F)N 34a_100000042052_100000210202 [0,2,0,0,0,0|2,0,0]=4 23019 B12R1.1123 CCOc1cc(c(cc1Cl)F)N 7a_100000042052_100000210202 [0,2,0,0,0,0|2,0,0]=4 23020 B12R1.1123 CCOc1cc(c(cc1Cl)N)Cl 34a_100012000071_100000210202 [0,2,0,0,0,0|2,0,0]=4 23021 B12R1.1123 CCOc1cc(c(cc1Cl)N)Cl 7a_100012000071_100000210202 [0,2,0,0,0,0|2,0,0]=4 23022 B12R1.1123 CCOc1cc(c(cc1F)Br)C 34a_100012355673_100000210202 [0,2,0,0,0,0|2,0,0]=4 23023 B12R1.1123 CCOc1cc(c(cc1F)Br)C 7a_100012355673_100000210202 [0,2,0,0,0,0|2,0,0]=4 23024 B12R1.1123 CCOc1cc(c(cc1F)Br)F 34a_100011830439_100000210202 [0,2,0,0,0,0|2,0,0]=4 23025 B12R1.1123 CCOc1cc(c(cc1F)Br)F 7a_100011830439_100000210202 [0,2,0,0,0,0|2,0,0]=4 23026 B12R1.1123 CCOc1cc(c(cc1F)C)Br 34a_100010068922_100000210202 [0,2,0,0,0,0|2,0,0]=4 23027 B12R1.1123 CCOc1cc(c(cc1F)C)Br 7a_100010068922_100000210202 [0,2,0,0,0,0|2,0,0]=4 23028 B12R1.1123 CCOc1cc(c(cc1F)F)Br 34a_100012457948_100000210202 [0,2,0,0,0,0|2,0,0]=4 23029 B12R1.1123 CCOc1cc(c(cc1F)F)Br 7a_100012457948_100000210202 [0,2,0,0,0,0|2,0,0]=4 23030 B12R1.1123 CCOc1cc(c(cc1F)F)F 34a_100000237555_100000210202 [0,2,0,0,0,0|2,0,0]=4 23031 B12R1.1123 CCOc1cc(c(cc1F)F)F 7a_100000237555_100000210202 [0,2,0,0,0,0|2,0,0]=4 23032 B12R1.1123 CCOc1cc(c(cc1F)F)I 34a_100015789030_100000210202 [0,2,0,0,0,0|2,0,0]=4 23033 B12R1.1123 CCOc1cc(c(cc1F)F)I 7a_100015789030_100000210202 [0,2,0,0,0,0|2,0,0]=4 23034 B12R1.1123 CCOc1cc(c(cc1F)F)N 34a_100011219470_100000210202 [0,2,0,0,0,0|2,0,0]=4 23035 B12R1.1123 CCOc1cc(c(cc1F)F)N 7a_100011219470_100000210202 [0,2,0,0,0,0|2,0,0]=4 23036 B12R1.1123 CCOc1cc(c(cc1F)N)Cl 34a_100009886023_100000210202 [0,2,0,0,0,0|2,0,0]=4 23037 B12R1.1123 CCOc1cc(c(cc1F)N)Cl 7a_100009886023_100000210202 [0,2,0,0,0,0|2,0,0]=4 23038 B12R1.1123 CCOc1cc(c(cc1F)N)F 34a_100020635945_100000210202 [0,2,0,0,0,0|2,0,0]=4 23039 B12R1.1123 CCOc1cc(c(cc1F)N)F 7a_100020635945_100000210202 [0,2,0,0,0,0|2,0,0]=4 23040 B12R1.1123 CCOc1cc(c(cc1I)F)F 34a_100010749349_100000210202 [0,2,0,0,0,0|2,0,0]=4 23041 B12R1.1123 CCOc1cc(c(cc1I)F)F 7a_100010749349_100000210202 [0,2,0,0,0,0|2,0,0]=4 23042 B12R1.1123 CCOc1cc(c(cc1N)Br)Br 34a_200010781931_100000210202 [0,2,0,0,0,0|2,0,0]=4 23043 B12R1.1123 CCOc1cc(c(cc1N)Br)Br 7a_200010781931_100000210202 [0,2,0,0,0,0|2,0,0]=4 23044 B12R1.1123 CCOc1cc(c(cc1N)Br)C 34a_200010235796_100000210202 [0,2,0,0,0,0|2,0,0]=4 23045 B12R1.1123 CCOc1cc(c(cc1N)Br)C 7a_200010235796_100000210202 [0,2,0,0,0,0|2,0,0]=4 23046 B12R1.1123 CCOc1cc(c(cc1N)Br)Cl 34a_100013488937_100000210202 [0,2,0,0,0,0|2,0,0]=4 23047 B12R1.1123 CCOc1cc(c(cc1N)Br)Cl 7a_100013488937_100000210202 [0,2,0,0,0,0|2,0,0]=4 23048 B12R1.1123 CCOc1cc(c(cc1N)Br)F 34a_100012359894_100000210202 [0,2,0,0,0,0|2,0,0]=4 23049 B12R1.1123 CCOc1cc(c(cc1N)Br)F 7a_100012359894_100000210202 [0,2,0,0,0,0|2,0,0]=4 23050 B12R1.1123 CCOc1cc(c(cc1N)C)Br 34a_200010107346_100000210202 [0,2,0,0,0,0|2,0,0]=4 23051 B12R1.1123 CCOc1cc(c(cc1N)C)Br 7a_200010107346_100000210202 [0,2,0,0,0,0|2,0,0]=4 23052 B12R1.1123 CCOc1cc(c(cc1N)C)C 34a_100133014134_100000210202 [0,2,0,0,0,0|2,0,0]=4 23053 B12R1.1123 CCOc1cc(c(cc1N)C)C 7a_100133014134_100000210202 [0,2,0,0,0,0|2,0,0]=4 23054 B12R1.1123 CCOc1cc(c(cc1N)C)F 34a_100012022779_100000210202 [0,2,0,0,0,0|2,0,0]=4 23055 B12R1.1123 CCOc1cc(c(cc1N)C)F 7a_100012022779_100000210202 [0,2,0,0,0,0|2,0,0]=4 23056 B12R1.1123 CCOc1cc(c(cc1N)Cl)C 34a_100000091707_100000210202 [0,2,0,0,0,0|2,0,0]=4 23057 B12R1.1123 CCOc1cc(c(cc1N)Cl)C 7a_100000091707_100000210202 [0,2,0,0,0,0|2,0,0]=4 23058 B12R1.1123 CCOc1cc(c(cc1N)Cl)Cl 34a_100000696747_100000210202 [0,2,0,0,0,0|2,0,0]=4 23059 B12R1.1123 CCOc1cc(c(cc1N)Cl)Cl 7a_100000696747_100000210202 [0,2,0,0,0,0|2,0,0]=4 23060 B12R1.1123 CCOc1cc(c(cc1N)F)Br 34a_100013038943_100000210202 [0,2,0,0,0,0|2,0,0]=4 23061 B12R1.1123 CCOc1cc(c(cc1N)F)Br 7a_100013038943_100000210202 [0,2,0,0,0,0|2,0,0]=4 23062 B12R1.1123 CCOc1cc(c(cc1N)F)F 34a_100011217416_100000210202 [0,2,0,0,0,0|2,0,0]=4 23063 B12R1.1123 CCOc1cc(c(cc1N)F)F 7a_100011217416_100000210202 [0,2,0,0,0,0|2,0,0]=4 23064 B12R1.1123 CCOc1cc(c(cc1N)I)Cl 34a_100011011175_100000210202 [0,2,0,0,0,0|2,0,0]=4 23065 B12R1.1123 CCOc1cc(c(cc1N)I)Cl 7a_100011011175_100000210202 [0,2,0,0,0,0|2,0,0]=4 23066 B12R1.1123 CCSc1cc(c(cc1Br)Br)Br 62a_100000210202_100010151546 [0,2,0,0,0,0|2,0,0]=4 23067 B12R1.1123 CCSc1cc(c(cc1Br)Br)Br 62a_100010151546_100000210202 [0,2,0,0,0,0|2,0,0]=4 23068 B12R1.1123 CCSc1cc(c(cc1Br)Br)F 62a_100000210202_200010212206 [0,2,0,0,0,0|2,0,0]=4 23069 B12R1.1123 CCSc1cc(c(cc1Br)Br)F 62a_200010212206_100000210202 [0,2,0,0,0,0|2,0,0]=4 23070 B12R1.1123 CCSc1cc(c(cc1Br)C)Br 62a_100000210202_100012929169 [0,2,0,0,0,0|2,0,0]=4 23071 B12R1.1123 CCSc1cc(c(cc1Br)C)Br 62a_100012929169_100000210202 [0,2,0,0,0,0|2,0,0]=4 23072 B12R1.1123 CCSc1cc(c(cc1Br)C)F 62a_100000210202_200009814774 [0,2,0,0,0,0|2,0,0]=4 23073 B12R1.1123 CCSc1cc(c(cc1Br)C)F 62a_200009814774_100000210202 [0,2,0,0,0,0|2,0,0]=4 23074 B12R1.1123 CCSc1cc(c(cc1Br)Cl)F 62a_100000210202_100010254745 [0,2,0,0,0,0|2,0,0]=4 23075 B12R1.1123 CCSc1cc(c(cc1Br)Cl)F 62a_100010254745_100000210202 [0,2,0,0,0,0|2,0,0]=4 23076 B12R1.1123 CCSc1cc(c(cc1Br)Cl)O 62a_100000210202_100021297947 [0,2,0,0,0,0|2,0,0]=4 23077 B12R1.1123 CCSc1cc(c(cc1Br)Cl)O 62a_100021297947_100000210202 [0,2,0,0,0,0|2,0,0]=4 23078 B12R1.1123 CCSc1cc(c(cc1Br)F)C 62a_100000210202_200009814773 [0,2,0,0,0,0|2,0,0]=4 23079 B12R1.1123 CCSc1cc(c(cc1Br)F)C 62a_200009814773_100000210202 [0,2,0,0,0,0|2,0,0]=4 23080 B12R1.1123 CCSc1cc(c(cc1Br)F)F 62a_100000210202_100010259568 [0,2,0,0,0,0|2,0,0]=4 23081 B12R1.1123 CCSc1cc(c(cc1Br)F)F 62a_100010259568_100000210202 [0,2,0,0,0,0|2,0,0]=4 23082 B12R1.1123 CCSc1cc(c(cc1C)Br)C 62a_100000210202_100011356911 [0,2,0,0,0,0|2,0,0]=4 23083 B12R1.1123 CCSc1cc(c(cc1C)Br)C 62a_100011356911_100000210202 [0,2,0,0,0,0|2,0,0]=4 23084 B12R1.1123 CCSc1cc(c(cc1C)Br)Cl 62a_100000210202_200009814780 [0,2,0,0,0,0|2,0,0]=4 23085 B12R1.1123 CCSc1cc(c(cc1C)Br)Cl 62a_200009814780_100000210202 [0,2,0,0,0,0|2,0,0]=4 23086 B12R1.1123 CCSc1cc(c(cc1C)Br)F 62a_100000210202_100011356895 [0,2,0,0,0,0|2,0,0]=4 23087 B12R1.1123 CCSc1cc(c(cc1C)Br)F 62a_100011356895_100000210202 [0,2,0,0,0,0|2,0,0]=4 23088 B12R1.1123 CCSc1cc(c(cc1C)C)C 62a_100000210202_100000759388 [0,2,0,0,0,0|2,0,0]=4 23089 B12R1.1123 CCSc1cc(c(cc1C)C)C 62a_100000759388_100000210202 [0,2,0,0,0,0|2,0,0]=4 23090 B12R1.1123 CCSc1cc(c(cc1C)C)N 62a_100000210202_100000703630 [0,2,0,0,0,0|2,0,0]=4 23091 B12R1.1123 CCSc1cc(c(cc1C)C)N 62a_100000703630_100000210202 [0,2,0,0,0,0|2,0,0]=4 23092 B12R1.1123 CCSc1cc(c(cc1C)Cl)C 62a_100000210202_100012357408 [0,2,0,0,0,0|2,0,0]=4 23093 B12R1.1123 CCSc1cc(c(cc1C)Cl)C 62a_100012357408_100000210202 [0,2,0,0,0,0|2,0,0]=4 23094 B12R1.1123 CCSc1cc(c(cc1C)F)Br 62a_100000210202_100011216669 [0,2,0,0,0,0|2,0,0]=4 23095 B12R1.1123 CCSc1cc(c(cc1C)F)Br 62a_100011216669_100000210202 [0,2,0,0,0,0|2,0,0]=4 23096 B12R1.1123 CCSc1cc(c(cc1C)F)C 62a_100000210202_100010212296 [0,2,0,0,0,0|2,0,0]=4 23097 B12R1.1123 CCSc1cc(c(cc1C)F)C 62a_100010212296_100000210202 [0,2,0,0,0,0|2,0,0]=4 23098 B12R1.1123 CCSc1cc(c(cc1C)F)F 62a_100000210202_100009815990 [0,2,0,0,0,0|2,0,0]=4 23099 B12R1.1123 CCSc1cc(c(cc1C)F)F 62a_100009815990_100000210202 [0,2,0,0,0,0|2,0,0]=4 23100 B12R1.1123 CCSc1cc(c(cc1C)F)N 62a_100000210202_100011014115 [0,2,0,0,0,0|2,0,0]=4 23101 B12R1.1123 CCSc1cc(c(cc1C)F)N 62a_100011014115_100000210202 [0,2,0,0,0,0|2,0,0]=4 23102 B12R1.1123 CCSc1cc(c(cc1C)F)O 62a_100000210202_100010068922 [0,2,0,0,0,0|2,0,0]=4 23103 B12R1.1123 CCSc1cc(c(cc1C)F)O 62a_100010068922_100000210202 [0,2,0,0,0,0|2,0,0]=4 23104 B12R1.1123 CCSc1cc(c(cc1C)N)C 62a_100000210202_100011934712 [0,2,0,0,0,0|2,0,0]=4 23105 B12R1.1123 CCSc1cc(c(cc1C)N)C 62a_100011934712_100000210202 [0,2,0,0,0,0|2,0,0]=4 23106 B12R1.1123 CCSc1cc(c(cc1C)N)F 62a_100000210202_100000691575 [0,2,0,0,0,0|2,0,0]=4 23107 B12R1.1123 CCSc1cc(c(cc1C)N)F 62a_100000691575_100000210202 [0,2,0,0,0,0|2,0,0]=4 23108 B12R1.1123 CCSc1cc(c(cc1C)N)N 62a_100000210202_100010080480 [0,2,0,0,0,0|2,0,0]=4 23109 B12R1.1123 CCSc1cc(c(cc1C)N)N 62a_100010080480_100000210202 [0,2,0,0,0,0|2,0,0]=4 23110 B12R1.1123 CCSc1cc(c(cc1C)N)O 62a_100000210202_200010107346 [0,2,0,0,0,0|2,0,0]=4 23111 B12R1.1123 CCSc1cc(c(cc1C)N)O 62a_200010107346_100000210202 [0,2,0,0,0,0|2,0,0]=4 23112 B12R1.1123 CCSc1cc(c(cc1C)O)C 62a_100000210202_100000698207 [0,2,0,0,0,0|2,0,0]=4 23113 B12R1.1123 CCSc1cc(c(cc1C)O)C 62a_100000698207_100000210202 [0,2,0,0,0,0|2,0,0]=4 23114 B12R1.1123 CCSc1cc(c(cc1C)O)F 62a_100000210202_100012355673 [0,2,0,0,0,0|2,0,0]=4 23115 B12R1.1123 CCSc1cc(c(cc1C)O)F 62a_100012355673_100000210202 [0,2,0,0,0,0|2,0,0]=4 23116 B12R1.1123 CCSc1cc(c(cc1C)O)N 62a_100000210202_200010235796 [0,2,0,0,0,0|2,0,0]=4 23117 B12R1.1123 CCSc1cc(c(cc1C)O)N 62a_200010235796_100000210202 [0,2,0,0,0,0|2,0,0]=4 23118 B12R1.1123 CCSc1cc(c(cc1Cl)Br)C 62a_100000210202_100010259621 [0,2,0,0,0,0|2,0,0]=4 23119 B12R1.1123 CCSc1cc(c(cc1Cl)Br)C 62a_100010259621_100000210202 [0,2,0,0,0,0|2,0,0]=4 23120 B12R1.1123 CCSc1cc(c(cc1Cl)Br)Cl 62a_100000210202_200010244590 [0,2,0,0,0,0|2,0,0]=4 23121 B12R1.1123 CCSc1cc(c(cc1Cl)Br)Cl 62a_200010244590_100000210202 [0,2,0,0,0,0|2,0,0]=4 23122 B12R1.1123 CCSc1cc(c(cc1Cl)Br)F 62a_100000210202_100010212230 [0,2,0,0,0,0|2,0,0]=4 23123 B12R1.1123 CCSc1cc(c(cc1Cl)Br)F 62a_100010212230_100000210202 [0,2,0,0,0,0|2,0,0]=4 23124 B12R1.1123 CCSc1cc(c(cc1Cl)Cl)Cl 62a_100000210202_200011216203 [0,2,0,0,0,0|2,0,0]=4 23125 B12R1.1123 CCSc1cc(c(cc1Cl)Cl)Cl 62a_200011216203_100000210202 [0,2,0,0,0,0|2,0,0]=4 23126 B12R1.1123 CCSc1cc(c(cc1Cl)Cl)N 62a_100000210202_100016224655 [0,2,0,0,0,0|2,0,0]=4 23127 B12R1.1123 CCSc1cc(c(cc1Cl)Cl)N 62a_100016224655_100000210202 [0,2,0,0,0,0|2,0,0]=4 23128 B12R1.1123 CCSc1cc(c(cc1Cl)F)F 62a_100000210202_100012349977 [0,2,0,0,0,0|2,0,0]=4 23129 B12R1.1123 CCSc1cc(c(cc1Cl)F)F 62a_100012349977_100000210202 [0,2,0,0,0,0|2,0,0]=4 23130 B12R1.1123 CCSc1cc(c(cc1Cl)O)N 62a_100000210202_100011011175 [0,2,0,0,0,0|2,0,0]=4 23131 B12R1.1123 CCSc1cc(c(cc1Cl)O)N 62a_100011011175_100000210202 [0,2,0,0,0,0|2,0,0]=4 23132 B12R1.1123 CCSc1cc(c(cc1F)Br)Br 62a_100000210202_200010212210 [0,2,0,0,0,0|2,0,0]=4 23133 B12R1.1123 CCSc1cc(c(cc1F)Br)Br 62a_200010212210_100000210202 [0,2,0,0,0,0|2,0,0]=4 23134 B12R1.1123 CCSc1cc(c(cc1F)Br)C 62a_100000210202_200009814772 [0,2,0,0,0,0|2,0,0]=4 23135 B12R1.1123 CCSc1cc(c(cc1F)Br)C 62a_200009814772_100000210202 [0,2,0,0,0,0|2,0,0]=4 23136 B12R1.1123 CCSc1cc(c(cc1F)Br)F 62a_100000210202_100011356857 [0,2,0,0,0,0|2,0,0]=4 23137 B12R1.1123 CCSc1cc(c(cc1F)Br)F 62a_100011356857_100000210202 [0,2,0,0,0,0|2,0,0]=4 23138 B12R1.1123 CCSc1cc(c(cc1F)C)Br 62a_100000210202_100011068846 [0,2,0,0,0,0|2,0,0]=4 23139 B12R1.1123 CCSc1cc(c(cc1F)C)Br 62a_100011068846_100000210202 [0,2,0,0,0,0|2,0,0]=4 23140 B12R1.1123 CCSc1cc(c(cc1F)C)C 62a_100000210202_100010197417 [0,2,0,0,0,0|2,0,0]=4 23141 B12R1.1123 CCSc1cc(c(cc1F)C)C 62a_100010197417_100000210202 [0,2,0,0,0,0|2,0,0]=4 23142 B12R1.1123 CCSc1cc(c(cc1F)C)F 62a_100000210202_100011219510 [0,2,0,0,0,0|2,0,0]=4 23143 B12R1.1123 CCSc1cc(c(cc1F)C)F 62a_100011219510_100000210202 [0,2,0,0,0,0|2,0,0]=4 23144 B12R1.1123 CCSc1cc(c(cc1F)C)N 62a_100000210202_100000717900 [0,2,0,0,0,0|2,0,0]=4 23145 B12R1.1123 CCSc1cc(c(cc1F)C)N 62a_100000717900_100000210202 [0,2,0,0,0,0|2,0,0]=4 23146 B12R1.1123 CCSc1cc(c(cc1F)C)O 62a_100000210202_100014242602 [0,2,0,0,0,0|2,0,0]=4 23147 B12R1.1123 CCSc1cc(c(cc1F)C)O 62a_100014242602_100000210202 [0,2,0,0,0,0|2,0,0]=4 23148 B12R1.1123 CCSc1cc(c(cc1F)Cl)F 62a_100000210202_100010142863 [0,2,0,0,0,0|2,0,0]=4 23149 B12R1.1123 CCSc1cc(c(cc1F)Cl)F 62a_100010142863_100000210202 [0,2,0,0,0,0|2,0,0]=4 23150 B12R1.1123 CCSc1cc(c(cc1F)Cl)O 62a_100000210202_100010735246 [0,2,0,0,0,0|2,0,0]=4 23151 B12R1.1123 CCSc1cc(c(cc1F)Cl)O 62a_100010735246_100000210202 [0,2,0,0,0,0|2,0,0]=4 23152 B12R1.1123 CCSc1cc(c(cc1F)F)Br 62a_100000210202_100011356914 [0,2,0,0,0,0|2,0,0]=4 23153 B12R1.1123 CCSc1cc(c(cc1F)F)Br 62a_100011356914_100000210202 [0,2,0,0,0,0|2,0,0]=4 23154 B12R1.1123 CCSc1cc(c(cc1F)F)C 62a_100000210202_100000692463 [0,2,0,0,0,0|2,0,0]=4 23155 B12R1.1123 CCSc1cc(c(cc1F)F)C 62a_100000692463_100000210202 [0,2,0,0,0,0|2,0,0]=4 23156 B12R1.1123 CCSc1cc(c(cc1F)F)F 62a_100000210202_100011756838 [0,2,0,0,0,0|2,0,0]=4 23157 B12R1.1123 CCSc1cc(c(cc1F)F)F 62a_100011756838_100000210202 [0,2,0,0,0,0|2,0,0]=4 23158 B12R1.1123 CCSc1cc(c(cc1F)F)N 62a_100000210202_100000700208 [0,2,0,0,0,0|2,0,0]=4 23159 B12R1.1123 CCSc1cc(c(cc1F)F)N 62a_100000700208_100000210202 [0,2,0,0,0,0|2,0,0]=4 23160 B12R1.1123 CCSc1cc(c(cc1F)F)O 62a_100000210202_100012457948 [0,2,0,0,0,0|2,0,0]=4 23161 B12R1.1123 CCSc1cc(c(cc1F)F)O 62a_100012457948_100000210202 [0,2,0,0,0,0|2,0,0]=4 23162 B12R1.1123 CCSc1cc(c(cc1F)N)C 62a_100000210202_100000695870 [0,2,0,0,0,0|2,0,0]=4 23163 B12R1.1123 CCSc1cc(c(cc1F)N)C 62a_100000695870_100000210202 [0,2,0,0,0,0|2,0,0]=4 23164 B12R1.1123 CCSc1cc(c(cc1F)N)F 62a_100000210202_100000690247 [0,2,0,0,0,0|2,0,0]=4 23165 B12R1.1123 CCSc1cc(c(cc1F)N)F 62a_100000690247_100000210202 [0,2,0,0,0,0|2,0,0]=4 23166 B12R1.1123 CCSc1cc(c(cc1F)N)N 62a_100000210202_100000766667 [0,2,0,0,0,0|2,0,0]=4 23167 B12R1.1123 CCSc1cc(c(cc1F)N)N 62a_100000766667_100000210202 [0,2,0,0,0,0|2,0,0]=4 23168 B12R1.1123 CCSc1cc(c(cc1F)N)O 62a_100000210202_100013038943 [0,2,0,0,0,0|2,0,0]=4 23169 B12R1.1123 CCSc1cc(c(cc1F)N)O 62a_100013038943_100000210202 [0,2,0,0,0,0|2,0,0]=4 23170 B12R1.1123 CCSc1cc(c(cc1F)O)F 62a_100000210202_100011830439 [0,2,0,0,0,0|2,0,0]=4 23171 B12R1.1123 CCSc1cc(c(cc1F)O)F 62a_100011830439_100000210202 [0,2,0,0,0,0|2,0,0]=4 23172 B12R1.1123 CCSc1cc(c(cc1F)O)N 62a_100000210202_100012359894 [0,2,0,0,0,0|2,0,0]=4 23173 B12R1.1123 CCSc1cc(c(cc1F)O)N 62a_100012359894_100000210202 [0,2,0,0,0,0|2,0,0]=4 23174 B12R1.1123 CCSc1cc(c(cc1N)Br)C 62a_100000210202_200015600912 [0,2,0,0,0,0|2,0,0]=4 23175 B12R1.1123 CCSc1cc(c(cc1N)Br)C 62a_200015600912_100000210202 [0,2,0,0,0,0|2,0,0]=4 23176 B12R1.1123 CCSc1cc(c(cc1N)Br)F 62a_100000210202_200021016574 [0,2,0,0,0,0|2,0,0]=4 23177 B12R1.1123 CCSc1cc(c(cc1N)Br)F 62a_200021016574_100000210202 [0,2,0,0,0,0|2,0,0]=4 23178 B12R1.1123 CCSc1cc(c(cc1N)C)C 62a_100000210202_100012337760 [0,2,0,0,0,0|2,0,0]=4 23179 B12R1.1123 CCSc1cc(c(cc1N)C)C 62a_100012337760_100000210202 [0,2,0,0,0,0|2,0,0]=4 23180 B12R1.1123 CCSc1cc(c(cc1N)C)F 62a_100000210202_100010233353 [0,2,0,0,0,0|2,0,0]=4 23181 B12R1.1123 CCSc1cc(c(cc1N)C)F 62a_100010233353_100000210202 [0,2,0,0,0,0|2,0,0]=4 23182 B12R1.1123 CCSc1cc(c(cc1N)Cl)Cl 62a_100000210202_200011093942 [0,2,0,0,0,0|2,0,0]=4 23183 B12R1.1123 CCSc1cc(c(cc1N)Cl)Cl 62a_200011093942_100000210202 [0,2,0,0,0,0|2,0,0]=4 23184 B12R1.1123 CCSc1cc(c(cc1N)Cl)F 62a_100000210202_200010992381 [0,2,0,0,0,0|2,0,0]=4 23185 B12R1.1123 CCSc1cc(c(cc1N)Cl)F 62a_200010992381_100000210202 [0,2,0,0,0,0|2,0,0]=4 23186 B12R1.1123 CCSc1cc(c(cc1N)F)Br 62a_100000210202_100010888672 [0,2,0,0,0,0|2,0,0]=4 23187 B12R1.1123 CCSc1cc(c(cc1N)F)Br 62a_100010888672_100000210202 [0,2,0,0,0,0|2,0,0]=4 23188 B12R1.1123 CCSc1cc(c(cc1N)F)C 62a_100000210202_100011218008 [0,2,0,0,0,0|2,0,0]=4 23189 B12R1.1123 CCSc1cc(c(cc1N)F)C 62a_100011218008_100000210202 [0,2,0,0,0,0|2,0,0]=4 23190 B12R1.1123 CCSc1cc(c(cc1N)F)Cl 62a_100000210202_100010892166 [0,2,0,0,0,0|2,0,0]=4 23191 B12R1.1123 CCSc1cc(c(cc1N)F)Cl 62a_100010892166_100000210202 [0,2,0,0,0,0|2,0,0]=4 23192 B12R1.1123 CCSc1cc(c(cc1N)F)F 62a_100000210202_100000765032 [0,2,0,0,0,0|2,0,0]=4 23193 B12R1.1123 CCSc1cc(c(cc1N)F)F 62a_100000765032_100000210202 [0,2,0,0,0,0|2,0,0]=4 23194 B12R1.1123 CCSc1cc(c(cc1N)N)C 62a_100000210202_200013038441 [0,2,0,0,0,0|2,0,0]=4 23195 B12R1.1123 CCSc1cc(c(cc1N)N)C 62a_200013038441_100000210202 [0,2,0,0,0,0|2,0,0]=4 23196 B12R1.1123 CCSc1cc(c(cc1N)N)F 62a_100000210202_200010115645 [0,2,0,0,0,0|2,0,0]=4 23197 B12R1.1123 CCSc1cc(c(cc1N)N)F 62a_200010115645_100000210202 [0,2,0,0,0,0|2,0,0]=4 23198 B12R1.1123 CCSc1cc(c(cc1O)C)C 62a_100000210202_100009814663 [0,2,0,0,0,0|1,0,0]=3 23199 B12R1.1123 CCSc1cc(c(cc1O)C)C 62a_100009814663_100000210202 [0,2,0,0,0,0|1,0,0]=3 23200 B12R1.1123 CCSc1cc(c(cc1O)F)F 62a_100000210202_100009813768 [0,2,0,0,0,0|1,0,0]=3 23201 B12R1.1123 CCSc1cc(c(cc1O)F)F 62a_100009813768_100000210202 [0,2,0,0,0,0|1,0,0]=3 23202 B12R1.1123 CNCc1cc(c(cc1Br)C)C 26a_100102657272_100009814663 [0,2,0,0,0,0|2,0,0]=4 23203 B12R1.1123 CNCc1cc(c(cc1Br)C)F 207a_100102657272_100010186290 [0,2,0,0,0,0|2,0,0]=4 23204 B12R1.1123 CNCc1cc(c(cc1Br)C)F 270004a_106832991635_100010186290 [0,2,0,0,0,0|2,0,0]=4 23205 B12R1.1123 CNCc1cc(c(cc1Br)Cl)C 26a_100102657272_100022700756 [0,2,0,0,0,0|2,0,0]=4 23206 B12R1.1123 CNCc1cc(c(cc1Br)Cl)F 270004a_106832991635_100010270164 [0,2,0,0,0,0|2,0,0]=4 23207 B12R1.1123 CNCc1cc(c(cc1Br)F)C 207a_100102657272_100009814814 [0,2,0,0,0,0|2,0,0]=4 23208 B12R1.1123 CNCc1cc(c(cc1Br)F)C 270004a_106832991635_100009814814 [0,2,0,0,0,0|2,0,0]=4 23209 B12R1.1123 CNCc1cc(c(cc1Br)F)F 2230a_106832991635_100010077255 [0,2,0,0,0,0|2,0,0]=4 23210 B12R1.1123 CNCc1cc(c(cc1Br)F)F 26a_100102657272_100009813768 [0,2,0,0,0,0|2,0,0]=4 23211 B12R1.1123 CNCc1cc(c(cc1Br)F)F 270004a_106832991635_100012344232 [0,2,0,0,0,0|2,0,0]=4 23212 B12R1.1123 CNCc1cc(c(cc1Br)F)F 34a_100102657272_100010077255 [0,2,0,0,0,0|2,0,0]=4 23213 B12R1.1123 CNCc1cc(c(cc1Br)F)F 7a_106832991635_100010077255 [0,2,0,0,0,0|2,0,0]=4 23214 B12R1.1123 CNCc1cc(c(cc1Br)N)Br 26a_100102657272_100011080774 [0,2,0,0,0,0|2,0,0]=4 23215 B12R1.1123 CNCc1cc(c(cc1C)Br)C 207a_100102657272_100012024176 [0,2,0,0,0,0|2,0,0]=4 23216 B12R1.1123 CNCc1cc(c(cc1C)Br)C 26a_100102657272_100000698207 [0,2,0,0,0,0|2,0,0]=4 23217 B12R1.1123 CNCc1cc(c(cc1C)Br)C 270004a_106832991635_100012024176 [0,2,0,0,0,0|2,0,0]=4 23218 B12R1.1123 CNCc1cc(c(cc1C)Br)F 207a_100102657272_100010186292 [0,2,0,0,0,0|2,0,0]=4 23219 B12R1.1123 CNCc1cc(c(cc1C)Br)F 270004a_106832991635_100010186292 [0,2,0,0,0,0|2,0,0]=4 23220 B12R1.1123 CNCc1cc(c(cc1C)C)C 207a_100102657272_100000211818 [0,2,0,0,0,0|2,0,0]=4 23221 B12R1.1123 CNCc1cc(c(cc1C)C)C 270004a_106832991635_100000211818 [0,2,0,0,0,0|2,0,0]=4 23222 B12R1.1123 CNCc1cc(c(cc1C)Cl)Cl 207a_100102657272_100010724756 [0,2,0,0,0,0|2,0,0]=4 23223 B12R1.1123 CNCc1cc(c(cc1C)Cl)Cl 270004a_106832991635_100010724756 [0,2,0,0,0,0|2,0,0]=4 23224 B12R1.1123 CNCc1cc(c(cc1C)F)Br 26a_100102657272_100014242602 [0,2,0,0,0,0|2,0,0]=4 23225 B12R1.1123 CNCc1cc(c(cc1Cl)Br)C 26a_100102657272_200012350488 [0,2,0,0,0,0|2,0,0]=4 23226 B12R1.1123 CNCc1cc(c(cc1Cl)Br)Cl 26a_100102657272_100000719705 [0,2,0,0,0,0|2,0,0]=4 23227 B12R1.1123 CNCc1cc(c(cc1Cl)Br)F 207a_100102657272_100010172941 [0,2,0,0,0,0|2,0,0]=4 23228 B12R1.1123 CNCc1cc(c(cc1Cl)Br)F 26a_100102657272_100000726166 [0,2,0,0,0,0|2,0,0]=4 23229 B12R1.1123 CNCc1cc(c(cc1Cl)Br)F 270004a_106832991635_100010172941 [0,2,0,0,0,0|2,0,0]=4 23230 B12R1.1123 CNCc1cc(c(cc1Cl)Br)I 26a_100102657272_100021297947 [0,2,0,0,0,0|2,0,0]=4 23231 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)Br 26a_100102657272_100010203734 [0,2,0,0,0,0|2,0,0]=4 23232 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)C 26a_100102657272_100012002691 [0,2,0,0,0,0|2,0,0]=4 23233 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)Cl 207a_100102657272_100010220946 [0,2,0,0,0,0|2,0,0]=4 23234 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)Cl 2230a_106832991635_100010220947 [0,2,0,0,0,0|2,0,0]=4 23235 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)Cl 26a_100102657272_100000211312 [0,2,0,0,0,0|2,0,0]=4 23236 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)Cl 270004a_106832991635_100010220946 [0,2,0,0,0,0|2,0,0]=4 23237 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)Cl 34a_100102657272_100010220947 [0,2,0,0,0,0|2,0,0]=4 23238 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)Cl 7a_106832991635_100010220947 [0,2,0,0,0,0|2,0,0]=4 23239 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)F 207a_100102657272_100000036543 [0,2,0,0,0,0|2,0,0]=4 23240 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)F 2230a_106832991635_100009813697 [0,2,0,0,0,0|2,0,0]=4 23241 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)F 2230a_114828290983_200000210301 [0,2,0,0,0,0|2,0,0]=4 23242 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)F 270004a_106832991635_100000036543 [0,2,0,0,0,0|2,0,0]=4 23243 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)F 34a_100102657272_100009813697 [0,2,0,0,0,0|2,0,0]=4 23244 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)F 34a_114828290983_200000210301 [0,2,0,0,0,0|2,0,0]=4 23245 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)F 7a_106832991635_100009813697 [0,2,0,0,0,0|2,0,0]=4 23246 B12R1.1123 CNCc1cc(c(cc1Cl)F)Br 207a_100102657272_100015727512 [0,2,0,0,0,0|2,0,0]=4 23247 B12R1.1123 CNCc1cc(c(cc1Cl)F)Br 26a_100102657272_100010189047 [0,2,0,0,0,0|2,0,0]=4 23248 B12R1.1123 CNCc1cc(c(cc1Cl)F)Br 270004a_106832991635_100015727512 [0,2,0,0,0,0|2,0,0]=4 23249 B12R1.1123 CNCc1cc(c(cc1Cl)F)Cl 207a_100102657272_100010623807 [0,2,0,0,0,0|2,0,0]=4 23250 B12R1.1123 CNCc1cc(c(cc1Cl)F)Cl 270004a_106832991635_100010623807 [0,2,0,0,0,0|2,0,0]=4 23251 B12R1.1123 CNCc1cc(c(cc1Cl)F)F 207a_100102657272_100011998482 [0,2,0,0,0,0|2,0,0]=4 23252 B12R1.1123 CNCc1cc(c(cc1Cl)F)F 2230a_100011830481_200000210301 [0,2,0,0,0,0|2,0,0]=4 23253 B12R1.1123 CNCc1cc(c(cc1Cl)F)F 2230a_106832991635_100011830393 [0,2,0,0,0,0|2,0,0]=4 23254 B12R1.1123 CNCc1cc(c(cc1Cl)F)F 26a_100102657272_100009848785 [0,2,0,0,0,0|2,0,0]=4 23255 B12R1.1123 CNCc1cc(c(cc1Cl)F)F 270004a_106832991635_100011998482 [0,2,0,0,0,0|2,0,0]=4 23256 B12R1.1123 CNCc1cc(c(cc1Cl)F)F 34a_100011830481_200000210301 [0,2,0,0,0,0|2,0,0]=4 23257 B12R1.1123 CNCc1cc(c(cc1Cl)F)F 34a_100102657272_100011830393 [0,2,0,0,0,0|2,0,0]=4 23258 B12R1.1123 CNCc1cc(c(cc1Cl)F)F 7a_106832991635_100011830393 [0,2,0,0,0,0|2,0,0]=4 23259 B12R1.1123 CNCc1cc(c(cc1F)Br)C 207a_100102657272_100010186291 [0,2,0,0,0,0|2,0,0]=4 23260 B12R1.1123 CNCc1cc(c(cc1F)Br)C 26a_100102657272_100012355673 [0,2,0,0,0,0|2,0,0]=4 23261 B12R1.1123 CNCc1cc(c(cc1F)Br)C 270004a_106832991635_100010186291 [0,2,0,0,0,0|2,0,0]=4 23262 B12R1.1123 CNCc1cc(c(cc1F)Br)Cl 207a_100102657272_100013713083 [0,2,0,0,0,0|2,0,0]=4 23263 B12R1.1123 CNCc1cc(c(cc1F)Br)F 207a_100102657272_100012024334 [0,2,0,0,0,0|2,0,0]=4 23264 B12R1.1123 CNCc1cc(c(cc1F)Br)F 2230a_106832991635_100012024439 [0,2,0,0,0,0|2,0,0]=4 23265 B12R1.1123 CNCc1cc(c(cc1F)Br)F 26a_100102657272_100011830439 [0,2,0,0,0,0|2,0,0]=4 23266 B12R1.1123 CNCc1cc(c(cc1F)Br)F 270004a_106832991635_100012024334 [0,2,0,0,0,0|2,0,0]=4 23267 B12R1.1123 CNCc1cc(c(cc1F)Br)F 34a_100102657272_100012024439 [0,2,0,0,0,0|2,0,0]=4 23268 B12R1.1123 CNCc1cc(c(cc1F)Br)F 7a_106832991635_100012024439 [0,2,0,0,0,0|2,0,0]=4 23269 B12R1.1123 CNCc1cc(c(cc1F)C)Br 207a_100102657272_100010138641 [0,2,0,0,0,0|2,0,0]=4 23270 B12R1.1123 CNCc1cc(c(cc1F)C)Br 26a_100102657272_100010068922 [0,2,0,0,0,0|2,0,0]=4 23271 B12R1.1123 CNCc1cc(c(cc1F)C)Br 270004a_106832991635_100010138641 [0,2,0,0,0,0|2,0,0]=4 23272 B12R1.1123 CNCc1cc(c(cc1F)Cl)C 207a_100102657272_100015641705 [0,2,0,0,0,0|2,0,0]=4 23273 B12R1.1123 CNCc1cc(c(cc1F)Cl)C 270004a_106832991635_100015641705 [0,2,0,0,0,0|2,0,0]=4 23274 B12R1.1123 CNCc1cc(c(cc1F)Cl)F 207a_100102657272_100011998483 [0,2,0,0,0,0|2,0,0]=4 23275 B12R1.1123 CNCc1cc(c(cc1F)Cl)F 2230a_106832991635_200012361342 [0,2,0,0,0,0|2,0,0]=4 23276 B12R1.1123 CNCc1cc(c(cc1F)Cl)F 270004a_106832991635_100011998483 [0,2,0,0,0,0|2,0,0]=4 23277 B12R1.1123 CNCc1cc(c(cc1F)Cl)F 34a_100102657272_200012361342 [0,2,0,0,0,0|2,0,0]=4 23278 B12R1.1123 CNCc1cc(c(cc1F)Cl)F 7a_106832991635_200012361342 [0,2,0,0,0,0|2,0,0]=4 23279 B12R1.1123 CNCc1cc(c(cc1F)F)Br 207a_100102657272_100009814802 [0,2,0,0,0,0|2,0,0]=4 23280 B12R1.1123 CNCc1cc(c(cc1F)F)Br 26a_100102657272_100012457948 [0,2,0,0,0,0|2,0,0]=4 23281 B12R1.1123 CNCc1cc(c(cc1F)F)Br 270004a_106832991635_100009814802 [0,2,0,0,0,0|2,0,0]=4 23282 B12R1.1123 CNCc1cc(c(cc1F)F)C 207a_100102657272_100012017330 [0,2,0,0,0,0|2,0,0]=4 23283 B12R1.1123 CNCc1cc(c(cc1F)F)C 2230a_106832991635_100012347589 [0,2,0,0,0,0|2,0,0]=4 23284 B12R1.1123 CNCc1cc(c(cc1F)F)C 270004a_106832991635_100012017330 [0,2,0,0,0,0|2,0,0]=4 23285 B12R1.1123 CNCc1cc(c(cc1F)F)C 34a_100102657272_100012347589 [0,2,0,0,0,0|2,0,0]=4 23286 B12R1.1123 CNCc1cc(c(cc1F)F)C 7a_106832991635_100012347589 [0,2,0,0,0,0|2,0,0]=4 23287 B12R1.1123 CNCc1cc(c(cc1F)F)Cl 207a_100102657272_100000086691 [0,2,0,0,0,0|2,0,0]=4 23288 B12R1.1123 CNCc1cc(c(cc1F)F)Cl 2230a_103624766871_200000210301 [0,2,0,0,0,0|2,0,0]=4 23289 B12R1.1123 CNCc1cc(c(cc1F)F)Cl 2230a_106832991635_100010994231 [0,2,0,0,0,0|2,0,0]=4 23290 B12R1.1123 CNCc1cc(c(cc1F)F)Cl 270004a_106832991635_100000086691 [0,2,0,0,0,0|2,0,0]=4 23291 B12R1.1123 CNCc1cc(c(cc1F)F)Cl 34a_100102657272_100010994231 [0,2,0,0,0,0|2,0,0]=4 23292 B12R1.1123 CNCc1cc(c(cc1F)F)Cl 34a_103624766871_200000210301 [0,2,0,0,0,0|2,0,0]=4 23293 B12R1.1123 CNCc1cc(c(cc1F)F)Cl 7a_106832991635_100010994231 [0,2,0,0,0,0|2,0,0]=4 23294 B12R1.1123 CNCc1cc(c(cc1F)F)F 207a_100102657272_100000690286 [0,2,0,0,0,0|2,0,0]=4 23295 B12R1.1123 CNCc1cc(c(cc1F)F)F 2230a_102495337830_200000210301 [0,2,0,0,0,0|2,0,0]=4 23296 B12R1.1123 CNCc1cc(c(cc1F)F)F 2230a_106832991635_100011218792 [0,2,0,0,0,0|2,0,0]=4 23297 B12R1.1123 CNCc1cc(c(cc1F)F)F 270004a_106832991635_100000690286 [0,2,0,0,0,0|2,0,0]=4 23298 B12R1.1123 CNCc1cc(c(cc1F)F)F 34a_100102657272_100011218792 [0,2,0,0,0,0|2,0,0]=4 23299 B12R1.1123 CNCc1cc(c(cc1F)F)F 34a_102495337830_200000210301 [0,2,0,0,0,0|2,0,0]=4 23300 B12R1.1123 CNCc1cc(c(cc1F)F)F 7a_106832991635_100011218792 [0,2,0,0,0,0|2,0,0]=4 23301 B12R1.1123 CNCc1cc(c(cc1F)F)I 207a_100102657272_100015839132 [0,2,0,0,0,0|2,0,0]=4 23302 B12R1.1123 CNCc1cc(c(cc1F)F)I 2230a_106832991635_100019984567 [0,2,0,0,0,0|2,0,0]=4 23303 B12R1.1123 CNCc1cc(c(cc1F)F)I 34a_100102657272_100019984567 [0,2,0,0,0,0|2,0,0]=4 23304 B12R1.1123 CNCc1cc(c(cc1F)F)I 7a_106832991635_100019984567 [0,2,0,0,0,0|2,0,0]=4 23305 B12R1.1123 CNCc1cc(c(cc1I)C)C 207a_100102657272_100010184403 [0,2,0,0,0,0|2,0,0]=4 23306 B12R1.1123 CNCc1cc(c(cc1I)C)C 270004a_106832991635_100010184403 [0,2,0,0,0,0|2,0,0]=4 23307 B12R1.1123 CNCc1cc(c(cc1N)Br)Br 26a_100102657272_200010781931 [0,2,0,0,0,0|2,0,0]=4 23308 B12R1.1123 COCc1cc(c(cc1Br)F)F 34a_100012344399_200000210301 [0,2,0,0,0,0|2,0,0]=4 23309 B12R1.1123 COCc1cc(c(cc1Br)F)F 34a_100138415774_100010077255 [0,2,0,0,0,0|2,0,0]=4 23310 B12R1.1123 COCc1cc(c(cc1Br)F)F 7a_100012344399_200000210301 [0,2,0,0,0,0|2,0,0]=4 23311 B12R1.1123 COCc1cc(c(cc1C)C)C 34a_200000246302_200000210301 [0,2,0,0,0,0|2,0,0]=4 23312 B12R1.1123 COCc1cc(c(cc1C)C)C 7a_200000246302_200000210301 [0,2,0,0,0,0|2,0,0]=4 23313 B12R1.1123 COCc1cc(c(cc1Cl)Br)F 34a_100010883925_200000210301 [0,2,0,0,0,0|2,0,0]=4 23314 B12R1.1123 COCc1cc(c(cc1Cl)Br)F 7a_100010883925_200000210301 [0,2,0,0,0,0|2,0,0]=4 23315 B12R1.1123 COCc1cc(c(cc1Cl)Cl)Cl 34a_100138415774_100010220947 [0,2,0,0,0,0|2,0,0]=4 23316 B12R1.1123 COCc1cc(c(cc1Cl)Cl)F 34a_100000043066_200000210301 [0,2,0,0,0,0|2,0,0]=4 23317 B12R1.1123 COCc1cc(c(cc1Cl)Cl)F 34a_100138415774_100009813697 [0,2,0,0,0,0|2,0,0]=4 23318 B12R1.1123 COCc1cc(c(cc1Cl)Cl)F 7a_100000043066_200000210301 [0,2,0,0,0,0|2,0,0]=4 23319 B12R1.1123 COCc1cc(c(cc1Cl)F)Br 34a_200021122263_200000210301 [0,2,0,0,0,0|2,0,0]=4 23320 B12R1.1123 COCc1cc(c(cc1Cl)F)Br 7a_200021122263_200000210301 [0,2,0,0,0,0|2,0,0]=4 23321 B12R1.1123 COCc1cc(c(cc1Cl)F)F 34a_100011996549_200000210301 [0,2,0,0,0,0|2,0,0]=4 23322 B12R1.1123 COCc1cc(c(cc1Cl)F)F 34a_100138415774_100011830393 [0,2,0,0,0,0|2,0,0]=4 23323 B12R1.1123 COCc1cc(c(cc1Cl)F)F 7a_100011996549_200000210301 [0,2,0,0,0,0|2,0,0]=4 23324 B12R1.1123 COCc1cc(c(cc1F)Br)F 34a_100012024398_200000210301 [0,2,0,0,0,0|2,0,0]=4 23325 B12R1.1123 COCc1cc(c(cc1F)Br)F 34a_100138415774_100012024439 [0,2,0,0,0,0|2,0,0]=4 23326 B12R1.1123 COCc1cc(c(cc1F)Br)F 7a_100012024398_200000210301 [0,2,0,0,0,0|2,0,0]=4 23327 B12R1.1123 COCc1cc(c(cc1F)Cl)Br 34a_200011070574_200000210301 [0,2,0,0,0,0|2,0,0]=4 23328 B12R1.1123 COCc1cc(c(cc1F)Cl)Br 7a_200011070574_200000210301 [0,2,0,0,0,0|2,0,0]=4 23329 B12R1.1123 COCc1cc(c(cc1F)Cl)F 34a_100138415774_200012361342 [0,2,0,0,0,0|2,0,0]=4 23330 B12R1.1123 COCc1cc(c(cc1F)F)C 34a_100012186966_200000210301 [0,2,0,0,0,0|2,0,0]=4 23331 B12R1.1123 COCc1cc(c(cc1F)F)C 34a_100138415774_100012347589 [0,2,0,0,0,0|2,0,0]=4 23332 B12R1.1123 COCc1cc(c(cc1F)F)C 7a_100012186966_200000210301 [0,2,0,0,0,0|2,0,0]=4 23333 B12R1.1123 COCc1cc(c(cc1F)F)Cl 34a_100010365311_200000210301 [0,2,0,0,0,0|2,0,0]=4 23334 B12R1.1123 COCc1cc(c(cc1F)F)Cl 34a_100138415774_100010994231 [0,2,0,0,0,0|2,0,0]=4 23335 B12R1.1123 COCc1cc(c(cc1F)F)Cl 7a_100010365311_200000210301 [0,2,0,0,0,0|2,0,0]=4 23336 B12R1.1123 COCc1cc(c(cc1F)F)F 34a_100011215899_200000210301 [0,2,0,0,0,0|2,0,0]=4 23337 B12R1.1123 COCc1cc(c(cc1F)F)F 34a_100138415774_100011218792 [0,2,0,0,0,0|2,0,0]=4 23338 B12R1.1123 COCc1cc(c(cc1F)F)F 7a_100011215899_200000210301 [0,2,0,0,0,0|2,0,0]=4 23339 B12R1.1123 COCc1cc(c(cc1F)F)I 34a_100016029355_200000210301 [0,2,0,0,0,0|2,0,0]=4 23340 B12R1.1123 COCc1cc(c(cc1F)F)I 34a_100138415774_100019984567 [0,2,0,0,0,0|2,0,0]=4 23341 B12R1.1123 COCc1cc(c(cc1F)F)I 7a_100016029355_200000210301 [0,2,0,0,0,0|2,0,0]=4 23342 B12R1.1123 COCc1cc(c(cc1I)C)C 34a_100010184405_200000210301 [0,2,0,0,0,0|2,0,0]=4 23343 B12R1.1123 COCc1cc(c(cc1I)C)C 7a_100010184405_200000210301 [0,2,0,0,0,0|2,0,0]=4 23344 B12R1.1123 CSCc1cc(c(cc1Br)F)F 62a_100010077255_200000210301 [0,2,0,0,0,0|2,0,0]=4 23345 B12R1.1123 CSCc1cc(c(cc1Br)F)F 62a_200000210301_100010077255 [0,2,0,0,0,0|2,0,0]=4 23346 B12R1.1123 CSCc1cc(c(cc1Cl)Cl)Cl 62a_100010220947_200000210301 [0,2,0,0,0,0|2,0,0]=4 23347 B12R1.1123 CSCc1cc(c(cc1Cl)Cl)Cl 62a_200000210301_100010220947 [0,2,0,0,0,0|2,0,0]=4 23348 B12R1.1123 CSCc1cc(c(cc1Cl)Cl)F 62a_100009813697_200000210301 [0,2,0,0,0,0|2,0,0]=4 23349 B12R1.1123 CSCc1cc(c(cc1Cl)Cl)F 62a_200000210301_100009813697 [0,2,0,0,0,0|2,0,0]=4 23350 B12R1.1123 CSCc1cc(c(cc1Cl)F)F 62a_100011830393_200000210301 [0,2,0,0,0,0|2,0,0]=4 23351 B12R1.1123 CSCc1cc(c(cc1Cl)F)F 62a_200000210301_100011830393 [0,2,0,0,0,0|2,0,0]=4 23352 B12R1.1123 CSCc1cc(c(cc1F)Br)F 62a_100012024439_200000210301 [0,2,0,0,0,0|2,0,0]=4 23353 B12R1.1123 CSCc1cc(c(cc1F)Br)F 62a_200000210301_100012024439 [0,2,0,0,0,0|2,0,0]=4 23354 B12R1.1123 CSCc1cc(c(cc1F)Cl)F 62a_200000210301_200012361342 [0,2,0,0,0,0|2,0,0]=4 23355 B12R1.1123 CSCc1cc(c(cc1F)Cl)F 62a_200012361342_200000210301 [0,2,0,0,0,0|2,0,0]=4 23356 B12R1.1123 CSCc1cc(c(cc1F)F)C 62a_100012347589_200000210301 [0,2,0,0,0,0|2,0,0]=4 23357 B12R1.1123 CSCc1cc(c(cc1F)F)C 62a_200000210301_100012347589 [0,2,0,0,0,0|2,0,0]=4 23358 B12R1.1123 CSCc1cc(c(cc1F)F)Cl 62a_100010994231_200000210301 [0,2,0,0,0,0|2,0,0]=4 23359 B12R1.1123 CSCc1cc(c(cc1F)F)Cl 62a_200000210301_100010994231 [0,2,0,0,0,0|2,0,0]=4 23360 B12R1.1123 CSCc1cc(c(cc1F)F)F 62a_100011218792_200000210301 [0,2,0,0,0,0|2,0,0]=4 23361 B12R1.1123 CSCc1cc(c(cc1F)F)F 62a_200000210301_100011218792 [0,2,0,0,0,0|2,0,0]=4 23362 B12R1.1123 CSCc1cc(c(cc1F)F)I 62a_100019984567_200000210301 [0,2,0,0,0,0|2,0,0]=4 23363 B12R1.1123 CSCc1cc(c(cc1F)F)I 62a_200000210301_100019984567 [0,2,0,0,0,0|2,0,0]=4 23364 B12R1.1123 Cc1cc(c(cc1Br)NCF)O 34a_200010235796_100015361967 [0,2,0,0,0,0|2,0,0]=4 23365 B12R1.1123 Cc1cc(c(cc1Br)NCF)O 7a_200010235796_100015361967 [0,2,0,0,0,0|2,0,0]=4 23366 B12R1.1123 Cc1cc(c(cc1Br)O)NCF 34a_200010107346_100015361967 [0,2,0,0,0,0|2,0,0]=4 23367 B12R1.1123 Cc1cc(c(cc1C)CO[13CH3])C 34a_200000246302_200025704644 [0,2,0,0,0,0|2,0,0]=4 23368 B12R1.1123 Cc1cc(c(cc1C)CO[13CH3])C 7a_200000246302_200025704644 [0,2,0,0,0,0|2,0,0]=4 23369 B12R1.1123 Cc1cc(c(cc1C)CO[13CH3])I 34a_100010184405_200025704644 [0,2,0,0,0,0|2,0,0]=4 23370 B12R1.1123 Cc1cc(c(cc1C)CO[13CH3])I 7a_100010184405_200025704644 [0,2,0,0,0,0|2,0,0]=4 23371 B12R1.1123 Cc1cc(c(cc1C)NCF)O 34a_100133014134_100015361967 [0,2,0,0,0,0|2,0,0]=4 23372 B12R1.1123 Cc1cc(c(cc1C)NCF)O 7a_100133014134_100015361967 [0,2,0,0,0,0|2,0,0]=4 23373 B12R1.1123 Cc1cc(c(cc1C)SCF)O 62a_100009814663_100015361967 [0,2,0,0,0,0|2,0,0]=4 23374 B12R1.1123 Cc1cc(c(cc1C)SCF)O 62a_100015361967_100009814663 [0,2,0,0,0,0|2,0,0]=4 23375 B12R1.1123 Cc1cc(c(cc1Cl)NCF)O 34a_100000091707_100015361967 [0,2,0,0,0,0|2,0,0]=4 23376 B12R1.1123 Cc1cc(c(cc1F)F)CO[13CH3] 34a_100012186966_200025704644 [0,2,0,0,0,0|2,0,0]=4 23377 B12R1.1123 Cc1cc(c(cc1F)F)CO[13CH3] 7a_100012186966_200025704644 [0,2,0,0,0,0|2,0,0]=4 23378 B12R1.1123 Cc1cc(c(cc1F)F)CS[13CH3] 62a_100012347589_200025704644 [0,2,0,0,0,0|2,0,0]=4 23379 B12R1.1123 Cc1cc(c(cc1F)F)CS[13CH3] 62a_200025704644_100012347589 [0,2,0,0,0,0|2,0,0]=4 23380 B12R1.1123 Cc1cc(c(cc1F)O)NCF 34a_100012022779_100015361967 [0,2,0,0,0,0|2,0,0]=4 23381 B12R1.1123 Cc1cc(c(cc1F)O)NCF 7a_100012022779_100015361967 [0,2,0,0,0,0|2,0,0]=4 23382 B12R1.1123 N#CCc1cc(c(cc1O)F)F 271570a_203496583355_100011156620 [0,2,0,0,0,0|1,0,1]=4 23383 B12R1.1123 Oc1cc(c(cc1NCF)Br)Br 7a_200010781931_100015361967 [0,2,0,0,0,0|2,0,0]=4 23384 B12R1.1123 Oc1cc(c(cc1NCF)Br)Cl 34a_100013488937_100015361967 [0,2,0,0,0,0|2,0,0]=4 23385 B12R1.1123 Oc1cc(c(cc1NCF)Br)Cl 7a_100013488937_100015361967 [0,2,0,0,0,0|2,0,0]=4 23386 B12R1.1123 Oc1cc(c(cc1NCF)Br)F 34a_100012359894_100015361967 [0,2,0,0,0,0|2,0,0]=4 23387 B12R1.1123 Oc1cc(c(cc1NCF)Br)F 7a_100012359894_100015361967 [0,2,0,0,0,0|2,0,0]=4 23388 B12R1.1123 Oc1cc(c(cc1NCF)Cl)Cl 34a_100000696747_100015361967 [0,2,0,0,0,0|2,0,0]=4 23389 B12R1.1123 Oc1cc(c(cc1NCF)Cl)Cl 7a_100000696747_100015361967 [0,2,0,0,0,0|2,0,0]=4 23390 B12R1.1123 Oc1cc(c(cc1NCF)F)Br 34a_100013038943_100015361967 [0,2,0,0,0,0|2,0,0]=4 23391 B12R1.1123 Oc1cc(c(cc1NCF)F)Br 7a_100013038943_100015361967 [0,2,0,0,0,0|2,0,0]=4 23392 B12R1.1123 Oc1cc(c(cc1NCF)F)F 34a_106722365970_100015361967 [0,2,0,0,0,0|2,0,0]=4 23393 B12R1.1123 Oc1cc(c(cc1NCF)F)F 7a_106722365970_100015361967 [0,2,0,0,0,0|2,0,0]=4 23394 B12R1.1123 Oc1cc(c(cc1SCF)F)F 62a_100009813768_100015361967 [0,2,0,0,0,0|2,0,0]=4 23395 B12R1.1123 Oc1cc(c(cc1SCF)F)F 62a_100015361967_100009813768 [0,2,0,0,0,0|2,0,0]=4 23396 B12R1.1123 [13CH3]NCc1cc(c(cc1Cl)Cl)F 2230a_114828290983_200025704644 [0,2,0,0,0,0|2,0,0]=4 23397 B12R1.1123 [13CH3]NCc1cc(c(cc1Cl)Cl)F 34a_114828290983_200025704644 [0,2,0,0,0,0|2,0,0]=4 23398 B12R1.1123 [13CH3]NCc1cc(c(cc1Cl)F)F 2230a_100011830481_200025704644 [0,2,0,0,0,0|2,0,0]=4 23399 B12R1.1123 [13CH3]NCc1cc(c(cc1Cl)F)F 34a_100011830481_200025704644 [0,2,0,0,0,0|2,0,0]=4 23400 B12R1.1123 [13CH3]NCc1cc(c(cc1F)F)Cl 2230a_103624766871_200025704644 [0,2,0,0,0,0|2,0,0]=4 23401 B12R1.1123 [13CH3]NCc1cc(c(cc1F)F)Cl 34a_103624766871_200025704644 [0,2,0,0,0,0|2,0,0]=4 23402 B12R1.1123 [13CH3]NCc1cc(c(cc1F)F)F 2230a_102495337830_200025704644 [0,2,0,0,0,0|2,0,0]=4 23403 B12R1.1123 [13CH3]NCc1cc(c(cc1F)F)F 34a_102495337830_200025704644 [0,2,0,0,0,0|2,0,0]=4 23404 B12R1.1123 [13CH3]OCc1cc(c(cc1Br)F)F 34a_100012344399_200025704644 [0,2,0,0,0,0|2,0,0]=4 23405 B12R1.1123 [13CH3]OCc1cc(c(cc1Br)F)F 7a_100012344399_200025704644 [0,2,0,0,0,0|2,0,0]=4 23406 B12R1.1123 [13CH3]OCc1cc(c(cc1Cl)Br)F 34a_100010883925_200025704644 [0,2,0,0,0,0|2,0,0]=4 23407 B12R1.1123 [13CH3]OCc1cc(c(cc1Cl)Br)F 7a_100010883925_200025704644 [0,2,0,0,0,0|2,0,0]=4 23408 B12R1.1123 [13CH3]OCc1cc(c(cc1Cl)Cl)F 34a_100000043066_200025704644 [0,2,0,0,0,0|2,0,0]=4 23409 B12R1.1123 [13CH3]OCc1cc(c(cc1Cl)Cl)F 7a_100000043066_200025704644 [0,2,0,0,0,0|2,0,0]=4 23410 B12R1.1123 [13CH3]OCc1cc(c(cc1Cl)F)Br 34a_200021122263_200025704644 [0,2,0,0,0,0|2,0,0]=4 23411 B12R1.1123 [13CH3]OCc1cc(c(cc1Cl)F)Br 7a_200021122263_200025704644 [0,2,0,0,0,0|2,0,0]=4 23412 B12R1.1123 [13CH3]OCc1cc(c(cc1Cl)F)F 34a_100011996549_200025704644 [0,2,0,0,0,0|2,0,0]=4 23413 B12R1.1123 [13CH3]OCc1cc(c(cc1Cl)F)F 7a_100011996549_200025704644 [0,2,0,0,0,0|2,0,0]=4 23414 B12R1.1123 [13CH3]OCc1cc(c(cc1F)Br)F 34a_100012024398_200025704644 [0,2,0,0,0,0|2,0,0]=4 23415 B12R1.1123 [13CH3]OCc1cc(c(cc1F)Br)F 7a_100012024398_200025704644 [0,2,0,0,0,0|2,0,0]=4 23416 B12R1.1123 [13CH3]OCc1cc(c(cc1F)Cl)Br 34a_200011070574_200025704644 [0,2,0,0,0,0|2,0,0]=4 23417 B12R1.1123 [13CH3]OCc1cc(c(cc1F)Cl)Br 7a_200011070574_200025704644 [0,2,0,0,0,0|2,0,0]=4 23418 B12R1.1123 [13CH3]OCc1cc(c(cc1F)F)Cl 34a_100010365311_200025704644 [0,2,0,0,0,0|2,0,0]=4 23419 B12R1.1123 [13CH3]OCc1cc(c(cc1F)F)Cl 7a_100010365311_200025704644 [0,2,0,0,0,0|2,0,0]=4 23420 B12R1.1123 [13CH3]OCc1cc(c(cc1F)F)F 34a_100011215899_200025704644 [0,2,0,0,0,0|2,0,0]=4 23421 B12R1.1123 [13CH3]OCc1cc(c(cc1F)F)F 7a_100011215899_200025704644 [0,2,0,0,0,0|2,0,0]=4 23422 B12R1.1123 [13CH3]OCc1cc(c(cc1F)F)I 34a_100016029355_200025704644 [0,2,0,0,0,0|2,0,0]=4 23423 B12R1.1123 [13CH3]OCc1cc(c(cc1F)F)I 7a_100016029355_200025704644 [0,2,0,0,0,0|2,0,0]=4 23424 B12R1.1123 [13CH3]SCc1cc(c(cc1Br)F)F 62a_100010077255_200025704644 [0,2,0,0,0,0|2,0,0]=4 23425 B12R1.1123 [13CH3]SCc1cc(c(cc1Br)F)F 62a_200025704644_100010077255 [0,2,0,0,0,0|2,0,0]=4 23426 B12R1.1123 [13CH3]SCc1cc(c(cc1Cl)Cl)Cl 62a_100010220947_200025704644 [0,2,0,0,0,0|2,0,0]=4 23427 B12R1.1123 [13CH3]SCc1cc(c(cc1Cl)Cl)Cl 62a_200025704644_100010220947 [0,2,0,0,0,0|2,0,0]=4 23428 B12R1.1123 [13CH3]SCc1cc(c(cc1Cl)Cl)F 62a_100009813697_200025704644 [0,2,0,0,0,0|2,0,0]=4 23429 B12R1.1123 [13CH3]SCc1cc(c(cc1Cl)Cl)F 62a_200025704644_100009813697 [0,2,0,0,0,0|2,0,0]=4 23430 B12R1.1123 [13CH3]SCc1cc(c(cc1Cl)F)F 62a_100011830393_200025704644 [0,2,0,0,0,0|2,0,0]=4 23431 B12R1.1123 [13CH3]SCc1cc(c(cc1Cl)F)F 62a_200025704644_100011830393 [0,2,0,0,0,0|2,0,0]=4 23432 B12R1.1123 [13CH3]SCc1cc(c(cc1F)Br)F 62a_100012024439_200025704644 [0,2,0,0,0,0|2,0,0]=4 23433 B12R1.1123 [13CH3]SCc1cc(c(cc1F)Br)F 62a_200025704644_100012024439 [0,2,0,0,0,0|2,0,0]=4 23434 B12R1.1123 [13CH3]SCc1cc(c(cc1F)Cl)F 62a_200012361342_200025704644 [0,2,0,0,0,0|2,0,0]=4 23435 B12R1.1123 [13CH3]SCc1cc(c(cc1F)Cl)F 62a_200025704644_200012361342 [0,2,0,0,0,0|2,0,0]=4 23436 B12R1.1123 [13CH3]SCc1cc(c(cc1F)F)Cl 62a_100010994231_200025704644 [0,2,0,0,0,0|2,0,0]=4 23437 B12R1.1123 [13CH3]SCc1cc(c(cc1F)F)Cl 62a_200025704644_100010994231 [0,2,0,0,0,0|2,0,0]=4 23438 B12R1.1123 [13CH3]SCc1cc(c(cc1F)F)F 62a_100011218792_200025704644 [0,2,0,0,0,0|2,0,0]=4 23439 B12R1.1123 [13CH3]SCc1cc(c(cc1F)F)F 62a_200025704644_100011218792 [0,2,0,0,0,0|2,0,0]=4 23440 B12R1.1123 [13CH3]SCc1cc(c(cc1F)F)I 62a_100019984567_200025704644 [0,2,0,0,0,0|2,0,0]=4 23441 B12R1.1123 [13CH3]SCc1cc(c(cc1F)F)I 62a_200025704644_100019984567 [0,2,0,0,0,0|2,0,0]=4 23442 B12R1.1703 CC(N[13CH3])c1ccc(cc1Cl)Cl 2230a_100000179772_200025704644 [0,2,0,0,0,0|2,0,0]=4 23443 B12R1.1703 CC(N[13CH3])c1ccc(cc1Cl)Cl 34a_100000179772_200025704644 [0,2,0,0,0,0|2,0,0]=4 23444 B12R1.1703 CC(N[13CH3])c1ccc(cc1F)Br 2230a_100000730447_200025704644 [0,2,0,0,0,0|2,0,0]=4 23445 B12R1.1703 CC(N[13CH3])c1ccc(cc1F)Br 34a_100000730447_200025704644 [0,2,0,0,0,0|2,0,0]=4 23446 B12R1.1703 CC(N[13CH3])c1ccc(cc1F)F 2230a_100000181410_200025704644 [0,2,0,0,0,0|2,0,0]=4 23447 B12R1.1703 CC(N[13CH3])c1ccc(cc1F)F 34a_100000181410_200025704644 [0,2,0,0,0,0|2,0,0]=4 23448 B12R1.1703 CC(O[13CH3])c1ccc(cc1Cl)Cl 34a_100000743050_200025704644 [0,2,0,0,0,0|2,0,0]=4 23449 B12R1.1703 CC(O[13CH3])c1ccc(cc1Cl)Cl 7a_100000743050_200025704644 [0,2,0,0,0,0|2,0,0]=4 23450 B12R1.1703 CC(O[13CH3])c1ccc(cc1Cl)F 34a_200011245020_200025704644 [0,2,0,0,0,0|2,0,0]=4 23451 B12R1.1703 CC(O[13CH3])c1ccc(cc1Cl)F 7a_200011245020_200025704644 [0,2,0,0,0,0|2,0,0]=4 23452 B12R1.1703 CC(O[13CH3])c1ccc(cc1F)Cl 34a_200011805215_200025704644 [0,2,0,0,0,0|2,0,0]=4 23453 B12R1.1703 CC(O[13CH3])c1ccc(cc1F)Cl 7a_200011805215_200025704644 [0,2,0,0,0,0|2,0,0]=4 23454 B12R1.1703 CC(O[13CH3])c1ccc(cc1F)F 34a_200000246518_200025704644 [0,2,0,0,0,0|2,0,0]=4 23455 B12R1.1703 CC(O[13CH3])c1ccc(cc1F)F 7a_200000246518_200025704644 [0,2,0,0,0,0|2,0,0]=4 23456 B12R1.1703 CCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210202 [0,2,0,0,0,0|1,0,1]=4 23457 B12R1.1703 CCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000210202 [0,2,0,0,0,0|1,0,1]=4 23458 B12R1.1703 CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210202 [0,2,0,0,0,0|1,0,1]=4 23459 B12R1.1703 CCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210202 [0,2,0,0,0,0|1,0,1]=4 23460 B12R1.1703 CCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210202 [0,2,0,0,0,0|1,0,1]=4 23461 B12R1.1703 CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210202 [0,2,0,0,0,0|1,0,1]=4 23462 B12R1.1703 CCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000210202 [0,2,0,0,0,0|1,0,1]=4 23463 B12R1.1703 CCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000210202 [0,2,0,0,0,0|1,0,1]=4 23464 B12R1.1703 CCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210202 [0,2,0,0,0,0|1,0,1]=4 23465 B12R1.1703 CCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000210202 [0,2,0,0,0,0|1,0,1]=4 23466 B12R1.1703 CCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000210202 [0,2,0,0,0,0|1,0,1]=4 23467 B12R1.1703 CCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210202 [0,2,0,0,0,0|1,0,1]=4 23468 B12R1.1703 CCC(=O)c1ccc(cc1C)O 271570a_203496583355_200012361375 [0,2,0,0,0,0|1,0,1]=4 23469 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210202 [0,2,0,0,0,0|1,0,1]=4 23470 B12R1.1703 CCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210202 [0,2,0,0,0,0|1,0,1]=4 23471 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210202 [0,2,0,0,0,0|1,0,1]=4 23472 B12R1.1703 CCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210202 [0,2,0,0,0,0|1,0,1]=4 23473 B12R1.1703 CCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210202 [0,2,0,0,0,0|1,0,1]=4 23474 B12R1.1703 CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210202 [0,2,0,0,0,0|1,0,1]=4 23475 B12R1.1703 CCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210202 [0,2,0,0,0,0|1,0,1]=4 23476 B12R1.1703 CCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000210202 [0,2,0,0,0,0|1,0,1]=4 23477 B12R1.1703 CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210202 [0,2,0,0,0,0|1,0,1]=4 23478 B12R1.1703 CCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210202 [0,2,0,0,0,0|1,0,1]=4 23479 B12R1.1703 CCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210202 [0,2,0,0,0,0|1,0,1]=4 23480 B12R1.1703 CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210202 [0,2,0,0,0,0|1,0,1]=4 23481 B12R1.1703 CCC(=O)c1ccc(cc1F)O 271570a_203496583355_100012360378 [0,2,0,0,0,0|1,0,1]=4 23482 B12R1.1703 CCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210202 [0,2,0,0,0,0|1,0,1]=4 23483 B12R1.1703 CCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000210202 [0,2,0,0,0,0|1,0,1]=4 23484 B12R1.1703 CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210202 [0,2,0,0,0,0|1,0,1]=4 23485 B12R1.1703 CCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210202 [0,2,0,0,0,0|1,0,1]=4 23486 B12R1.1703 CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210202 [0,2,0,0,0,0|0,0,1]=3 23487 B12R1.1703 CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210202 [0,2,0,0,0,0|0,0,1]=3 23488 B12R1.1703 CCC(=O)c1ccc(cc1O)C 271570a_203496583355_200012349623 [0,2,0,0,0,0|0,0,1]=3 23489 B12R1.1703 CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210202 [0,2,0,0,0,0|0,0,1]=3 23490 B12R1.1703 CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210202 [0,2,0,0,0,0|0,0,1]=3 23491 B12R1.1703 CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210202 [0,2,0,0,0,0|0,0,1]=3 23492 B12R1.1703 CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210202 [0,2,0,0,0,0|0,0,1]=3 23493 B12R1.1703 CCN(C)c1ccc(cc1Br)Br 269982a_200000221195_100000204670 [0,2,0,0,0,0|2,0,0]=4 23494 B12R1.1703 CCN(C)c1ccc(cc1Br)Br 34a_200000221195_100000210202 [0,2,0,0,0,0|2,0,0]=4 23495 B12R1.1703 CCN(C)c1ccc(cc1Br)C 2230a_100000221369_100000210202 [0,2,0,0,0,0|2,0,0]=4 23496 B12R1.1703 CCN(C)c1ccc(cc1Br)C 269982a_100000221369_100000204670 [0,2,0,0,0,0|2,0,0]=4 23497 B12R1.1703 CCN(C)c1ccc(cc1Br)C 34a_100000221369_100000210202 [0,2,0,0,0,0|2,0,0]=4 23498 B12R1.1703 CCN(C)c1ccc(cc1Br)Cl 269982a_100020633009_100000204670 [0,2,0,0,0,0|2,0,0]=4 23499 B12R1.1703 CCN(C)c1ccc(cc1Br)Cl 34a_100020633009_100000210202 [0,2,0,0,0,0|2,0,0]=4 23500 B12R1.1703 CCN(C)c1ccc(cc1Br)F 269982a_100011246292_100000204670 [0,2,0,0,0,0|2,0,0]=4 23501 B12R1.1703 CCN(C)c1ccc(cc1Br)F 34a_100011246292_100000210202 [0,2,0,0,0,0|2,0,0]=4 23502 B12R1.1703 CCN(C)c1ccc(cc1C)Br 2230a_100000221803_100000210202 [0,2,0,0,0,0|2,0,0]=4 23503 B12R1.1703 CCN(C)c1ccc(cc1C)Br 269982a_100000221803_100000204670 [0,2,0,0,0,0|2,0,0]=4 23504 B12R1.1703 CCN(C)c1ccc(cc1C)Br 34a_100000221803_100000210202 [0,2,0,0,0,0|2,0,0]=4 23505 B12R1.1703 CCN(C)c1ccc(cc1C)Cl 2230a_114849113698_100000210202 [0,2,0,0,0,0|2,0,0]=4 23506 B12R1.1703 CCN(C)c1ccc(cc1C)Cl 269982a_114849113698_100000204670 [0,2,0,0,0,0|2,0,0]=4 23507 B12R1.1703 CCN(C)c1ccc(cc1C)Cl 34a_114849113698_100000210202 [0,2,0,0,0,0|2,0,0]=4 23508 B12R1.1703 CCN(C)c1ccc(cc1C)Cl 38a_114849113698_100000204670 [0,2,0,0,0,0|2,0,0]=4 23509 B12R1.1703 CCN(C)c1ccc(cc1C)F 2230a_100000221679_200000210301 [0,2,0,0,0,0|2,0,0]=4 23510 B12R1.1703 CCN(C)c1ccc(cc1C)F 269982a_100000221679_200000210301 [0,2,0,0,0,0|2,0,0]=4 23511 B12R1.1703 CCN(C)c1ccc(cc1C)F 34a_100000221679_200000210301 [0,2,0,0,0,0|2,0,0]=4 23512 B12R1.1703 CCN(C)c1ccc(cc1C)F 7a_100000221679_200000210301 [0,2,0,0,0,0|2,0,0]=4 23513 B12R1.1703 CCN(C)c1ccc(cc1C)O 269982a_100161107805_100000204670 [0,2,0,0,0,0|2,0,0]=4 23514 B12R1.1703 CCN(C)c1ccc(cc1C)O 34a_100161107805_100000210202 [0,2,0,0,0,0|2,0,0]=4 23515 B12R1.1703 CCN(C)c1ccc(cc1Cl)Br 269982a_100000221650_100000204670 [0,2,0,0,0,0|2,0,0]=4 23516 B12R1.1703 CCN(C)c1ccc(cc1Cl)Br 34a_100000221650_100000210202 [0,2,0,0,0,0|2,0,0]=4 23517 B12R1.1703 CCN(C)c1ccc(cc1Cl)Cl 269982a_100160557746_200000210301 [0,2,0,0,0,0|2,0,0]=4 23518 B12R1.1703 CCN(C)c1ccc(cc1Cl)Cl 269982a_114849113696_100000204670 [0,2,0,0,0,0|2,0,0]=4 23519 B12R1.1703 CCN(C)c1ccc(cc1Cl)Cl 34a_100160557746_200000210301 [0,2,0,0,0,0|2,0,0]=4 23520 B12R1.1703 CCN(C)c1ccc(cc1Cl)Cl 34a_114849113696_100000210202 [0,2,0,0,0,0|2,0,0]=4 23521 B12R1.1703 CCN(C)c1ccc(cc1F)Br 2230a_100000743884_100000210202 [0,2,0,0,0,0|2,0,0]=4 23522 B12R1.1703 CCN(C)c1ccc(cc1F)Br 269982a_100000743884_100000204670 [0,2,0,0,0,0|2,0,0]=4 23523 B12R1.1703 CCN(C)c1ccc(cc1F)Br 34a_100000743884_100000210202 [0,2,0,0,0,0|2,0,0]=4 23524 B12R1.1703 CCN(C)c1ccc(cc1F)F 2230a_100020633734_100000210202 [0,2,0,0,0,0|2,0,0]=4 23525 B12R1.1703 CCN(C)c1ccc(cc1F)F 269982a_100020633734_100000204670 [0,2,0,0,0,0|2,0,0]=4 23526 B12R1.1703 CCN(C)c1ccc(cc1F)F 34a_100020633734_100000210202 [0,2,0,0,0,0|2,0,0]=4 23527 B12R1.1703 CCN(C)c1ccc(cc1F)F 38a_100020633734_100000204670 [0,2,0,0,0,0|2,0,0]=4 23528 B12R1.1703 CCN(C)c1ccc(cc1F)I 269982a_114948340911_100000204670 [0,2,0,0,0,0|2,0,0]=4 23529 B12R1.1703 CCN(C)c1ccc(cc1F)I 34a_114948340911_100000210202 [0,2,0,0,0,0|2,0,0]=4 23530 B12R1.1703 CCN(C)c1ccc(cc1F)I 38a_114948340911_100000204670 [0,2,0,0,0,0|2,0,0]=4 23531 B12R1.1703 CCN([13CH3])c1ccc(cc1C)F 2230a_100000221679_200025704644 [0,2,0,0,0,0|2,0,0]=4 23532 B12R1.1703 CCN([13CH3])c1ccc(cc1C)F 269982a_100000221679_200025704644 [0,2,0,0,0,0|2,0,0]=4 23533 B12R1.1703 CCN([13CH3])c1ccc(cc1C)F 34a_100000221679_200025704644 [0,2,0,0,0,0|2,0,0]=4 23534 B12R1.1703 CCN([13CH3])c1ccc(cc1C)F 7a_100000221679_200025704644 [0,2,0,0,0,0|2,0,0]=4 23535 B12R1.1703 CCN([13CH3])c1ccc(cc1Cl)Cl 269982a_100160557746_200025704644 [0,2,0,0,0,0|2,0,0]=4 23536 B12R1.1703 CCN([13CH3])c1ccc(cc1Cl)Cl 34a_100160557746_200025704644 [0,2,0,0,0,0|2,0,0]=4 23537 B12R1.1703 CNC(=O)c1ccc(cc1O)Br 240690a_100102657272_100000744433 [0,2,0,0,0,0|1,0,1]=4 23538 B12R1.1703 CNC(=O)c1ccc(cc1O)Br 527a_100102657272_100000744433 [0,2,0,0,0,0|1,0,1]=4 23539 B12R1.1703 CNC(=O)c1ccc(cc1O)C 1626a_100102657272_100000212137 [0,2,0,0,0,0|1,0,1]=4 23540 B12R1.1703 CNC(=O)c1ccc(cc1O)C 240690a_100102657272_100000212137 [0,2,0,0,0,0|1,0,1]=4 23541 B12R1.1703 CNC(=O)c1ccc(cc1O)C 527a_100102657272_100000212137 [0,2,0,0,0,0|1,0,1]=4 23542 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 11a_106832991635_100000188622 [0,2,0,0,0,0|1,0,1]=4 23543 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 240690a_100102657272_100000188622 [0,2,0,0,0,0|1,0,1]=4 23544 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 527a_100102657272_100000188622 [0,2,0,0,0,0|1,0,1]=4 23545 B12R1.1703 CNC(=O)c1ccc(cc1O)F 240690a_100102657272_100000746061 [0,2,0,0,0,0|1,0,1]=4 23546 B12R1.1703 CNC(=O)c1ccc(cc1O)F 271570a_203496583355_200000206206 [0,2,0,0,0,0|1,0,1]=4 23547 B12R1.1703 CNC(=O)c1ccc(cc1O)F 527a_100102657272_100000746061 [0,2,0,0,0,0|1,0,1]=4 23548 B12R1.1703 CNC(=O)c1ccc(cc1O)I 240690a_100102657272_100000091984 [0,2,0,0,0,0|1,0,1]=4 23549 B12R1.1703 CNC(=O)c1ccc(cc1O)I 527a_100102657272_100000091984 [0,2,0,0,0,0|1,0,1]=4 23550 B12R1.1703 CNC(C)c1ccc(cc1Br)Br 269862a_106832991636_100000183147 [0,2,0,0,0,0|2,0,0]=4 23551 B12R1.1703 CNC(C)c1ccc(cc1Br)C 269862a_106832991636_100012353930 [0,2,0,0,0,0|2,0,0]=4 23552 B12R1.1703 CNC(C)c1ccc(cc1Br)Cl 269862a_106832991636_100011934292 [0,2,0,0,0,0|2,0,0]=4 23553 B12R1.1703 CNC(C)c1ccc(cc1Br)F 269862a_106832991636_100000686192 [0,2,0,0,0,0|2,0,0]=4 23554 B12R1.1703 CNC(C)c1ccc(cc1C)Br 269862a_106832991636_100012360112 [0,2,0,0,0,0|2,0,0]=4 23555 B12R1.1703 CNC(C)c1ccc(cc1C)C 269862a_106832991636_100000211561 [0,2,0,0,0,0|2,0,0]=4 23556 B12R1.1703 CNC(C)c1ccc(cc1C)Cl 269862a_106832991636_100011998434 [0,2,0,0,0,0|2,0,0]=4 23557 B12R1.1703 CNC(C)c1ccc(cc1C)F 269862a_106832991636_100000753884 [0,2,0,0,0,0|2,0,0]=4 23558 B12R1.1703 CNC(C)c1ccc(cc1Cl)Br 269862a_106832991636_100000693907 [0,2,0,0,0,0|2,0,0]=4 23559 B12R1.1703 CNC(C)c1ccc(cc1Cl)Cl 2230a_100000179772_200000210301 [0,2,0,0,0,0|2,0,0]=4 23560 B12R1.1703 CNC(C)c1ccc(cc1Cl)Cl 269862a_106832991636_100000210972 [0,2,0,0,0,0|2,0,0]=4 23561 B12R1.1703 CNC(C)c1ccc(cc1Cl)Cl 34a_100000179772_200000210301 [0,2,0,0,0,0|2,0,0]=4 23562 B12R1.1703 CNC(C)c1ccc(cc1Cl)F 269862a_106832991636_100000214953 [0,2,0,0,0,0|2,0,0]=4 23563 B12R1.1703 CNC(C)c1ccc(cc1F)Br 2230a_100000730447_200000210301 [0,2,0,0,0,0|2,0,0]=4 23564 B12R1.1703 CNC(C)c1ccc(cc1F)Br 269862a_106832991636_100000690205 [0,2,0,0,0,0|2,0,0]=4 23565 B12R1.1703 CNC(C)c1ccc(cc1F)Br 34a_100000730447_200000210301 [0,2,0,0,0,0|2,0,0]=4 23566 B12R1.1703 CNC(C)c1ccc(cc1F)C 269862a_106832991636_100011216410 [0,2,0,0,0,0|2,0,0]=4 23567 B12R1.1703 CNC(C)c1ccc(cc1F)Cl 269862a_106832991636_100011805184 [0,2,0,0,0,0|2,0,0]=4 23568 B12R1.1703 CNC(C)c1ccc(cc1F)F 2230a_100000181410_200000210301 [0,2,0,0,0,0|2,0,0]=4 23569 B12R1.1703 CNC(C)c1ccc(cc1F)F 269862a_106832991636_100000185200 [0,2,0,0,0,0|2,0,0]=4 23570 B12R1.1703 CNC(C)c1ccc(cc1F)F 34a_100000181410_200000210301 [0,2,0,0,0,0|2,0,0]=4 23571 B12R1.1703 CNC(C)c1ccc(cc1O)Br 269862a_106832991636_100000188348 [0,2,0,0,0,0|1,0,0]=3 23572 B12R1.1703 CNC(C)c1ccc(cc1O)C 269862a_106832991636_100000234885 [0,2,0,0,0,0|1,0,0]=3 23573 B12R1.1703 CNC(C)c1ccc(cc1O)Cl 269862a_106832991636_100000061402 [0,2,0,0,0,0|1,0,0]=3 23574 B12R1.1703 CNC(C)c1ccc(cc1O)F 269862a_106832991636_100011215782 [0,2,0,0,0,0|1,0,0]=3 23575 B12R1.1703 CN[C@@H](C)c1ccc(cc1C)C 2230a_100000745882_200000210301 [0,2,0,0,0,0|2,0,0]=4 23576 B12R1.1703 CN[C@@H](C)c1ccc(cc1C)C 34a_100000745882_200000210301 [0,2,0,0,0,0|2,0,0]=4 23577 B12R1.1703 CN[C@@H](C)c1ccc(cc1C)Cl 2230a_100020633667_200000210301 [0,2,0,0,0,0|2,0,0]=4 23578 B12R1.1703 CN[C@@H](C)c1ccc(cc1C)Cl 34a_100020633667_200000210301 [0,2,0,0,0,0|2,0,0]=4 23579 B12R1.1703 CN[C@H](C)c1ccc(cc1Br)F 2230a_100025704064_200000210301 [0,2,0,0,0,0|2,0,0]=4 23580 B12R1.1703 CN[C@H](C)c1ccc(cc1Br)F 34a_100025704064_200000210301 [0,2,0,0,0,0|2,0,0]=4 23581 B12R1.1703 CN[C@H](C)c1ccc(cc1Cl)F 2230a_100015196781_200000210301 [0,2,0,0,0,0|2,0,0]=4 23582 B12R1.1703 CN[C@H](C)c1ccc(cc1Cl)F 34a_100015196781_200000210301 [0,2,0,0,0,0|2,0,0]=4 23583 B12R1.1703 COC(=O)c1ccc(cc1O)Br 271570a_203496583355_100000701758 [0,2,0,0,0,0|1,0,1]=4 23584 B12R1.1703 COC(=O)c1ccc(cc1O)C 271570a_203496583355_100012340597 [0,2,0,0,0,0|1,0,1]=4 23585 B12R1.1703 COC(=O)c1ccc(cc1O)Cl 271570a_203496583355_100000047510 [0,2,0,0,0,0|1,0,1]=4 23586 B12R1.1703 COC(=O)c1ccc(cc1O)F 271570a_203496583355_100000204356 [0,2,0,0,0,0|1,0,1]=4 23587 B12R1.1703 COC(=O)c1ccc(cc1O)N 271570a_203496583355_100009998378 [0,2,0,0,0,0|1,0,1]=4 23588 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100000062286 [0,2,0,0,0,0|1,0,1]=4 23589 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100010150825 [0,2,0,0,0,0|1,0,1]=4 23590 B12R1.1703 COC(C)c1ccc(cc1C)C 34a_100000246504_200000210301 [0,2,0,0,0,0|2,0,0]=4 23591 B12R1.1703 COC(C)c1ccc(cc1C)C 7a_100000246504_200000210301 [0,2,0,0,0,0|2,0,0]=4 23592 B12R1.1703 COC(C)c1ccc(cc1Cl)Cl 34a_100000743050_200000210301 [0,2,0,0,0,0|2,0,0]=4 23593 B12R1.1703 COC(C)c1ccc(cc1Cl)Cl 7a_100000743050_200000210301 [0,2,0,0,0,0|2,0,0]=4 23594 B12R1.1703 COC(C)c1ccc(cc1Cl)F 34a_200011245020_200000210301 [0,2,0,0,0,0|2,0,0]=4 23595 B12R1.1703 COC(C)c1ccc(cc1Cl)F 7a_200011245020_200000210301 [0,2,0,0,0,0|2,0,0]=4 23596 B12R1.1703 COC(C)c1ccc(cc1F)Cl 34a_200011805215_200000210301 [0,2,0,0,0,0|2,0,0]=4 23597 B12R1.1703 COC(C)c1ccc(cc1F)Cl 7a_200011805215_200000210301 [0,2,0,0,0,0|2,0,0]=4 23598 B12R1.1703 COC(C)c1ccc(cc1F)F 34a_200000246518_200000210301 [0,2,0,0,0,0|2,0,0]=4 23599 B12R1.1703 COC(C)c1ccc(cc1F)F 7a_200000246518_200000210301 [0,2,0,0,0,0|2,0,0]=4 23600 B12R1.1703 C[C@@H](N[13CH3])c1ccc(cc1Br)F 2230a_100025704064_200025704644 [0,2,0,0,0,0|2,0,0]=4 23601 B12R1.1703 C[C@@H](N[13CH3])c1ccc(cc1Br)F 34a_100025704064_200025704644 [0,2,0,0,0,0|2,0,0]=4 23602 B12R1.1703 C[C@@H](N[13CH3])c1ccc(cc1Cl)F 2230a_100015196781_200025704644 [0,2,0,0,0,0|2,0,0]=4 23603 B12R1.1703 C[C@@H](N[13CH3])c1ccc(cc1Cl)F 34a_100015196781_200025704644 [0,2,0,0,0,0|2,0,0]=4 23604 B12R1.1703 Cc1cc(ccc1[C@H](C)N[13CH3])Cl 2230a_100020633667_200025704644 [0,2,0,0,0,0|2,0,0]=4 23605 B12R1.1703 Cc1cc(ccc1[C@H](C)N[13CH3])Cl 34a_100020633667_200025704644 [0,2,0,0,0,0|2,0,0]=4 23606 B12R1.1703 Cc1cc(ccc1[C@H](N)CO)O 271570a_203496583355_100138412551 [0,2,0,0,0,0|2,0,0]=4 23607 B12R1.1703 Cc1ccc(c(c1)C)C(C)O[13CH3] 34a_100000246504_200025704644 [0,2,0,0,0,0|2,0,0]=4 23608 B12R1.1703 Cc1ccc(c(c1)C)C(C)O[13CH3] 7a_100000246504_200025704644 [0,2,0,0,0,0|2,0,0]=4 23609 B12R1.1703 Cc1ccc(c(c1)C)[C@H](C)N[13CH3] 2230a_100000745882_200025704644 [0,2,0,0,0,0|2,0,0]=4 23610 B12R1.1703 Cc1ccc(c(c1)C)[C@H](C)N[13CH3] 34a_100000745882_200025704644 [0,2,0,0,0,0|2,0,0]=4 23611 B12R1.1703 Cc1ccc(c(c1)O)C(=O)CF 1458a_100000212137_100015361967 [0,2,0,0,0,0|1,0,1]=4 23612 B12R1.1703 O=C(CF)c1ccc(cc1O)Br 1458a_100000744433_100015361967 [0,2,0,0,0,0|1,0,1]=4 23613 B12R1.1703 O=C(CF)c1ccc(cc1O)Cl 1458a_100000188622_100015361967 [0,2,0,0,0,0|1,0,1]=4 23614 B12R1.1703 O=C(CF)c1ccc(cc1O)F 1458a_100000746061_100015361967 [0,2,0,0,0,0|1,0,1]=4 23615 B12R1.1703 O=C(CF)c1ccc(cc1O)I 1458a_100000091984_100015361967 [0,2,0,0,0,0|1,0,1]=4 23616 B12R1.1703 O=C(CF)c1ccc(cc1O)O 1458a_100000212172_100015361967 [0,2,0,0,0,0|1,0,1]=4 23617 B12R1.124 CC(=C(C)c1ccccc1O)C 271570a_200000049429_100000739446 [0,2,0,0,0,0|0,0,2]=4 23618 B12R1.124 CC(=O)C(C)c1ccccc1Br 1458a_100012359601_200000210301 [0,2,0,0,0,0|1,0,1]=4 23619 B12R1.124 CC(=O)C(C)c1ccccc1Cl 1458a_100000070787_100000181259 [0,2,0,0,0,0|1,0,1]=4 23620 B12R1.124 CC(=O)C(C)c1ccccc1Cl 1458a_100011667492_200000210301 [0,2,0,0,0,0|1,0,1]=4 23621 B12R1.124 CC(=O)C(C)c1ccccc1F 1458a_100000070787_200000741388 [0,2,0,0,0,0|1,0,1]=4 23622 B12R1.124 CC(=O)C(O)c1ccccc1Br 1458a_200011356456_200000210301 [0,2,0,0,0,0|1,0,1]=4 23623 B12R1.124 CC(=O)C(O)c1ccccc1Cl 1458a_100011217820_200000210301 [0,2,0,0,0,0|1,0,1]=4 23624 B12R1.124 CC(=O)C(O)c1ccccc1F 1458a_100011219519_200000210301 [0,2,0,0,0,0|1,0,1]=4 23625 B12R1.124 CC(=O)N(C)c1ccccc1O 22a_100000033821_100000070787 [0,2,0,0,0,0|1,0,1]=4 23626 B12R1.124 CC(=O)N(C)c1ccccc1O 527a_100000033821_100103153847 [0,2,0,0,0,0|1,0,1]=4 23627 B12R1.124 CC(C(=O)[13CH3])c1ccccc1Br 1458a_100012359601_200025704644 [0,2,0,0,0,0|1,0,1]=4 23628 B12R1.124 CC(C(=O)[13CH3])c1ccccc1Cl 1458a_100011667492_200025704644 [0,2,0,0,0,0|1,0,1]=4 23629 B12R1.124 CC(C)C(=O)c1ccccc1Br 1458a_100000188424_100000210206 [0,2,0,0,0,0|1,0,1]=4 23630 B12R1.124 CC(C)C(=O)c1ccccc1Cl 1458a_100000185844_100000210206 [0,2,0,0,0,0|1,0,1]=4 23631 B12R1.124 CC(C)C(=O)c1ccccc1F 1458a_100000188656_100000210206 [0,2,0,0,0,0|1,0,1]=4 23632 B12R1.124 CC(C)C(=O)c1ccccc1I 1458a_100000187884_100000210206 [0,2,0,0,0,0|1,0,1]=4 23633 B12R1.124 CC(C)C(=O)c1ccccc1O 1458a_100015234032_100000210206 [0,2,0,0,0,0|0,0,1]=3 23634 B12R1.124 CC(C)C(=O)c1ccccc1[O-] 1458a_100009911694_100000210206 [0,2,0,0,0,0|0,0,2]=4 23635 B12R1.124 CC(C)N(C)c1ccccc1Br 2230a_100020606079_100000210206 [0,2,0,0,0,0|2,0,0]=4 23636 B12R1.124 CC(C)N(C)c1ccccc1Br 269982a_100000219599_200000210301 [0,2,0,0,0,0|2,0,0]=4 23637 B12R1.124 CC(C)N(C)c1ccccc1Br 269982a_100020606079_100000210206 [0,2,0,0,0,0|2,0,0]=4 23638 B12R1.124 CC(C)N(C)c1ccccc1Br 34a_100000219599_200000210301 [0,2,0,0,0,0|2,0,0]=4 23639 B12R1.124 CC(C)N(C)c1ccccc1Br 34a_100020606079_100000210206 [0,2,0,0,0,0|2,0,0]=4 23640 B12R1.124 CC(C)N(C)c1ccccc1Br 7a_100000219599_200000210301 [0,2,0,0,0,0|2,0,0]=4 23641 B12R1.124 CC(C)N(C)c1ccccc1Cl 2230a_100000219374_100000210206 [0,2,0,0,0,0|2,0,0]=4 23642 B12R1.124 CC(C)N(C)c1ccccc1Cl 269982a_100000219374_100000210206 [0,2,0,0,0,0|2,0,0]=4 23643 B12R1.124 CC(C)N(C)c1ccccc1Cl 269982a_100000219376_200000210301 [0,2,0,0,0,0|2,0,0]=4 23644 B12R1.124 CC(C)N(C)c1ccccc1Cl 34a_100000219374_100000210206 [0,2,0,0,0,0|2,0,0]=4 23645 B12R1.124 CC(C)N(C)c1ccccc1Cl 34a_100000219376_200000210301 [0,2,0,0,0,0|2,0,0]=4 23646 B12R1.124 CC(C)N(C)c1ccccc1Cl 7a_100000219376_200000210301 [0,2,0,0,0,0|2,0,0]=4 23647 B12R1.124 CC(C)N(C)c1ccccc1F 2230a_100000220357_100000210206 [0,2,0,0,0,0|2,0,0]=4 23648 B12R1.124 CC(C)N(C)c1ccccc1F 269982a_100000220357_100000210206 [0,2,0,0,0,0|2,0,0]=4 23649 B12R1.124 CC(C)N(C)c1ccccc1F 269982a_100000220358_200000210301 [0,2,0,0,0,0|2,0,0]=4 23650 B12R1.124 CC(C)N(C)c1ccccc1F 34a_100000220357_100000210206 [0,2,0,0,0,0|2,0,0]=4 23651 B12R1.124 CC(C)N(C)c1ccccc1F 34a_100000220358_200000210301 [0,2,0,0,0,0|2,0,0]=4 23652 B12R1.124 CC(C)N(C)c1ccccc1F 38a_100000220357_100000210206 [0,2,0,0,0,0|2,0,0]=4 23653 B12R1.124 CC(C)N(C)c1ccccc1F 38a_100000220358_200000210301 [0,2,0,0,0,0|2,0,0]=4 23654 B12R1.124 CC(C)N(C)c1ccccc1F 7a_100000220358_200000210301 [0,2,0,0,0,0|2,0,0]=4 23655 B12R1.124 CC(C)N(C)c1ccccc1O 269982a_100000033821_100000210206 [0,2,0,0,0,0|1,0,0]=3 23656 B12R1.124 CC(C)N([13CH3])c1ccccc1Br 269982a_100000219599_200025704644 [0,2,0,0,0,0|2,0,0]=4 23657 B12R1.124 CC(C)N([13CH3])c1ccccc1Br 34a_100000219599_200025704644 [0,2,0,0,0,0|2,0,0]=4 23658 B12R1.124 CC(C)N([13CH3])c1ccccc1Br 7a_100000219599_200025704644 [0,2,0,0,0,0|2,0,0]=4 23659 B12R1.124 CC(C)N([13CH3])c1ccccc1Cl 269982a_100000219376_200025704644 [0,2,0,0,0,0|2,0,0]=4 23660 B12R1.124 CC(C)N([13CH3])c1ccccc1Cl 34a_100000219376_200025704644 [0,2,0,0,0,0|2,0,0]=4 23661 B12R1.124 CC(C)N([13CH3])c1ccccc1Cl 7a_100000219376_200025704644 [0,2,0,0,0,0|2,0,0]=4 23662 B12R1.124 CC(C)N([13CH3])c1ccccc1F 269982a_100000220358_200025704644 [0,2,0,0,0,0|2,0,0]=4 23663 B12R1.124 CC(C)N([13CH3])c1ccccc1F 34a_100000220358_200025704644 [0,2,0,0,0,0|2,0,0]=4 23664 B12R1.124 CC(C)N([13CH3])c1ccccc1F 38a_100000220358_200025704644 [0,2,0,0,0,0|2,0,0]=4 23665 B12R1.124 CC(C)N([13CH3])c1ccccc1F 7a_100000220358_200025704644 [0,2,0,0,0,0|2,0,0]=4 23666 B12R1.124 CC(c1ccccc1Br)N(C)C 2230a_100000692418_200000210301 [0,2,0,0,0,0|2,0,0]=4 23667 B12R1.124 CC(c1ccccc1Br)N(C)C 269982a_100000692418_200000210301 [0,2,0,0,0,0|2,0,0]=4 23668 B12R1.124 CC(c1ccccc1Br)N(C)[13CH3] 2230a_100000692418_200025704644 [0,2,0,0,0,0|2,0,0]=4 23669 B12R1.124 CC(c1ccccc1Br)N(C)[13CH3] 269982a_100000692418_200025704644 [0,2,0,0,0,0|2,0,0]=4 23670 B12R1.124 CC(c1ccccc1Cl)N(C)C 2230a_100102631434_100000181259 [0,2,0,0,0,0|2,0,0]=4 23671 B12R1.124 CC(c1ccccc1Cl)N(C)C 269982a_100102631434_100000181259 [0,2,0,0,0,0|2,0,0]=4 23672 B12R1.124 CC(c1ccccc1F)N(C)C 2230a_100000231110_200000210301 [0,2,0,0,0,0|2,0,0]=4 23673 B12R1.124 CC(c1ccccc1F)N(C)C 2230a_100102631434_200000741388 [0,2,0,0,0,0|2,0,0]=4 23674 B12R1.124 CC(c1ccccc1F)N(C)C 269982a_100000231110_200000210301 [0,2,0,0,0,0|2,0,0]=4 23675 B12R1.124 CC(c1ccccc1F)N(C)C 269982a_100102631434_200000741388 [0,2,0,0,0,0|2,0,0]=4 23676 B12R1.124 CC(c1ccccc1F)N(C)C 34a_100000231110_200000210301 [0,2,0,0,0,0|2,0,0]=4 23677 B12R1.124 CC(c1ccccc1F)N(C)[13CH3] 2230a_100000231110_200025704644 [0,2,0,0,0,0|2,0,0]=4 23678 B12R1.124 CC(c1ccccc1F)N(C)[13CH3] 269982a_100000231110_200025704644 [0,2,0,0,0,0|2,0,0]=4 23679 B12R1.124 CC(c1ccccc1F)N(C)[13CH3] 34a_100000231110_200025704644 [0,2,0,0,0,0|2,0,0]=4 23680 B12R1.124 CN(C)C(=O)c1ccccc1O 240690a_100102631434_100015234032 [0,2,0,0,0,0|1,0,1]=4 23681 B12R1.124 CN(C)C(=O)c1ccccc1O 271570a_203496583355_100000159526 [0,2,0,0,0,0|1,0,1]=4 23682 B12R1.124 Cc1ccccc1C(=O)C(C)C 1458a_100000212026_100000210206 [0,2,0,0,0,0|1,0,1]=4 23683 B12R1.124 Cc1ccccc1N(C)C(C)C 2230a_100000219699_100000210206 [0,2,0,0,0,0|2,0,0]=4 23684 B12R1.124 Cc1ccccc1N(C)C(C)C 2230a_100000219700_200000210301 [0,2,0,0,0,0|2,0,0]=4 23685 B12R1.124 Cc1ccccc1N(C)C(C)C 269982a_100000219699_100000210206 [0,2,0,0,0,0|2,0,0]=4 23686 B12R1.124 Cc1ccccc1N(C)C(C)C 269982a_100000219700_200000210301 [0,2,0,0,0,0|2,0,0]=4 23687 B12R1.124 Cc1ccccc1N(C)C(C)C 34a_100000219699_100000210206 [0,2,0,0,0,0|2,0,0]=4 23688 B12R1.124 Cc1ccccc1N(C)C(C)C 34a_100000219700_200000210301 [0,2,0,0,0,0|2,0,0]=4 23689 B12R1.124 Cc1ccccc1N(C)C(C)C 7a_100000219700_200000210301 [0,2,0,0,0,0|2,0,0]=4 23690 B12R1.124 Cc1ccccc1N([13CH3])C(C)C 2230a_100000219700_200025704644 [0,2,0,0,0,0|2,0,0]=4 23691 B12R1.124 Cc1ccccc1N([13CH3])C(C)C 269982a_100000219700_200025704644 [0,2,0,0,0,0|2,0,0]=4 23692 B12R1.124 Cc1ccccc1N([13CH3])C(C)C 34a_100000219700_200025704644 [0,2,0,0,0,0|2,0,0]=4 23693 B12R1.124 Cc1ccccc1N([13CH3])C(C)C 7a_100000219700_200025704644 [0,2,0,0,0,0|2,0,0]=4 23694 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1Br 1458a_200011356456_200025704644 [0,2,0,0,0,0|1,0,1]=4 23695 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1Cl 1458a_100011217820_200025704644 [0,2,0,0,0,0|1,0,1]=4 23696 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1F 1458a_100011219519_200025704644 [0,2,0,0,0,0|1,0,1]=4 23697 B12R1.127 CC(=Cc1cc(ccc1O)Br)C 271570a_100102525489_100012355227 [0,2,0,0,0,0|0,0,2]=4 23698 B12R1.127 CC(=Cc1cc(ccc1O)C)C 271570a_100102525489_100000765521 [0,2,0,0,0,0|0,0,2]=4 23699 B12R1.127 CC(=Cc1cc(ccc1O)Cl)C 271570a_100102525489_100011356953 [0,2,0,0,0,0|0,0,2]=4 23700 B12R1.127 CC(=Cc1cc(ccc1O)F)C 271570a_100102525489_100000211999 [0,2,0,0,0,0|0,0,2]=4 23701 B12R1.127 CC(=Cc1cc(ccc1O)N)C 271570a_100102525489_100011534360 [0,2,0,0,0,0|0,0,2]=4 23702 B12R1.127 CC(=Cc1cc(ccc1O)O)C 271570a_100102525489_100009813629 [0,2,0,0,0,0|0,0,2]=4 23703 B12R1.127 CC(=O)Cc1cc(ccc1Br)Br 1458a_100000070787_100011982794 [0,2,0,0,0,0|1,0,1]=4 23704 B12R1.127 CC(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_200000210301 [0,2,0,0,0,0|1,0,1]=4 23705 B12R1.127 CC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_200000210301 [0,2,0,0,0,0|1,0,1]=4 23706 B12R1.127 CC(=O)Cc1cc(ccc1Br)Cl 1458a_100000070787_100000733903 [0,2,0,0,0,0|1,0,1]=4 23707 B12R1.127 CC(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_200000210301 [0,2,0,0,0,0|1,0,1]=4 23708 B12R1.127 CC(=O)Cc1cc(ccc1Br)F 1458a_100000070787_100000736370 [0,2,0,0,0,0|1,0,1]=4 23709 B12R1.127 CC(=O)Cc1cc(ccc1Br)F 1458a_100000690878_200000210301 [0,2,0,0,0,0|1,0,1]=4 23710 B12R1.127 CC(=O)Cc1cc(ccc1Br)I 1458a_100000070787_100012355412 [0,2,0,0,0,0|1,0,1]=4 23711 B12R1.127 CC(=O)Cc1cc(ccc1C)Br 1458a_100010244045_200000210301 [0,2,0,0,0,0|1,0,1]=4 23712 B12R1.127 CC(=O)Cc1cc(ccc1C)C 1458a_100000070787_100000184699 [0,2,0,0,0,0|1,0,1]=4 23713 B12R1.127 CC(=O)Cc1cc(ccc1C)C 1458a_100000749331_200000210301 [0,2,0,0,0,0|1,0,1]=4 23714 B12R1.127 CC(=O)Cc1cc(ccc1C)Cl 1458a_100000070787_100012186985 [0,2,0,0,0,0|1,0,1]=4 23715 B12R1.127 CC(=O)Cc1cc(ccc1C)F 1458a_100000070787_100000709795 [0,2,0,0,0,0|1,0,1]=4 23716 B12R1.127 CC(=O)Cc1cc(ccc1C)F 1458a_100011219217_200000210301 [0,2,0,0,0,0|1,0,1]=4 23717 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Br 1458a_100000070787_100000763347 [0,2,0,0,0,0|1,0,1]=4 23718 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_200000210301 [0,2,0,0,0,0|1,0,1]=4 23719 B12R1.127 CC(=O)Cc1cc(ccc1Cl)C 1458a_100000070787_100009871730 [0,2,0,0,0,0|1,0,1]=4 23720 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000070787_100000754809 [0,2,0,0,0,0|1,0,1]=4 23721 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_200000210301 [0,2,0,0,0,0|1,0,1]=4 23722 B12R1.127 CC(=O)Cc1cc(ccc1Cl)F 1458a_100000070787_100000709952 [0,2,0,0,0,0|1,0,1]=4 23723 B12R1.127 CC(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_200000210301 [0,2,0,0,0,0|1,0,1]=4 23724 B12R1.127 CC(=O)Cc1cc(ccc1Cl)I 1458a_100000070787_100010188191 [0,2,0,0,0,0|1,0,1]=4 23725 B12R1.127 CC(=O)Cc1cc(ccc1F)Br 1458a_100000070787_100000736399 [0,2,0,0,0,0|1,0,1]=4 23726 B12R1.127 CC(=O)Cc1cc(ccc1F)Br 1458a_100000690877_200000210301 [0,2,0,0,0,0|1,0,1]=4 23727 B12R1.127 CC(=O)Cc1cc(ccc1F)C 1458a_100000070787_100011260760 [0,2,0,0,0,0|1,0,1]=4 23728 B12R1.127 CC(=O)Cc1cc(ccc1F)C 1458a_100011667363_200000210301 [0,2,0,0,0,0|1,0,1]=4 23729 B12R1.127 CC(=O)Cc1cc(ccc1F)Cl 1458a_100000070787_100000716957 [0,2,0,0,0,0|1,0,1]=4 23730 B12R1.127 CC(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_200000210301 [0,2,0,0,0,0|1,0,1]=4 23731 B12R1.127 CC(=O)Cc1cc(ccc1F)F 1458a_100000070787_100000741279 [0,2,0,0,0,0|1,0,1]=4 23732 B12R1.127 CC(=O)Cc1cc(ccc1F)F 1458a_100000762760_200000210301 [0,2,0,0,0,0|1,0,1]=4 23733 B12R1.127 CC(=O)Cc1cc(ccc1F)I 1458a_100000070787_200010149601 [0,2,0,0,0,0|1,0,1]=4 23734 B12R1.127 CC(=O)Cc1cc(ccc1I)Br 1458a_100000070787_100012362523 [0,2,0,0,0,0|1,0,1]=4 23735 B12R1.127 CC(=O)Cc1cc(ccc1I)Cl 1458a_100000070787_100012348826 [0,2,0,0,0,0|1,0,1]=4 23736 B12R1.127 CC(=O)Cc1cc(ccc1I)F 1458a_100000070787_100010149606 [0,2,0,0,0,0|1,0,1]=4 23737 B12R1.127 CC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_200000210301 [0,2,0,0,0,0|0,0,1]=3 23738 B12R1.127 CC(=O)Cc1cc(ccc1O)F 1458a_100000070787_100010161318 [0,2,0,0,0,0|0,0,1]=3 23739 B12R1.127 CC(=O)Cc1cc(ccc1O)O 1458a_100000038496_200000210301 [0,2,0,0,0,0|0,0,1]=3 23740 B12R1.127 CC(=O)Cc1cc(ccc1O)O 271570a_203496583355_200010006938 [0,2,0,0,0,0|0,0,1]=3 23741 B12R1.127 CC(=O)Cc1nc(ccc1O)C 1458a_100000070787_100020630696 [0,2,0,0,0,0|1,0,1]=4 23742 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000070787 [0,2,0,0,0,0|1,0,1]=4 23743 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100103153847 [0,2,0,0,0,0|1,0,1]=4 23744 B12R1.127 CC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000070787 [0,2,0,0,0,0|1,0,1]=4 23745 B12R1.127 CC(=O)Nc1cc(ccc1O)C 271570a_203496583355_100000182586 [0,2,0,0,0,0|1,0,1]=4 23746 B12R1.127 CC(=O)Nc1cc(ccc1O)C 527a_100011215204_100103153847 [0,2,0,0,0,0|1,0,1]=4 23747 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000070787 [0,2,0,0,0,0|1,0,1]=4 23748 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100103153847 [0,2,0,0,0,0|1,0,1]=4 23749 B12R1.127 CC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000070787 [0,2,0,0,0,0|1,0,1]=4 23750 B12R1.127 CC(=O)Nc1cc(ccc1O)F 271570a_203496583355_100012558231 [0,2,0,0,0,0|1,0,1]=4 23751 B12R1.127 CC(=O)Nc1cc(ccc1O)F 527a_100000759472_100103153847 [0,2,0,0,0,0|1,0,1]=4 23752 B12R1.127 CC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000070787 [0,2,0,0,0,0|1,0,1]=4 23753 B12R1.127 CC(=O)Nc1cc(ccc1O)I 527a_100000753495_100103153847 [0,2,0,0,0,0|1,0,1]=4 23754 B12R1.127 CC(=O)Oc1cc(ccc1O)F 271570a_203496583355_200015685721 [0,2,0,0,0,0|1,0,1]=4 23755 B12R1.127 CC(C)Nc1cc(ccc1Br)Br 34a_100000737762_100000210206 [0,2,0,0,0,0|2,0,0]=4 23756 B12R1.127 CC(C)Nc1cc(ccc1Br)Cl 34a_100000687073_100000210206 [0,2,0,0,0,0|2,0,0]=4 23757 B12R1.127 CC(C)Nc1cc(ccc1Br)F 34a_100000687223_100000210206 [0,2,0,0,0,0|2,0,0]=4 23758 B12R1.127 CC(C)Nc1cc(ccc1Br)O 34a_100011999798_100000210206 [0,2,0,0,0,0|2,0,0]=4 23759 B12R1.127 CC(C)Nc1cc(ccc1Cl)Br 34a_100000750497_100000210206 [0,2,0,0,0,0|2,0,0]=4 23760 B12R1.127 CC(C)Nc1cc(ccc1Cl)Cl 34a_100000184485_100000210206 [0,2,0,0,0,0|2,0,0]=4 23761 B12R1.127 CC(C)Nc1cc(ccc1Cl)F 34a_100000751338_100000210206 [0,2,0,0,0,0|2,0,0]=4 23762 B12R1.127 CC(C)Nc1cc(ccc1Cl)I 34a_200000761891_100000210206 [0,2,0,0,0,0|2,0,0]=4 23763 B12R1.127 CC(C)Nc1cc(ccc1Cl)O 34a_100011934297_100000210206 [0,2,0,0,0,0|2,0,0]=4 23764 B12R1.127 CC(C)Nc1cc(ccc1F)Br 34a_100000740924_100000210206 [0,2,0,0,0,0|2,0,0]=4 23765 B12R1.127 CC(C)Nc1cc(ccc1F)Cl 34a_100000212115_100000210206 [0,2,0,0,0,0|2,0,0]=4 23766 B12R1.127 CC(C)Nc1cc(ccc1F)F 34a_100000210742_100000210206 [0,2,0,0,0,0|2,0,0]=4 23767 B12R1.127 CC(C)Nc1cc(ccc1F)I 34a_100011464823_100000210206 [0,2,0,0,0,0|2,0,0]=4 23768 B12R1.127 CC(C)Nc1cc(ccc1F)O 34a_100012017239_100000210206 [0,2,0,0,0,0|2,0,0]=4 23769 B12R1.127 CC(C)Nc1cc(ccc1I)Br 34a_100000743836_100000210206 [0,2,0,0,0,0|2,0,0]=4 23770 B12R1.127 CC(C)Nc1cc(ccc1I)Cl 34a_100000761886_100000210206 [0,2,0,0,0,0|2,0,0]=4 23771 B12R1.127 CC(C)Nc1cc(ccc1I)F 34a_100011218093_100000210206 [0,2,0,0,0,0|2,0,0]=4 23772 B12R1.127 CC(C)Nc1cc(ccc1O)Br 34a_100000752626_100000210206 [0,2,0,0,0,0|1,0,0]=3 23773 B12R1.127 CC(C)Nc1cc(ccc1O)Cl 34a_100000210500_100000210206 [0,2,0,0,0,0|1,0,0]=3 23774 B12R1.127 CC(C)Nc1cc(ccc1O)F 34a_100000759472_100000210206 [0,2,0,0,0,0|1,0,0]=3 23775 B12R1.127 CC(C)Oc1cc(ccc1Br)Br 34a_100011220040_100000210206 [0,2,0,0,0,0|2,0,0]=4 23776 B12R1.127 CC(C)Oc1cc(ccc1Br)Br 7a_100011220040_100000210206 [0,2,0,0,0,0|2,0,0]=4 23777 B12R1.127 CC(C)Oc1cc(ccc1Br)Cl 34a_100012339455_100000210206 [0,2,0,0,0,0|2,0,0]=4 23778 B12R1.127 CC(C)Oc1cc(ccc1Br)Cl 7a_100012339455_100000210206 [0,2,0,0,0,0|2,0,0]=4 23779 B12R1.127 CC(C)Oc1cc(ccc1Br)F 34a_100000690578_100000210206 [0,2,0,0,0,0|2,0,0]=4 23780 B12R1.127 CC(C)Oc1cc(ccc1Br)F 7a_100000690578_100000210206 [0,2,0,0,0,0|2,0,0]=4 23781 B12R1.127 CC(C)Oc1cc(ccc1Br)I 34a_100012356990_100000210206 [0,2,0,0,0,0|2,0,0]=4 23782 B12R1.127 CC(C)Oc1cc(ccc1Br)I 7a_100012356990_100000210206 [0,2,0,0,0,0|2,0,0]=4 23783 B12R1.127 CC(C)Oc1cc(ccc1Cl)Br 34a_100000738945_100000210206 [0,2,0,0,0,0|2,0,0]=4 23784 B12R1.127 CC(C)Oc1cc(ccc1Cl)Br 7a_100000738945_100000210206 [0,2,0,0,0,0|2,0,0]=4 23785 B12R1.127 CC(C)Oc1cc(ccc1Cl)Cl 34a_100000211422_100000210206 [0,2,0,0,0,0|2,0,0]=4 23786 B12R1.127 CC(C)Oc1cc(ccc1Cl)Cl 7a_100000211422_100000210206 [0,2,0,0,0,0|2,0,0]=4 23787 B12R1.127 CC(C)Oc1cc(ccc1Cl)F 34a_100000692107_100000210206 [0,2,0,0,0,0|2,0,0]=4 23788 B12R1.127 CC(C)Oc1cc(ccc1Cl)F 7a_100000692107_100000210206 [0,2,0,0,0,0|2,0,0]=4 23789 B12R1.127 CC(C)Oc1cc(ccc1Cl)I 34a_100011356854_100000210206 [0,2,0,0,0,0|2,0,0]=4 23790 B12R1.127 CC(C)Oc1cc(ccc1Cl)I 7a_100011356854_100000210206 [0,2,0,0,0,0|2,0,0]=4 23791 B12R1.127 CC(C)Oc1cc(ccc1Cl)N 34a_100011934209_100000210206 [0,2,0,0,0,0|2,0,0]=4 23792 B12R1.127 CC(C)Oc1cc(ccc1F)Br 34a_100000686035_100000210206 [0,2,0,0,0,0|2,0,0]=4 23793 B12R1.127 CC(C)Oc1cc(ccc1F)Br 7a_100000686035_100000210206 [0,2,0,0,0,0|2,0,0]=4 23794 B12R1.127 CC(C)Oc1cc(ccc1F)Cl 34a_100000757397_100000210206 [0,2,0,0,0,0|2,0,0]=4 23795 B12R1.127 CC(C)Oc1cc(ccc1F)Cl 7a_100000757397_100000210206 [0,2,0,0,0,0|2,0,0]=4 23796 B12R1.127 CC(C)Oc1cc(ccc1F)F 34a_100000752141_100000210206 [0,2,0,0,0,0|2,0,0]=4 23797 B12R1.127 CC(C)Oc1cc(ccc1F)F 7a_100000752141_100000210206 [0,2,0,0,0,0|2,0,0]=4 23798 B12R1.127 CC(C)Oc1cc(ccc1F)I 34a_100009958187_100000210206 [0,2,0,0,0,0|2,0,0]=4 23799 B12R1.127 CC(C)Oc1cc(ccc1F)I 7a_100009958187_100000210206 [0,2,0,0,0,0|2,0,0]=4 23800 B12R1.127 CC(C)Oc1cc(ccc1F)N 34a_100012017398_100000210206 [0,2,0,0,0,0|2,0,0]=4 23801 B12R1.127 CC(C)Oc1cc(ccc1F)N 7a_100012017398_100000210206 [0,2,0,0,0,0|2,0,0]=4 23802 B12R1.127 CC(C)Oc1cc(ccc1F)O 271570a_203496583355_200012350295 [0,2,0,0,0,0|2,0,0]=4 23803 B12R1.127 CC(C)Oc1cc(ccc1I)Br 34a_100012344904_100000210206 [0,2,0,0,0,0|2,0,0]=4 23804 B12R1.127 CC(C)Oc1cc(ccc1I)Br 7a_100012344904_100000210206 [0,2,0,0,0,0|2,0,0]=4 23805 B12R1.127 CC(C)Oc1cc(ccc1I)Cl 34a_100000050036_100000210206 [0,2,0,0,0,0|2,0,0]=4 23806 B12R1.127 CC(C)Oc1cc(ccc1I)Cl 7a_100000050036_100000210206 [0,2,0,0,0,0|2,0,0]=4 23807 B12R1.127 CC(C)Oc1cc(ccc1I)F 34a_100010084537_100000210206 [0,2,0,0,0,0|2,0,0]=4 23808 B12R1.127 CC(C)Oc1cc(ccc1I)F 7a_100010084537_100000210206 [0,2,0,0,0,0|2,0,0]=4 23809 B12R1.127 CC(C)Oc1cc(ccc1N)Br 34a_100000739049_100000210206 [0,2,0,0,0,0|2,0,0]=4 23810 B12R1.127 CC(C)Oc1cc(ccc1N)Br 7a_100000739049_100000210206 [0,2,0,0,0,0|2,0,0]=4 23811 B12R1.127 CC(C)Oc1cc(ccc1N)Cl 34a_100000185728_100000210206 [0,2,0,0,0,0|2,0,0]=4 23812 B12R1.127 CC(C)Oc1cc(ccc1N)Cl 7a_100000185728_100000210206 [0,2,0,0,0,0|2,0,0]=4 23813 B12R1.127 CC(C)Oc1cc(ccc1N)F 34a_100000753323_100000210206 [0,2,0,0,0,0|2,0,0]=4 23814 B12R1.127 CC(C)Oc1cc(ccc1N)F 7a_100000753323_100000210206 [0,2,0,0,0,0|2,0,0]=4 23815 B12R1.127 CC(C)Oc1cc(ccc1N)I 34a_100000057187_100000210206 [0,2,0,0,0,0|2,0,0]=4 23816 B12R1.127 CC(C)Oc1cc(ccc1N)I 7a_100000057187_100000210206 [0,2,0,0,0,0|2,0,0]=4 23817 B12R1.127 CC(C)Oc1cc(ccc1N)N 34a_100025717382_100000210206 [0,2,0,0,0,0|2,0,0]=4 23818 B12R1.127 CC(C)Oc1cc(ccc1O)F 271570a_203496583355_200012359391 [0,2,0,0,0,0|1,0,0]=3 23819 B12R1.127 CC(C)Sc1cc(ccc1Br)Br 62a_100000210206_100011483371 [0,2,0,0,0,0|2,0,0]=4 23820 B12R1.127 CC(C)Sc1cc(ccc1Br)Br 62a_100011483371_100000210206 [0,2,0,0,0,0|2,0,0]=4 23821 B12R1.127 CC(C)Sc1cc(ccc1Br)Cl 62a_100000210206_100012339723 [0,2,0,0,0,0|2,0,0]=4 23822 B12R1.127 CC(C)Sc1cc(ccc1Br)Cl 62a_100012339723_100000210206 [0,2,0,0,0,0|2,0,0]=4 23823 B12R1.127 CC(C)Sc1cc(ccc1Br)F 62a_100000210206_100011217576 [0,2,0,0,0,0|2,0,0]=4 23824 B12R1.127 CC(C)Sc1cc(ccc1Br)F 62a_100011217576_100000210206 [0,2,0,0,0,0|2,0,0]=4 23825 B12R1.127 CC(C)Sc1cc(ccc1Br)N 62a_100000210206_100000750459 [0,2,0,0,0,0|2,0,0]=4 23826 B12R1.127 CC(C)Sc1cc(ccc1Br)N 62a_100000750459_100000210206 [0,2,0,0,0,0|2,0,0]=4 23827 B12R1.127 CC(C)Sc1cc(ccc1Br)O 62a_100000210206_100012339312 [0,2,0,0,0,0|2,0,0]=4 23828 B12R1.127 CC(C)Sc1cc(ccc1Br)O 62a_100012339312_100000210206 [0,2,0,0,0,0|2,0,0]=4 23829 B12R1.127 CC(C)Sc1cc(ccc1Cl)Br 62a_100000210206_100011772130 [0,2,0,0,0,0|2,0,0]=4 23830 B12R1.127 CC(C)Sc1cc(ccc1Cl)Br 62a_100011772130_100000210206 [0,2,0,0,0,0|2,0,0]=4 23831 B12R1.127 CC(C)Sc1cc(ccc1Cl)Cl 62a_100000210206_100000707729 [0,2,0,0,0,0|2,0,0]=4 23832 B12R1.127 CC(C)Sc1cc(ccc1Cl)Cl 62a_100000707729_100000210206 [0,2,0,0,0,0|2,0,0]=4 23833 B12R1.127 CC(C)Sc1cc(ccc1Cl)F 62a_100000210206_100011217299 [0,2,0,0,0,0|2,0,0]=4 23834 B12R1.127 CC(C)Sc1cc(ccc1Cl)F 62a_100011217299_100000210206 [0,2,0,0,0,0|2,0,0]=4 23835 B12R1.127 CC(C)Sc1cc(ccc1Cl)N 62a_100000210206_100012360549 [0,2,0,0,0,0|2,0,0]=4 23836 B12R1.127 CC(C)Sc1cc(ccc1Cl)N 62a_100012360549_100000210206 [0,2,0,0,0,0|2,0,0]=4 23837 B12R1.127 CC(C)Sc1cc(ccc1Cl)O 62a_100000049588_100000210206 [0,2,0,0,0,0|2,0,0]=4 23838 B12R1.127 CC(C)Sc1cc(ccc1Cl)O 62a_100000210206_100000049588 [0,2,0,0,0,0|2,0,0]=4 23839 B12R1.127 CC(C)Sc1cc(ccc1F)Br 62a_100000210206_100011217312 [0,2,0,0,0,0|2,0,0]=4 23840 B12R1.127 CC(C)Sc1cc(ccc1F)Br 62a_100011217312_100000210206 [0,2,0,0,0,0|2,0,0]=4 23841 B12R1.127 CC(C)Sc1cc(ccc1F)Cl 62a_100000210206_100011218116 [0,2,0,0,0,0|2,0,0]=4 23842 B12R1.127 CC(C)Sc1cc(ccc1F)Cl 62a_100011218116_100000210206 [0,2,0,0,0,0|2,0,0]=4 23843 B12R1.127 CC(C)Sc1cc(ccc1F)F 62a_100000210206_100011219198 [0,2,0,0,0,0|2,0,0]=4 23844 B12R1.127 CC(C)Sc1cc(ccc1F)F 62a_100011219198_100000210206 [0,2,0,0,0,0|2,0,0]=4 23845 B12R1.127 CC(C)Sc1cc(ccc1F)N 62a_100000210206_100000760356 [0,2,0,0,0,0|2,0,0]=4 23846 B12R1.127 CC(C)Sc1cc(ccc1F)N 62a_100000760356_100000210206 [0,2,0,0,0,0|2,0,0]=4 23847 B12R1.127 CC(C)Sc1cc(ccc1F)O 62a_100000210206_100000693481 [0,2,0,0,0,0|2,0,0]=4 23848 B12R1.127 CC(C)Sc1cc(ccc1F)O 62a_100000693481_100000210206 [0,2,0,0,0,0|2,0,0]=4 23849 B12R1.127 CC(C)Sc1cc(ccc1N)Br 62a_100000187925_100000210206 [0,2,0,0,0,0|2,0,0]=4 23850 B12R1.127 CC(C)Sc1cc(ccc1N)Br 62a_100000210206_100000187925 [0,2,0,0,0,0|2,0,0]=4 23851 B12R1.127 CC(C)Sc1cc(ccc1N)Cl 62a_100000210206_100000761889 [0,2,0,0,0,0|2,0,0]=4 23852 B12R1.127 CC(C)Sc1cc(ccc1N)Cl 62a_100000761889_100000210206 [0,2,0,0,0,0|2,0,0]=4 23853 B12R1.127 CC(C)Sc1cc(ccc1N)F 62a_100000210206_100000760547 [0,2,0,0,0,0|2,0,0]=4 23854 B12R1.127 CC(C)Sc1cc(ccc1N)F 62a_100000760547_100000210206 [0,2,0,0,0,0|2,0,0]=4 23855 B12R1.127 CC(C)Sc1cc(ccc1N)N 62a_100000210206_100011534242 [0,2,0,0,0,0|2,0,0]=4 23856 B12R1.127 CC(C)Sc1cc(ccc1N)N 62a_100011534242_100000210206 [0,2,0,0,0,0|2,0,0]=4 23857 B12R1.127 CC(C)Sc1cc(ccc1N)O 62a_100000210206_100012001276 [0,2,0,0,0,0|2,0,0]=4 23858 B12R1.127 CC(C)Sc1cc(ccc1N)O 62a_100012001276_100000210206 [0,2,0,0,0,0|2,0,0]=4 23859 B12R1.127 CC(C)Sc1cc(ccc1O)Br 62a_100000210206_100012355227 [0,2,0,0,0,0|1,0,0]=3 23860 B12R1.127 CC(C)Sc1cc(ccc1O)Br 62a_100012355227_100000210206 [0,2,0,0,0,0|1,0,0]=3 23861 B12R1.127 CC(C)Sc1cc(ccc1O)Cl 62a_100000210206_100011356953 [0,2,0,0,0,0|1,0,0]=3 23862 B12R1.127 CC(C)Sc1cc(ccc1O)Cl 62a_100011356953_100000210206 [0,2,0,0,0,0|1,0,0]=3 23863 B12R1.127 CC(C)Sc1cc(ccc1O)F 62a_100000210206_100000211999 [0,2,0,0,0,0|1,0,0]=3 23864 B12R1.127 CC(C)Sc1cc(ccc1O)F 62a_100000211999_100000210206 [0,2,0,0,0,0|1,0,0]=3 23865 B12R1.127 CC(C)Sc1cc(ccc1O)N 62a_100000210206_100011534360 [0,2,0,0,0,0|1,0,0]=3 23866 B12R1.127 CC(C)Sc1cc(ccc1O)N 62a_100011534360_100000210206 [0,2,0,0,0,0|1,0,0]=3 23867 B12R1.127 CC(C)Sc1cc(ccc1O)O 62a_100000210206_100009813629 [0,2,0,0,0,0|1,0,0]=3 23868 B12R1.127 CC(C)Sc1cc(cnc1O)Br 62a_100000210206_100010197142 [0,2,0,0,0,0|2,0,0]=4 23869 B12R1.127 CC(C)Sc1cc(cnc1O)Br 62a_100010197142_100000210206 [0,2,0,0,0,0|2,0,0]=4 23870 B12R1.127 CC(C)Sc1cc(cnc1O)Cl 62a_100000210206_100010188700 [0,2,0,0,0,0|2,0,0]=4 23871 B12R1.127 CC(C)Sc1cc(cnc1O)Cl 62a_100010188700_100000210206 [0,2,0,0,0,0|2,0,0]=4 23872 B12R1.127 CC(C)Sc1cc(ncc1O)Cl 62a_100000210206_100000698892 [0,2,0,0,0,0|2,0,0]=4 23873 B12R1.127 CC(C)Sc1cc(ncc1O)Cl 62a_100000698892_100000210206 [0,2,0,0,0,0|2,0,0]=4 23874 B12R1.127 CC(C)Sc1nc(ccc1O)Br 62a_100000210206_100010253912 [0,2,0,0,0,0|2,0,0]=4 23875 B12R1.127 CC(C)Sc1nc(ccc1O)Br 62a_100010253912_100000210206 [0,2,0,0,0,0|2,0,0]=4 23876 B12R1.127 CC(C)Sc1nc(ccc1O)Cl 62a_100000210206_100000696390 [0,2,0,0,0,0|2,0,0]=4 23877 B12R1.127 CC(C)Sc1nc(ccc1O)F 62a_100000210206_100010382442 [0,2,0,0,0,0|2,0,0]=4 23878 B12R1.127 CC(C)Sc1nc(ccc1O)F 62a_100010382442_100000210206 [0,2,0,0,0,0|2,0,0]=4 23879 B12R1.127 CN(C)Cc1cc(ccc1Br)Br 2230a_100102631434_100011982794 [0,2,0,0,0,0|2,0,0]=4 23880 B12R1.127 CN(C)Cc1cc(ccc1Br)Br 269982a_100102631434_100011982794 [0,2,0,0,0,0|2,0,0]=4 23881 B12R1.127 CN(C)Cc1cc(ccc1Br)Br 270004a_100102631434_100011266429 [0,2,0,0,0,0|2,0,0]=4 23882 B12R1.127 CN(C)Cc1cc(ccc1Br)Cl 2230a_100000711432_200000210301 [0,2,0,0,0,0|2,0,0]=4 23883 B12R1.127 CN(C)Cc1cc(ccc1Br)Cl 2230a_100102631434_100000733903 [0,2,0,0,0,0|2,0,0]=4 23884 B12R1.127 CN(C)Cc1cc(ccc1Br)Cl 269982a_100000711432_200000210301 [0,2,0,0,0,0|2,0,0]=4 23885 B12R1.127 CN(C)Cc1cc(ccc1Br)Cl 269982a_100102631434_100000733903 [0,2,0,0,0,0|2,0,0]=4 23886 B12R1.127 CN(C)Cc1cc(ccc1Br)Cl 270004a_100102631434_100000746314 [0,2,0,0,0,0|2,0,0]=4 23887 B12R1.127 CN(C)Cc1cc(ccc1Br)F 2230a_100102631434_100000736370 [0,2,0,0,0,0|2,0,0]=4 23888 B12R1.127 CN(C)Cc1cc(ccc1Br)F 269982a_100102631434_100000736370 [0,2,0,0,0,0|2,0,0]=4 23889 B12R1.127 CN(C)Cc1cc(ccc1Br)F 270004a_100102631434_100000766564 [0,2,0,0,0,0|2,0,0]=4 23890 B12R1.127 CN(C)Cc1cc(ccc1Br)I 2230a_100102631434_100012355412 [0,2,0,0,0,0|2,0,0]=4 23891 B12R1.127 CN(C)Cc1cc(ccc1Br)I 269982a_100102631434_100012355412 [0,2,0,0,0,0|2,0,0]=4 23892 B12R1.127 CN(C)Cc1cc(ccc1Cl)Br 2230a_100102631434_100000763347 [0,2,0,0,0,0|2,0,0]=4 23893 B12R1.127 CN(C)Cc1cc(ccc1Cl)Br 269982a_100102631434_100000763347 [0,2,0,0,0,0|2,0,0]=4 23894 B12R1.127 CN(C)Cc1cc(ccc1Cl)Br 270004a_100102631434_100000746309 [0,2,0,0,0,0|2,0,0]=4 23895 B12R1.127 CN(C)Cc1cc(ccc1Cl)Cl 2230a_100102631434_100000756322 [0,2,0,0,0,0|2,0,0]=4 23896 B12R1.127 CN(C)Cc1cc(ccc1Cl)Cl 2230a_106354212996_200000210301 [0,2,0,0,0,0|2,0,0]=4 23897 B12R1.127 CN(C)Cc1cc(ccc1Cl)Cl 269982a_100102631434_100000754809 [0,2,0,0,0,0|2,0,0]=4 23898 B12R1.127 CN(C)Cc1cc(ccc1Cl)Cl 269982a_106354212996_200000210301 [0,2,0,0,0,0|2,0,0]=4 23899 B12R1.127 CN(C)Cc1cc(ccc1Cl)Cl 270004a_100102631434_100000746308 [0,2,0,0,0,0|2,0,0]=4 23900 B12R1.127 CN(C)Cc1cc(ccc1Cl)Cl 34a_106354212996_200000210301 [0,2,0,0,0,0|2,0,0]=4 23901 B12R1.127 CN(C)Cc1cc(ccc1Cl)F 2230a_100102631434_100000709952 [0,2,0,0,0,0|2,0,0]=4 23902 B12R1.127 CN(C)Cc1cc(ccc1Cl)F 269982a_100102631434_100000709952 [0,2,0,0,0,0|2,0,0]=4 23903 B12R1.127 CN(C)Cc1cc(ccc1Cl)F 270004a_100102631434_100011218309 [0,2,0,0,0,0|2,0,0]=4 23904 B12R1.127 CN(C)Cc1cc(ccc1Cl)I 2230a_100102631434_100010188191 [0,2,0,0,0,0|2,0,0]=4 23905 B12R1.127 CN(C)Cc1cc(ccc1Cl)I 269982a_100102631434_100010188191 [0,2,0,0,0,0|2,0,0]=4 23906 B12R1.127 CN(C)Cc1cc(ccc1F)Br 2230a_100000748472_200000210301 [0,2,0,0,0,0|2,0,0]=4 23907 B12R1.127 CN(C)Cc1cc(ccc1F)Br 2230a_100102631434_100000736399 [0,2,0,0,0,0|2,0,0]=4 23908 B12R1.127 CN(C)Cc1cc(ccc1F)Br 269982a_100000748472_200000210301 [0,2,0,0,0,0|2,0,0]=4 23909 B12R1.127 CN(C)Cc1cc(ccc1F)Br 269982a_100102631434_100000736399 [0,2,0,0,0,0|2,0,0]=4 23910 B12R1.127 CN(C)Cc1cc(ccc1F)Br 270004a_100102631434_100000211465 [0,2,0,0,0,0|2,0,0]=4 23911 B12R1.127 CN(C)Cc1cc(ccc1F)Br 34a_100000748472_200000210301 [0,2,0,0,0,0|2,0,0]=4 23912 B12R1.127 CN(C)Cc1cc(ccc1F)Cl 2230a_100102631434_100000716957 [0,2,0,0,0,0|2,0,0]=4 23913 B12R1.127 CN(C)Cc1cc(ccc1F)Cl 269982a_100102631434_100000716957 [0,2,0,0,0,0|2,0,0]=4 23914 B12R1.127 CN(C)Cc1cc(ccc1F)Cl 270004a_100102631434_100000745245 [0,2,0,0,0,0|2,0,0]=4 23915 B12R1.127 CN(C)Cc1cc(ccc1F)F 2230a_100000724026_200000210301 [0,2,0,0,0,0|2,0,0]=4 23916 B12R1.127 CN(C)Cc1cc(ccc1F)F 2230a_100102631434_100000741279 [0,2,0,0,0,0|2,0,0]=4 23917 B12R1.127 CN(C)Cc1cc(ccc1F)F 269982a_100000724026_200000210301 [0,2,0,0,0,0|2,0,0]=4 23918 B12R1.127 CN(C)Cc1cc(ccc1F)F 269982a_100102631434_100000685659 [0,2,0,0,0,0|2,0,0]=4 23919 B12R1.127 CN(C)Cc1cc(ccc1F)F 270004a_100102631434_100000740046 [0,2,0,0,0,0|2,0,0]=4 23920 B12R1.127 CN(C)Cc1cc(ccc1F)F 34a_100000724026_200000210301 [0,2,0,0,0,0|2,0,0]=4 23921 B12R1.127 CN(C)Cc1cc(ccc1F)I 2230a_100102631434_200010149601 [0,2,0,0,0,0|2,0,0]=4 23922 B12R1.127 CN(C)Cc1cc(ccc1F)I 269982a_100102631434_200010149601 [0,2,0,0,0,0|2,0,0]=4 23923 B12R1.127 CN(C)Cc1cc(ccc1F)O 271570a_203496583355_100011597561 [0,2,0,0,0,0|2,0,0]=4 23924 B12R1.127 CN(C)Cc1cc(ccc1I)Br 2230a_100102631434_100012362523 [0,2,0,0,0,0|2,0,0]=4 23925 B12R1.127 CN(C)Cc1cc(ccc1I)Br 269982a_100102631434_100012362523 [0,2,0,0,0,0|2,0,0]=4 23926 B12R1.127 CN(C)Cc1cc(ccc1I)Br 270004a_100102631434_100010185651 [0,2,0,0,0,0|2,0,0]=4 23927 B12R1.127 CN(C)Cc1cc(ccc1I)Cl 2230a_100102631434_100012348826 [0,2,0,0,0,0|2,0,0]=4 23928 B12R1.127 CN(C)Cc1cc(ccc1I)Cl 269982a_100102631434_100012348826 [0,2,0,0,0,0|2,0,0]=4 23929 B12R1.127 CN(C)Cc1cc(ccc1I)Cl 270004a_100102631434_100010254386 [0,2,0,0,0,0|2,0,0]=4 23930 B12R1.127 CN(C)Cc1cc(ccc1I)F 2230a_100102631434_100010149606 [0,2,0,0,0,0|2,0,0]=4 23931 B12R1.127 CN(C)Cc1cc(ccc1I)F 269982a_100102631434_100010149606 [0,2,0,0,0,0|2,0,0]=4 23932 B12R1.127 CN(C)Cc1cc(ccc1I)F 270004a_100102631434_100010186294 [0,2,0,0,0,0|2,0,0]=4 23933 B12R1.127 CN(C)Cc1cc(ccc1O)Br 2230a_100011602694_200000210301 [0,2,0,0,0,0|1,0,0]=3 23934 B12R1.127 CN(C)Cc1cc(ccc1O)Br 269982a_100011602694_200000210301 [0,2,0,0,0,0|1,0,0]=3 23935 B12R1.127 CN(C)Cc1cc(ccc1O)Cl 2230a_100000712467_200000210301 [0,2,0,0,0,0|1,0,0]=3 23936 B12R1.127 CN(C)Cc1cc(ccc1O)Cl 269982a_100000712467_200000210301 [0,2,0,0,0,0|1,0,0]=3 23937 B12R1.127 CN(C)Cc1cc(ccc1O)F 2230a_114855342409_200000210301 [0,2,0,0,0,0|1,0,0]=3 23938 B12R1.127 CN(C)Cc1cc(ccc1O)F 269982a_100102631434_100010161318 [0,2,0,0,0,0|1,0,0]=3 23939 B12R1.127 CN(C)Cc1cc(ccc1O)F 269982a_114855342409_200000210301 [0,2,0,0,0,0|1,0,0]=3 23940 B12R1.127 CN(C)Cc1cc(ccc1O)F 34a_114855342409_200000210301 [0,2,0,0,0,0|1,0,0]=3 23941 B12R1.127 CN(C)Cc1cc(ccc1O)O 271570a_203496583355_100011934597 [0,2,0,0,0,0|1,0,0]=3 23942 B12R1.127 CN(C)Cc1cc(cnc1O)Br 270004a_100102631434_100010064889 [0,2,0,0,0,0|2,0,0]=4 23943 B12R1.127 CN([13CH3])Cc1cc(ccc1Br)Cl 2230a_100000711432_200025704644 [0,2,0,0,0,0|2,0,0]=4 23944 B12R1.127 CN([13CH3])Cc1cc(ccc1Br)Cl 269982a_100000711432_200025704644 [0,2,0,0,0,0|2,0,0]=4 23945 B12R1.127 CN([13CH3])Cc1cc(ccc1Cl)Cl 2230a_106354212996_200025704644 [0,2,0,0,0,0|2,0,0]=4 23946 B12R1.127 CN([13CH3])Cc1cc(ccc1Cl)Cl 269982a_106354212996_200025704644 [0,2,0,0,0,0|2,0,0]=4 23947 B12R1.127 CN([13CH3])Cc1cc(ccc1Cl)Cl 34a_106354212996_200025704644 [0,2,0,0,0,0|2,0,0]=4 23948 B12R1.127 CN([13CH3])Cc1cc(ccc1F)Br 2230a_100000748472_200025704644 [0,2,0,0,0,0|2,0,0]=4 23949 B12R1.127 CN([13CH3])Cc1cc(ccc1F)Br 269982a_100000748472_200025704644 [0,2,0,0,0,0|2,0,0]=4 23950 B12R1.127 CN([13CH3])Cc1cc(ccc1F)Br 34a_100000748472_200025704644 [0,2,0,0,0,0|2,0,0]=4 23951 B12R1.127 CN([13CH3])Cc1cc(ccc1F)F 2230a_100000724026_200025704644 [0,2,0,0,0,0|2,0,0]=4 23952 B12R1.127 CN([13CH3])Cc1cc(ccc1F)F 269982a_100000724026_200025704644 [0,2,0,0,0,0|2,0,0]=4 23953 B12R1.127 CN([13CH3])Cc1cc(ccc1F)F 34a_100000724026_200025704644 [0,2,0,0,0,0|2,0,0]=4 23954 B12R1.127 CN([13CH3])Cc1cc(ccc1O)Br 2230a_100011602694_200025704644 [0,2,0,0,0,0|1,0,0]=3 23955 B12R1.127 CN([13CH3])Cc1cc(ccc1O)Br 269982a_100011602694_200025704644 [0,2,0,0,0,0|1,0,0]=3 23956 B12R1.127 CN([13CH3])Cc1cc(ccc1O)Cl 2230a_100000712467_200025704644 [0,2,0,0,0,0|1,0,0]=3 23957 B12R1.127 CN([13CH3])Cc1cc(ccc1O)Cl 269982a_100000712467_200025704644 [0,2,0,0,0,0|1,0,0]=3 23958 B12R1.127 CN([13CH3])Cc1cc(ccc1O)F 2230a_114855342409_200025704644 [0,2,0,0,0,0|1,0,0]=3 23959 B12R1.127 CN([13CH3])Cc1cc(ccc1O)F 269982a_114855342409_200025704644 [0,2,0,0,0,0|1,0,0]=3 23960 B12R1.127 CN([13CH3])Cc1cc(ccc1O)F 34a_114855342409_200025704644 [0,2,0,0,0,0|1,0,0]=3 23961 B12R1.127 Cc1cc(c(cn1)O)SC(C)C 62a_100000210206_100009843476 [0,2,0,0,0,0|2,0,0]=4 23962 B12R1.127 Cc1cc(c(cn1)O)SC(C)C 62a_100009843476_100000210206 [0,2,0,0,0,0|2,0,0]=4 23963 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])Br 1458a_100010004923_200025704644 [0,2,0,0,0,0|1,0,1]=4 23964 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])C 1458a_100000749331_200025704644 [0,2,0,0,0,0|1,0,1]=4 23965 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])F 1458a_100011667363_200025704644 [0,2,0,0,0,0|1,0,1]=4 23966 B12R1.127 Cc1ccc(c(c1)CN(C)C)Br 270004a_100102631434_100011551863 [0,2,0,0,0,0|2,0,0]=4 23967 B12R1.127 Cc1ccc(c(c1)CN(C)C)C 2230a_100102631434_100000184699 [0,2,0,0,0,0|2,0,0]=4 23968 B12R1.127 Cc1ccc(c(c1)CN(C)C)C 269982a_100102631434_100000184699 [0,2,0,0,0,0|2,0,0]=4 23969 B12R1.127 Cc1ccc(c(c1)CN(C)C)C 270004a_100102631434_100000211343 [0,2,0,0,0,0|2,0,0]=4 23970 B12R1.127 Cc1ccc(c(c1)CN(C)C)Cl 2230a_100102631434_100009871730 [0,2,0,0,0,0|2,0,0]=4 23971 B12R1.127 Cc1ccc(c(c1)CN(C)C)Cl 269982a_100102631434_100009871730 [0,2,0,0,0,0|2,0,0]=4 23972 B12R1.127 Cc1ccc(c(c1)CN(C)C)Cl 270004a_100102631434_100011551332 [0,2,0,0,0,0|2,0,0]=4 23973 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 2230a_100102631434_100011260760 [0,2,0,0,0,0|2,0,0]=4 23974 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 2230a_102515433075_200000210301 [0,2,0,0,0,0|2,0,0]=4 23975 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 269982a_100102631434_100011260760 [0,2,0,0,0,0|2,0,0]=4 23976 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 269982a_102515433075_200000210301 [0,2,0,0,0,0|2,0,0]=4 23977 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 270004a_100102631434_100000756917 [0,2,0,0,0,0|2,0,0]=4 23978 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 34a_102515433075_200000210301 [0,2,0,0,0,0|2,0,0]=4 23979 B12R1.127 Cc1ccc(c(c1)CN(C)C)I 270004a_100102631434_100010150105 [0,2,0,0,0,0|2,0,0]=4 23980 B12R1.127 Cc1ccc(c(c1)CN(C)[13CH3])F 2230a_102515433075_200025704644 [0,2,0,0,0,0|2,0,0]=4 23981 B12R1.127 Cc1ccc(c(c1)CN(C)[13CH3])F 269982a_102515433075_200025704644 [0,2,0,0,0,0|2,0,0]=4 23982 B12R1.127 Cc1ccc(c(c1)CN(C)[13CH3])F 34a_102515433075_200025704644 [0,2,0,0,0,0|2,0,0]=4 23983 B12R1.127 Cc1ccc(c(c1)NC(C)C)Br 34a_100000745044_100000210206 [0,2,0,0,0,0|2,0,0]=4 23984 B12R1.127 Cc1ccc(c(c1)NC(C)C)C 2230a_100000185781_100000210206 [0,2,0,0,0,0|2,0,0]=4 23985 B12R1.127 Cc1ccc(c(c1)NC(C)C)C 34a_100000185781_100000210206 [0,2,0,0,0,0|2,0,0]=4 23986 B12R1.127 Cc1ccc(c(c1)NC(C)C)C 7a_100000185781_100000210206 [0,2,0,0,0,0|2,0,0]=4 23987 B12R1.127 Cc1ccc(c(c1)NC(C)C)Cl 34a_100011215360_100000210206 [0,2,0,0,0,0|2,0,0]=4 23988 B12R1.127 Cc1ccc(c(c1)NC(C)C)F 34a_100000211285_100000210206 [0,2,0,0,0,0|2,0,0]=4 23989 B12R1.127 Cc1ccc(c(c1)NC(C)C)I 34a_100011216686_100000210206 [0,2,0,0,0,0|2,0,0]=4 23990 B12R1.127 Cc1ccc(c(c1)NC(C)C)O 34a_100011215204_100000210206 [0,2,0,0,0,0|1,0,0]=3 23991 B12R1.127 Cc1ccc(c(c1)OC(C)C)Br 34a_100012002257_100000210206 [0,2,0,0,0,0|2,0,0]=4 23992 B12R1.127 Cc1ccc(c(c1)OC(C)C)Br 7a_100012002257_100000210206 [0,2,0,0,0,0|2,0,0]=4 23993 B12R1.127 Cc1ccc(c(c1)OC(C)C)C 34a_100000210931_100000210206 [0,2,0,0,0,0|2,0,0]=4 23994 B12R1.127 Cc1ccc(c(c1)OC(C)C)C 7a_100000210931_100000210206 [0,2,0,0,0,0|2,0,0]=4 23995 B12R1.127 Cc1ccc(c(c1)OC(C)C)Cl 34a_100000211493_100000210206 [0,2,0,0,0,0|2,0,0]=4 23996 B12R1.127 Cc1ccc(c(c1)OC(C)C)Cl 7a_100000211493_100000210206 [0,2,0,0,0,0|2,0,0]=4 23997 B12R1.127 Cc1ccc(c(c1)OC(C)C)F 34a_100000759540_100000210206 [0,2,0,0,0,0|2,0,0]=4 23998 B12R1.127 Cc1ccc(c(c1)OC(C)C)F 7a_100000759540_100000210206 [0,2,0,0,0,0|2,0,0]=4 23999 B12R1.127 Cc1ccc(c(c1)OC(C)C)N 34a_100000211527_100000210206 [0,2,0,0,0,0|2,0,0]=4 24000 B12R1.127 Cc1ccc(c(c1)OC(C)C)N 7a_100000211527_100000210206 [0,2,0,0,0,0|2,0,0]=4 24001 B12R1.127 Cc1ccc(c(c1)SC(C)C)Br 62a_100000210206_100012353751 [0,2,0,0,0,0|2,0,0]=4 24002 B12R1.127 Cc1ccc(c(c1)SC(C)C)Br 62a_100012353751_100000210206 [0,2,0,0,0,0|2,0,0]=4 24003 B12R1.127 Cc1ccc(c(c1)SC(C)C)C 62a_100000210206_100000210833 [0,2,0,0,0,0|2,0,0]=4 24004 B12R1.127 Cc1ccc(c(c1)SC(C)C)C 62a_100000210833_100000210206 [0,2,0,0,0,0|2,0,0]=4 24005 B12R1.127 Cc1ccc(c(c1)SC(C)C)Cl 62a_100000210206_100012356289 [0,2,0,0,0,0|2,0,0]=4 24006 B12R1.127 Cc1ccc(c(c1)SC(C)C)Cl 62a_100012356289_100000210206 [0,2,0,0,0,0|2,0,0]=4 24007 B12R1.127 Cc1ccc(c(c1)SC(C)C)F 62a_100000210206_100000736223 [0,2,0,0,0,0|2,0,0]=4 24008 B12R1.127 Cc1ccc(c(c1)SC(C)C)F 62a_100000736223_100000210206 [0,2,0,0,0,0|2,0,0]=4 24009 B12R1.127 Cc1ccc(c(c1)SC(C)C)N 62a_100000210206_100011356834 [0,2,0,0,0,0|2,0,0]=4 24010 B12R1.127 Cc1ccc(c(c1)SC(C)C)N 62a_100011356834_100000210206 [0,2,0,0,0,0|2,0,0]=4 24011 B12R1.127 Cc1ccc(c(c1)SC(C)C)O 62a_100000210206_100000765521 [0,2,0,0,0,0|1,0,0]=3 24012 B12R1.127 Cc1ccc(c(c1)SC(C)C)O 62a_100000765521_100000210206 [0,2,0,0,0,0|1,0,0]=3 24013 B12R1.127 Cc1ccc(c(n1)CN(C)C)O 2230a_100102631434_100020630696 [0,2,0,0,0,0|2,0,0]=4 24014 B12R1.127 Cc1ccc(c(n1)CN(C)C)O 269982a_100102631434_100020630696 [0,2,0,0,0,0|2,0,0]=4 24015 B12R1.127 Cc1ccc(c(n1)SC(C)C)O 62a_100000210206_100000702858 [0,2,0,0,0,0|2,0,0]=4 24016 B12R1.127 Cc1ccc(c(n1)SC(C)C)O 62a_100000702858_100000210206 [0,2,0,0,0,0|2,0,0]=4 24017 B12R1.127 Cc1ccc(cc1CC(=O)[13CH3])Br 1458a_100010244045_200025704644 [0,2,0,0,0,0|1,0,1]=4 24018 B12R1.127 Cc1ccc(cc1CC(=O)[13CH3])F 1458a_100011219217_200025704644 [0,2,0,0,0,0|1,0,1]=4 24019 B12R1.127 Cc1ccc(cc1CN(C)C)Br 2230a_106744473289_200000210301 [0,2,0,0,0,0|2,0,0]=4 24020 B12R1.127 Cc1ccc(cc1CN(C)C)Br 269982a_106744473289_200000210301 [0,2,0,0,0,0|2,0,0]=4 24021 B12R1.127 Cc1ccc(cc1CN(C)C)Br 270004a_100102631434_100011361606 [0,2,0,0,0,0|2,0,0]=4 24022 B12R1.127 Cc1ccc(cc1CN(C)C)Cl 2230a_100102631434_100012186985 [0,2,0,0,0,0|2,0,0]=4 24023 B12R1.127 Cc1ccc(cc1CN(C)C)Cl 269982a_100102631434_100012186985 [0,2,0,0,0,0|2,0,0]=4 24024 B12R1.127 Cc1ccc(cc1CN(C)C)Cl 270004a_100102631434_100011551331 [0,2,0,0,0,0|2,0,0]=4 24025 B12R1.127 Cc1ccc(cc1CN(C)C)F 2230a_100102631434_100000709795 [0,2,0,0,0,0|2,0,0]=4 24026 B12R1.127 Cc1ccc(cc1CN(C)C)F 269982a_100102631434_100000709795 [0,2,0,0,0,0|2,0,0]=4 24027 B12R1.127 Cc1ccc(cc1CN(C)C)F 270004a_100102631434_100000697687 [0,2,0,0,0,0|2,0,0]=4 24028 B12R1.127 Cc1ccc(cc1CN(C)[13CH3])Br 2230a_106744473289_200025704644 [0,2,0,0,0,0|2,0,0]=4 24029 B12R1.127 Cc1ccc(cc1CN(C)[13CH3])Br 269982a_106744473289_200025704644 [0,2,0,0,0,0|2,0,0]=4 24030 B12R1.127 Cc1ccc(cc1NC(C)C)Br 34a_100000741167_100000210206 [0,2,0,0,0,0|2,0,0]=4 24031 B12R1.127 Cc1ccc(cc1NC(C)C)Br 7a_100000741167_100000210206 [0,2,0,0,0,0|2,0,0]=4 24032 B12R1.127 Cc1ccc(cc1NC(C)C)Cl 34a_100000211374_100000210206 [0,2,0,0,0,0|2,0,0]=4 24033 B12R1.127 Cc1ccc(cc1NC(C)C)Cl 7a_100000211374_100000210206 [0,2,0,0,0,0|2,0,0]=4 24034 B12R1.127 Cc1ccc(cc1NC(C)C)F 34a_100000211107_100000210206 [0,2,0,0,0,0|2,0,0]=4 24035 B12R1.127 Cc1ccc(cc1NC(C)C)F 7a_100000211107_100000210206 [0,2,0,0,0,0|2,0,0]=4 24036 B12R1.127 Cc1ccc(cc1NC(C)C)I 7a_100000761890_100000210206 [0,2,0,0,0,0|2,0,0]=4 24037 B12R1.127 Cc1ccc(cc1NC(C)C)O 271570a_203496583355_200000714908 [0,2,0,0,0,0|2,0,0]=4 24038 B12R1.127 Cc1ccc(cc1NC(C)C)O 34a_100011216113_100000210206 [0,2,0,0,0,0|2,0,0]=4 24039 B12R1.127 Cc1ccc(cc1OC(C)C)Br 34a_100000685420_100000210206 [0,2,0,0,0,0|2,0,0]=4 24040 B12R1.127 Cc1ccc(cc1OC(C)C)Br 7a_100000685420_100000210206 [0,2,0,0,0,0|2,0,0]=4 24041 B12R1.127 Cc1ccc(cc1OC(C)C)Cl 34a_100000756515_100000210206 [0,2,0,0,0,0|2,0,0]=4 24042 B12R1.127 Cc1ccc(cc1OC(C)C)Cl 7a_100000756515_100000210206 [0,2,0,0,0,0|2,0,0]=4 24043 B12R1.127 Cc1ccc(cc1OC(C)C)F 34a_100000690566_100000210206 [0,2,0,0,0,0|2,0,0]=4 24044 B12R1.127 Cc1ccc(cc1OC(C)C)F 7a_100000690566_100000210206 [0,2,0,0,0,0|2,0,0]=4 24045 B12R1.127 Cc1ccc(cc1OC(C)C)I 7a_100000766334_100000210206 [0,2,0,0,0,0|2,0,0]=4 24046 B12R1.127 Cc1ccc(cc1OC(C)C)N 34a_100000759471_100000210206 [0,2,0,0,0,0|2,0,0]=4 24047 B12R1.127 Cc1ccc(cc1OC(C)C)N 7a_100000759471_100000210206 [0,2,0,0,0,0|2,0,0]=4 24048 B12R1.127 Cc1ccc(cc1OC(C)C)O 271570a_203496583355_200012359587 [0,2,0,0,0,0|2,0,0]=4 24049 B12R1.127 Cc1ccc(cc1SC(C)C)Br 62a_100000210206_100011344865 [0,2,0,0,0,0|2,0,0]=4 24050 B12R1.127 Cc1ccc(cc1SC(C)C)Br 62a_100011344865_100000210206 [0,2,0,0,0,0|2,0,0]=4 24051 B12R1.127 Cc1ccc(cc1SC(C)C)Cl 62a_100000210206_100011263213 [0,2,0,0,0,0|2,0,0]=4 24052 B12R1.127 Cc1ccc(cc1SC(C)C)Cl 62a_100011263213_100000210206 [0,2,0,0,0,0|2,0,0]=4 24053 B12R1.127 Cc1ccc(cc1SC(C)C)F 62a_100000210206_100011218078 [0,2,0,0,0,0|2,0,0]=4 24054 B12R1.127 Cc1ccc(cc1SC(C)C)F 62a_100011218078_100000210206 [0,2,0,0,0,0|2,0,0]=4 24055 B12R1.127 Cc1ccc(cc1SC(C)C)N 62a_100000210206_100000736455 [0,2,0,0,0,0|2,0,0]=4 24056 B12R1.127 Cc1ccc(cc1SC(C)C)N 62a_100000736455_100000210206 [0,2,0,0,0,0|2,0,0]=4 24057 B12R1.127 Cc1ccc(cc1SC(C)C)O 62a_100000210206_100011380479 [0,2,0,0,0,0|2,0,0]=4 24058 B12R1.127 Cc1ccc(cc1SC(C)C)O 62a_100011380479_100000210206 [0,2,0,0,0,0|2,0,0]=4 24059 B12R1.127 Cc1cnc(c(c1)SC(C)C)O 62a_100000210206_100000719714 [0,2,0,0,0,0|2,0,0]=4 24060 B12R1.127 Cc1cnc(c(c1)SC(C)C)O 62a_100000719714_100000210206 [0,2,0,0,0,0|2,0,0]=4 24061 B12R1.127 Oc1ccc(cc1OC(F)F)F 271570a_203496583355_100000727826 [0,2,0,0,0,0|2,0,0]=4 24062 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_200025704644 [0,2,0,0,0,0|1,0,1]=4 24063 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_200025704644 [0,2,0,0,0,0|1,0,1]=4 24064 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)F 1458a_100000690878_200025704644 [0,2,0,0,0,0|1,0,1]=4 24065 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_200025704644 [0,2,0,0,0,0|1,0,1]=4 24066 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_200025704644 [0,2,0,0,0,0|1,0,1]=4 24067 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_200025704644 [0,2,0,0,0,0|1,0,1]=4 24068 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)Br 1458a_100000690877_200025704644 [0,2,0,0,0,0|1,0,1]=4 24069 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_200025704644 [0,2,0,0,0,0|1,0,1]=4 24070 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)F 1458a_100000762760_200025704644 [0,2,0,0,0,0|1,0,1]=4 24071 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)Br 1458a_100010072483_200025704644 [0,2,0,0,0,0|0,0,1]=3 24072 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)O 1458a_100000038496_200025704644 [0,2,0,0,0,0|0,0,1]=3 24073 B12R1.151 CC(C)(C)Nc1ccccc1Br 34a_100000210017_100000210625 [0,2,0,0,0,0|2,0,0]=4 24074 B12R1.151 CC(C)(C)Nc1ccccc1Cl 34a_100000185783_100000210625 [0,2,0,0,0,0|2,0,0]=4 24075 B12R1.151 CC(C)(C)Nc1ccccc1F 34a_100000210422_100000210625 [0,2,0,0,0,0|2,0,0]=4 24076 B12R1.151 CC(C)(C)Nc1ccccc1I 34a_100000210053_100000210625 [0,2,0,0,0,0|2,0,0]=4 24077 B12R1.151 CC(C)(C)Nc1ccccc1O 34a_100000185747_100000210625 [0,2,0,0,0,0|1,0,0]=3 24078 B12R1.151 CC(C)(C)Oc1ccccc1Br 34a_100000181306_100000210625 [0,2,0,0,0,0|2,0,0]=4 24079 B12R1.151 CC(C)(C)Oc1ccccc1Cl 34a_100000210172_100000210625 [0,2,0,0,0,0|2,0,0]=4 24080 B12R1.151 CC(C)(C)Oc1ccccc1F 34a_100000210171_100000210625 [0,2,0,0,0,0|2,0,0]=4 24081 B12R1.151 CC(C)(C)Oc1ccccc1I 34a_100000739446_100000210625 [0,2,0,0,0,0|2,0,0]=4 24082 B12R1.151 CC(C)(C)Oc1ccccc1N 34a_100000185747_100000210625 [0,2,0,0,0,0|2,0,0]=4 24083 B12R1.151 CC(C)(C)Oc1ccccc1O 271570a_203496583355_100010078496 [0,2,0,0,0,0|1,0,0]=3 24084 B12R1.151 CC(C)(C)Oc1ncccc1O 271570a_203496583355_100011465193 [0,2,0,0,0,0|2,0,0]=4 24085 B12R1.151 CC(C)(C)Sc1ccccc1Br 62a_100000211941_100000695589 [0,2,0,0,0,0|2,0,0]=4 24086 B12R1.151 CC(C)(C)Sc1ccccc1Br 62a_100000695589_100000211941 [0,2,0,0,0,0|2,0,0]=4 24087 B12R1.151 CC(C)(C)Sc1ccccc1Cl 62a_100000211941_100000764095 [0,2,0,0,0,0|2,0,0]=4 24088 B12R1.151 CC(C)(C)Sc1ccccc1Cl 62a_100000764095_100000211941 [0,2,0,0,0,0|2,0,0]=4 24089 B12R1.151 CC(C)(C)Sc1ccccc1F 62a_100000211941_100011215700 [0,2,0,0,0,0|2,0,0]=4 24090 B12R1.151 CC(C)(C)Sc1ccccc1F 62a_100011215700_100000211941 [0,2,0,0,0,0|2,0,0]=4 24091 B12R1.151 CC(C)(C)Sc1ccccc1N 62a_100000210017_100000211941 [0,2,0,0,0,0|2,0,0]=4 24092 B12R1.151 CC(C)(C)Sc1ccccc1N 62a_100000211941_100000210017 [0,2,0,0,0,0|2,0,0]=4 24093 B12R1.151 CC(C)(C)Sc1ccccc1O 62a_100000211941_100000739446 [0,2,0,0,0,0|1,0,0]=3 24094 B12R1.151 CC(C)(C)Sc1ccccc1O 62a_100000739446_100000211941 [0,2,0,0,0,0|1,0,0]=3 24095 B12R1.151 CC(C)(C)Sc1cccnc1O 62a_100000211941_100000760158 [0,2,0,0,0,0|2,0,0]=4 24096 B12R1.151 CC(C)(C)Sc1cccnc1O 62a_100000760158_100000211941 [0,2,0,0,0,0|2,0,0]=4 24097 B12R1.151 CC(C)(C)Sc1ccncc1O 62a_100000211941_100009817591 [0,2,0,0,0,0|2,0,0]=4 24098 B12R1.151 CC(C)(C)Sc1ccncc1O 62a_100009817591_100000211941 [0,2,0,0,0,0|2,0,0]=4 24099 B12R1.151 CC(C)(C)Sc1ncccc1O 62a_100000034122_100000211941 [0,2,0,0,0,0|2,0,0]=4 24100 B12R1.151 CC(C)(C)Sc1ncccc1O 62a_100000211941_100000034122 [0,2,0,0,0,0|2,0,0]=4 24101 B12R1.151 CC(C)(N)Cc1ccccc1O 271570a_203496583355_100161000475 [0,2,0,0,0,0|0,0,0]=2 24102 B12R1.151 CS(=O)(=O)Cc1ccccc1O 271570a_203496583355_100009814642 [0,2,0,0,0,0|1,0,0]=3 24103 B12R1.151 CS(=O)(=O)Nc1ccccc1O 271570a_203496583355_100000165598 [0,2,0,0,0,0|2,0,0]=4 24104 B12R1.151 Cc1ccccc1NC(C)(C)C 34a_100015192222_100000210625 [0,2,0,0,0,0|2,0,0]=4 24105 B12R1.151 Cc1ccccc1OC(C)(C)C 34a_100000210338_100000210625 [0,2,0,0,0,0|2,0,0]=4 24106 B12R1.151 Cc1ccccc1SC(C)(C)C 62a_100000210755_100000211941 [0,2,0,0,0,0|2,0,0]=4 24107 B12R1.151 Cc1ccccc1SC(C)(C)C 62a_100000211941_100000210755 [0,2,0,0,0,0|2,0,0]=4 24108 B12R1.151 Oc1ccccc1CC(F)(F)F 271570a_203496583355_100010220485 [0,2,0,0,0,0|1,0,0]=3 24109 B12R1.151 Oc1ccccc1NC(F)(F)F 34a_100000185747_200103152311 [0,2,0,0,0,0|2,0,0]=4 24110 B12R1.151 Oc1ccccc1OC(F)(F)F 271570a_203496583355_100000216699 [0,2,0,0,0,0|2,0,0]=4 24111 B12R1.151 Oc1ccccc1SC(F)(F)F 62a_100000739446_200103152311 [0,2,0,0,0,0|2,0,0]=4 24112 B12R1.151 Oc1ccccc1SC(F)(F)F 62a_200000243211_100000739446 [0,2,0,0,0,0|2,0,0]=4 24113 B12R1.1009 CC(=Cc1c(cccc1Br)O)C 271570a_100102525489_100010187912 [0,2,0,0,0,0|0,0,2]=4 24114 B12R1.1009 CC(=Cc1c(cccc1Cl)O)C 271570a_100102525489_100000050174 [0,2,0,0,0,0|0,0,2]=4 24115 B12R1.1009 CC(=Cc1c(cccc1F)O)C 271570a_100102525489_100009820682 [0,2,0,0,0,0|0,0,2]=4 24116 B12R1.1009 CC(=Cc1c(cccc1O)C)C 271570a_100102525489_100000686692 [0,2,0,0,0,0|0,0,2]=4 24117 B12R1.1009 CC(=Cc1c(cccc1O)N)C 271570a_100102525489_100012183704 [0,2,0,0,0,0|0,0,2]=4 24118 B12R1.1009 CC(=Cc1c(cccc1O)O)C 271570a_100102525489_100010205330 [0,2,0,0,0,0|0,0,2]=4 24119 B12R1.1009 CC(=O)Cc1c(cccc1Br)Br 1458a_100010209379_200000210301 [0,2,0,0,0,0|1,0,1]=4 24120 B12R1.1009 CC(=O)Cc1c(cccc1Br)C 1458a_100000070787_100010146847 [0,2,0,0,0,0|1,0,1]=4 24121 B12R1.1009 CC(=O)Cc1c(cccc1Br)C 1458a_100010147022_200000210301 [0,2,0,0,0,0|1,0,1]=4 24122 B12R1.1009 CC(=O)Cc1c(cccc1Br)Cl 1458a_100000070787_100010138402 [0,2,0,0,0,0|1,0,1]=4 24123 B12R1.1009 CC(=O)Cc1c(cccc1Br)Cl 1458a_100013084675_200000210301 [0,2,0,0,0,0|1,0,1]=4 24124 B12R1.1009 CC(=O)Cc1c(cccc1Br)F 1458a_100000070787_100000696636 [0,2,0,0,0,0|1,0,1]=4 24125 B12R1.1009 CC(=O)Cc1c(cccc1Br)F 1458a_100010172741_200000210301 [0,2,0,0,0,0|1,0,1]=4 24126 B12R1.1009 CC(=O)Cc1c(cccc1C)C 1458a_100000070787_100000758300 [0,2,0,0,0,0|1,0,1]=4 24127 B12R1.1009 CC(=O)Cc1c(cccc1C)C 1458a_100000689862_200000210301 [0,2,0,0,0,0|1,0,1]=4 24128 B12R1.1009 CC(=O)Cc1c(cccc1Cl)Cl 1458a_100000070787_100000187851 [0,2,0,0,0,0|1,0,1]=4 24129 B12R1.1009 CC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_200000210301 [0,2,0,0,0,0|1,0,1]=4 24130 B12R1.1009 CC(=O)Cc1c(cccc1Cl)F 1458a_100000070787_100000187852 [0,2,0,0,0,0|1,0,1]=4 24131 B12R1.1009 CC(=O)Cc1c(cccc1Cl)F 1458a_100000185183_200000210301 [0,2,0,0,0,0|1,0,1]=4 24132 B12R1.1009 CC(=O)Cc1c(cccc1F)C 1458a_100000070787_100009814554 [0,2,0,0,0,0|1,0,1]=4 24133 B12R1.1009 CC(=O)Cc1c(cccc1F)F 1458a_100000070787_100000698325 [0,2,0,0,0,0|1,0,1]=4 24134 B12R1.1009 CC(=O)Cc1c(cccc1F)F 1458a_100000684726_200000210301 [0,2,0,0,0,0|1,0,1]=4 24135 B12R1.1009 CC(=O)Cc1c(cccc1I)Br 1458a_100000070787_100010146611 [0,2,0,0,0,0|1,0,1]=4 24136 B12R1.1009 CC(=O)Cc1c(cccc1I)C 1458a_100000070787_100010150146 [0,2,0,0,0,0|1,0,1]=4 24137 B12R1.1009 CC(=O)Cc1c(cccc1I)F 1458a_100000070787_100010149602 [0,2,0,0,0,0|1,0,1]=4 24138 B12R1.1009 CC(=O)Nc1c(cccc1Br)O 527a_100011934926_100103153847 [0,2,0,0,0,0|1,0,1]=4 24139 B12R1.1009 CC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000070787 [0,2,0,0,0,0|1,0,1]=4 24140 B12R1.1009 CC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100103153847 [0,2,0,0,0,0|1,0,1]=4 24141 B12R1.1009 CC(=O)Nc1c(cccc1F)O 22a_100020591140_100000070787 [0,2,0,0,0,0|1,0,1]=4 24142 B12R1.1009 CC(=O)Nc1c(cccc1F)O 527a_100020591140_100103153847 [0,2,0,0,0,0|1,0,1]=4 24143 B12R1.1009 CC(=O)Nc1c(cccc1I)O 22a_200000049512_100000070787 [0,2,0,0,0,0|1,0,1]=4 24144 B12R1.1009 CC(=O)Nc1c(cccc1I)O 527a_200000049512_100103153847 [0,2,0,0,0,0|1,0,1]=4 24145 B12R1.1009 CC(=O)Nc1c(cccc1O)C 22a_100000743429_100000070787 [0,2,0,0,0,0|1,0,1]=4 24146 B12R1.1009 CC(=O)Nc1c(cccc1O)C 527a_100000743429_100103153847 [0,2,0,0,0,0|1,0,1]=4 24147 B12R1.1009 CC(=O)Nc1c(cccc1O)O 22a_100011995820_100000070787 [0,2,0,0,0,0|1,0,1]=4 24148 B12R1.1009 CC(=O)Nc1c(cccc1O)O 527a_100011995820_100103153847 [0,2,0,0,0,0|1,0,1]=4 24149 B12R1.1009 CC(C)Nc1c(cccc1Br)Br 34a_100000690995_100000210206 [0,2,0,0,0,0|2,0,0]=4 24150 B12R1.1009 CC(C)Nc1c(cccc1Br)Cl 34a_100102946385_100000210206 [0,2,0,0,0,0|2,0,0]=4 24151 B12R1.1009 CC(C)Nc1c(cccc1Br)F 34a_100000684712_100000210206 [0,2,0,0,0,0|2,0,0]=4 24152 B12R1.1009 CC(C)Nc1c(cccc1Br)O 34a_100011934926_100000210206 [0,2,0,0,0,0|1,0,0]=3 24153 B12R1.1009 CC(C)Nc1c(cccc1Cl)Cl 34a_100000210028_100000210206 [0,2,0,0,0,0|2,0,0]=4 24154 B12R1.1009 CC(C)Nc1c(cccc1Cl)F 34a_100000760031_100000210206 [0,2,0,0,0,0|2,0,0]=4 24155 B12R1.1009 CC(C)Nc1c(cccc1Cl)O 34a_100012022510_100000210206 [0,2,0,0,0,0|1,0,0]=3 24156 B12R1.1009 CC(C)Nc1c(cccc1F)F 2230a_100000210704_100000210206 [0,2,0,0,0,0|2,0,0]=4 24157 B12R1.1009 CC(C)Nc1c(cccc1F)F 34a_100000210704_100000210206 [0,2,0,0,0,0|2,0,0]=4 24158 B12R1.1009 CC(C)Nc1c(cccc1F)O 34a_100020591140_100000210206 [0,2,0,0,0,0|1,0,0]=3 24159 B12R1.1009 CC(C)Nc1c(cccc1I)F 34a_100000042321_100000210206 [0,2,0,0,0,0|2,0,0]=4 24160 B12R1.1009 CC(C)Oc1c(cccc1Br)Br 34a_100000736428_100000210206 [0,2,0,0,0,0|2,0,0]=4 24161 B12R1.1009 CC(C)Oc1c(cccc1Br)Br 7a_100000736428_100000210206 [0,2,0,0,0,0|2,0,0]=4 24162 B12R1.1009 CC(C)Oc1c(cccc1Br)Cl 34a_100010214474_100000210206 [0,2,0,0,0,0|2,0,0]=4 24163 B12R1.1009 CC(C)Oc1c(cccc1Br)Cl 7a_100010214474_100000210206 [0,2,0,0,0,0|2,0,0]=4 24164 B12R1.1009 CC(C)Oc1c(cccc1Br)F 34a_100009813666_100000210206 [0,2,0,0,0,0|2,0,0]=4 24165 B12R1.1009 CC(C)Oc1c(cccc1Br)F 7a_100009813666_100000210206 [0,2,0,0,0,0|2,0,0]=4 24166 B12R1.1009 CC(C)Oc1c(cccc1Br)N 34a_100011934915_100000210206 [0,2,0,0,0,0|2,0,0]=4 24167 B12R1.1009 CC(C)Oc1c(cccc1Cl)Cl 34a_100000211709_100000210206 [0,2,0,0,0,0|2,0,0]=4 24168 B12R1.1009 CC(C)Oc1c(cccc1Cl)Cl 7a_100000211709_100000210206 [0,2,0,0,0,0|2,0,0]=4 24169 B12R1.1009 CC(C)Oc1c(cccc1Cl)F 34a_100000694953_100000210206 [0,2,0,0,0,0|2,0,0]=4 24170 B12R1.1009 CC(C)Oc1c(cccc1Cl)F 7a_100000694953_100000210206 [0,2,0,0,0,0|2,0,0]=4 24171 B12R1.1009 CC(C)Oc1c(cccc1Cl)N 34a_100000754742_100000210206 [0,2,0,0,0,0|2,0,0]=4 24172 B12R1.1009 CC(C)Oc1c(cccc1F)F 34a_100000230165_100000210206 [0,2,0,0,0,0|2,0,0]=4 24173 B12R1.1009 CC(C)Oc1c(cccc1F)F 7a_100000230165_100000210206 [0,2,0,0,0,0|2,0,0]=4 24174 B12R1.1009 CC(C)Oc1c(cccc1F)N 34a_100011934987_100000210206 [0,2,0,0,0,0|2,0,0]=4 24175 B12R1.1009 CC(C)Oc1c(cccc1F)O 271570a_203496583355_200010078528 [0,2,0,0,0,0|1,0,0]=3 24176 B12R1.1009 CC(C)Oc1c(cccc1I)Br 34a_100010084509_100000210206 [0,2,0,0,0,0|2,0,0]=4 24177 B12R1.1009 CC(C)Oc1c(cccc1I)Br 7a_100010084509_100000210206 [0,2,0,0,0,0|2,0,0]=4 24178 B12R1.1009 CC(C)Oc1c(cccc1I)Cl 34a_100010202889_100000210206 [0,2,0,0,0,0|2,0,0]=4 24179 B12R1.1009 CC(C)Oc1c(cccc1I)Cl 7a_100010202889_100000210206 [0,2,0,0,0,0|2,0,0]=4 24180 B12R1.1009 CC(C)Oc1c(cccc1I)F 34a_100010186298_100000210206 [0,2,0,0,0,0|2,0,0]=4 24181 B12R1.1009 CC(C)Oc1c(cccc1I)F 7a_100010186298_100000210206 [0,2,0,0,0,0|2,0,0]=4 24182 B12R1.1009 CC(C)Oc1c(cccc1I)N 34a_100010084371_100000210206 [0,2,0,0,0,0|2,0,0]=4 24183 B12R1.1009 CC(C)Oc1c(cccc1N)N 34a_200016994477_100000210206 [0,2,0,0,0,0|2,0,0]=4 24184 B12R1.1009 CC(C)Sc1c(cccc1Br)Br 62a_100000210206_100009994525 [0,2,0,0,0,0|2,0,0]=4 24185 B12R1.1009 CC(C)Sc1c(cccc1Br)Br 62a_100009994525_100000210206 [0,2,0,0,0,0|2,0,0]=4 24186 B12R1.1009 CC(C)Sc1c(cccc1Br)Cl 62a_100000210206_100010214488 [0,2,0,0,0,0|2,0,0]=4 24187 B12R1.1009 CC(C)Sc1c(cccc1Br)Cl 62a_100010214488_100000210206 [0,2,0,0,0,0|2,0,0]=4 24188 B12R1.1009 CC(C)Sc1c(cccc1Br)F 62a_100000210206_100011219512 [0,2,0,0,0,0|2,0,0]=4 24189 B12R1.1009 CC(C)Sc1c(cccc1Br)F 62a_100011219512_100000210206 [0,2,0,0,0,0|2,0,0]=4 24190 B12R1.1009 CC(C)Sc1c(cccc1Br)N 62a_100000210206_100020590159 [0,2,0,0,0,0|2,0,0]=4 24191 B12R1.1009 CC(C)Sc1c(cccc1Br)N 62a_100020590159_100000210206 [0,2,0,0,0,0|2,0,0]=4 24192 B12R1.1009 CC(C)Sc1c(cccc1Br)O 62a_100000210206_100010187912 [0,2,0,0,0,0|1,0,0]=3 24193 B12R1.1009 CC(C)Sc1c(cccc1Br)O 62a_100010187912_100000210206 [0,2,0,0,0,0|1,0,0]=3 24194 B12R1.1009 CC(C)Sc1c(cccc1Cl)Cl 62a_100000034237_100000210206 [0,2,0,0,0,0|2,0,0]=4 24195 B12R1.1009 CC(C)Sc1c(cccc1Cl)Cl 62a_100000210206_100000034237 [0,2,0,0,0,0|2,0,0]=4 24196 B12R1.1009 CC(C)Sc1c(cccc1Cl)F 62a_100000050007_100000210206 [0,2,0,0,0,0|2,0,0]=4 24197 B12R1.1009 CC(C)Sc1c(cccc1Cl)F 62a_100000210206_100000050007 [0,2,0,0,0,0|2,0,0]=4 24198 B12R1.1009 CC(C)Sc1c(cccc1Cl)N 62a_100000049713_100000210206 [0,2,0,0,0,0|2,0,0]=4 24199 B12R1.1009 CC(C)Sc1c(cccc1Cl)N 62a_100000210206_100000049713 [0,2,0,0,0,0|2,0,0]=4 24200 B12R1.1009 CC(C)Sc1c(cccc1Cl)O 62a_100000210206_100000050174 [0,2,0,0,0,0|1,0,0]=3 24201 B12R1.1009 CC(C)Sc1c(cccc1F)F 62a_100000210206_100000693133 [0,2,0,0,0,0|2,0,0]=4 24202 B12R1.1009 CC(C)Sc1c(cccc1F)F 62a_100000693133_100000210206 [0,2,0,0,0,0|2,0,0]=4 24203 B12R1.1009 CC(C)Sc1c(cccc1F)N 62a_100000210206_100000690935 [0,2,0,0,0,0|2,0,0]=4 24204 B12R1.1009 CC(C)Sc1c(cccc1F)N 62a_100000690935_100000210206 [0,2,0,0,0,0|2,0,0]=4 24205 B12R1.1009 CC(C)Sc1c(cccc1F)O 62a_100000210206_100009820682 [0,2,0,0,0,0|1,0,0]=3 24206 B12R1.1009 CC(C)Sc1c(cccc1F)O 62a_100009820682_100000210206 [0,2,0,0,0,0|1,0,0]=3 24207 B12R1.1009 CC(C)Sc1c(cccc1O)N 62a_100000210206_100012183704 [0,2,0,0,0,0|1,0,0]=3 24208 B12R1.1009 CC(C)Sc1c(cccc1O)N 62a_100012183704_100000210206 [0,2,0,0,0,0|1,0,0]=3 24209 B12R1.1009 CC(C)Sc1c(cccc1O)O 62a_100000210206_100010205330 [0,2,0,0,0,0|1,0,0]=3 24210 B12R1.1009 CC(C)Sc1c(ccnc1O)O 62a_100000210206_200009817435 [0,2,0,0,0,0|2,0,0]=4 24211 B12R1.1009 CN(C)Cc1c(cccc1Br)Br 270004a_100102631434_100010233043 [0,2,0,0,0,0|2,0,0]=4 24212 B12R1.1009 CN(C)Cc1c(cccc1Br)Cl 2230a_100102631434_100010138402 [0,2,0,0,0,0|2,0,0]=4 24213 B12R1.1009 CN(C)Cc1c(cccc1Br)Cl 269982a_100102631434_100010138402 [0,2,0,0,0,0|2,0,0]=4 24214 B12R1.1009 CN(C)Cc1c(cccc1Br)Cl 270004a_100102631434_100011249081 [0,2,0,0,0,0|2,0,0]=4 24215 B12R1.1009 CN(C)Cc1c(cccc1Br)F 2230a_100102631434_100012145669 [0,2,0,0,0,0|2,0,0]=4 24216 B12R1.1009 CN(C)Cc1c(cccc1Br)F 2230a_106744473292_200000210301 [0,2,0,0,0,0|2,0,0]=4 24217 B12R1.1009 CN(C)Cc1c(cccc1Br)F 269982a_100102631434_100012145669 [0,2,0,0,0,0|2,0,0]=4 24218 B12R1.1009 CN(C)Cc1c(cccc1Br)F 269982a_106744473292_200000210301 [0,2,0,0,0,0|2,0,0]=4 24219 B12R1.1009 CN(C)Cc1c(cccc1Br)F 270004a_100102631434_100000752695 [0,2,0,0,0,0|2,0,0]=4 24220 B12R1.1009 CN(C)Cc1c(cccc1Br)F 34a_106744473292_200000210301 [0,2,0,0,0,0|2,0,0]=4 24221 B12R1.1009 CN(C)Cc1c(cccc1Cl)Cl 2230a_100000186903_200000210301 [0,2,0,0,0,0|2,0,0]=4 24222 B12R1.1009 CN(C)Cc1c(cccc1Cl)Cl 2230a_100102631434_100000187851 [0,2,0,0,0,0|2,0,0]=4 24223 B12R1.1009 CN(C)Cc1c(cccc1Cl)Cl 269982a_100000186903_200000210301 [0,2,0,0,0,0|2,0,0]=4 24224 B12R1.1009 CN(C)Cc1c(cccc1Cl)Cl 269982a_100102631434_100000211241 [0,2,0,0,0,0|2,0,0]=4 24225 B12R1.1009 CN(C)Cc1c(cccc1Cl)Cl 270004a_100102631434_100000189306 [0,2,0,0,0,0|2,0,0]=4 24226 B12R1.1009 CN(C)Cc1c(cccc1Cl)Cl 34a_100000186903_200000210301 [0,2,0,0,0,0|2,0,0]=4 24227 B12R1.1009 CN(C)Cc1c(cccc1Cl)F 2230a_100000184537_200000210301 [0,2,0,0,0,0|2,0,0]=4 24228 B12R1.1009 CN(C)Cc1c(cccc1Cl)F 2230a_100102631434_100000187852 [0,2,0,0,0,0|2,0,0]=4 24229 B12R1.1009 CN(C)Cc1c(cccc1Cl)F 269982a_100000184537_200000210301 [0,2,0,0,0,0|2,0,0]=4 24230 B12R1.1009 CN(C)Cc1c(cccc1Cl)F 269982a_100102631434_100000187852 [0,2,0,0,0,0|2,0,0]=4 24231 B12R1.1009 CN(C)Cc1c(cccc1Cl)F 270004a_100102631434_100000210083 [0,2,0,0,0,0|2,0,0]=4 24232 B12R1.1009 CN(C)Cc1c(cccc1Cl)F 34a_100000184537_200000210301 [0,2,0,0,0,0|2,0,0]=4 24233 B12R1.1009 CN(C)Cc1c(cccc1F)F 2230a_100102631434_100000698325 [0,2,0,0,0,0|2,0,0]=4 24234 B12R1.1009 CN(C)Cc1c(cccc1F)F 269982a_100102631434_100000709179 [0,2,0,0,0,0|2,0,0]=4 24235 B12R1.1009 CN(C)Cc1c(cccc1F)F 270004a_100102631434_100000211061 [0,2,0,0,0,0|2,0,0]=4 24236 B12R1.1009 CN(C)Cc1c(cccc1I)Br 2230a_100102631434_100010146611 [0,2,0,0,0,0|2,0,0]=4 24237 B12R1.1009 CN(C)Cc1c(cccc1I)Br 269982a_100102631434_100010146611 [0,2,0,0,0,0|2,0,0]=4 24238 B12R1.1009 CN(C)Cc1c(cccc1I)Cl 270004a_100102631434_100010147682 [0,2,0,0,0,0|2,0,0]=4 24239 B12R1.1009 CN(C)Cc1c(cccc1I)F 2230a_100102631434_100010149602 [0,2,0,0,0,0|2,0,0]=4 24240 B12R1.1009 CN(C)Cc1c(cccc1I)F 269982a_100102631434_100010149602 [0,2,0,0,0,0|2,0,0]=4 24241 B12R1.1009 CN(C)Cc1c(cccc1I)F 270004a_100102631434_100010178011 [0,2,0,0,0,0|2,0,0]=4 24242 B12R1.1009 CN([13CH3])Cc1c(cccc1Br)F 2230a_106744473292_200025704644 [0,2,0,0,0,0|2,0,0]=4 24243 B12R1.1009 CN([13CH3])Cc1c(cccc1Br)F 269982a_106744473292_200025704644 [0,2,0,0,0,0|2,0,0]=4 24244 B12R1.1009 CN([13CH3])Cc1c(cccc1Br)F 34a_106744473292_200025704644 [0,2,0,0,0,0|2,0,0]=4 24245 B12R1.1009 CN([13CH3])Cc1c(cccc1Cl)Cl 2230a_100000186903_200025704644 [0,2,0,0,0,0|2,0,0]=4 24246 B12R1.1009 CN([13CH3])Cc1c(cccc1Cl)Cl 269982a_100000186903_200025704644 [0,2,0,0,0,0|2,0,0]=4 24247 B12R1.1009 CN([13CH3])Cc1c(cccc1Cl)Cl 34a_100000186903_200025704644 [0,2,0,0,0,0|2,0,0]=4 24248 B12R1.1009 CN([13CH3])Cc1c(cccc1Cl)F 2230a_100000184537_200025704644 [0,2,0,0,0,0|2,0,0]=4 24249 B12R1.1009 CN([13CH3])Cc1c(cccc1Cl)F 269982a_100000184537_200025704644 [0,2,0,0,0,0|2,0,0]=4 24250 B12R1.1009 CN([13CH3])Cc1c(cccc1Cl)F 34a_100000184537_200025704644 [0,2,0,0,0,0|2,0,0]=4 24251 B12R1.1009 Cc1cccc(c1CC(=O)[13CH3])Br 1458a_100010147022_200025704644 [0,2,0,0,0,0|1,0,1]=4 24252 B12R1.1009 Cc1cccc(c1CC(=O)[13CH3])C 1458a_100000689862_200025704644 [0,2,0,0,0,0|1,0,1]=4 24253 B12R1.1009 Cc1cccc(c1CN(C)C)Br 2230a_100102631434_100010146847 [0,2,0,0,0,0|2,0,0]=4 24254 B12R1.1009 Cc1cccc(c1CN(C)C)Br 269982a_100102631434_100010146847 [0,2,0,0,0,0|2,0,0]=4 24255 B12R1.1009 Cc1cccc(c1CN(C)C)Br 270004a_100102631434_100009881667 [0,2,0,0,0,0|2,0,0]=4 24256 B12R1.1009 Cc1cccc(c1CN(C)C)C 2230a_100102631434_100000758300 [0,2,0,0,0,0|2,0,0]=4 24257 B12R1.1009 Cc1cccc(c1CN(C)C)C 269982a_100102631434_100000758300 [0,2,0,0,0,0|2,0,0]=4 24258 B12R1.1009 Cc1cccc(c1CN(C)C)C 270004a_100102631434_100000758299 [0,2,0,0,0,0|2,0,0]=4 24259 B12R1.1009 Cc1cccc(c1CN(C)C)Cl 270004a_100102631434_100000041122 [0,2,0,0,0,0|2,0,0]=4 24260 B12R1.1009 Cc1cccc(c1CN(C)C)F 2230a_100102631434_100009814554 [0,2,0,0,0,0|2,0,0]=4 24261 B12R1.1009 Cc1cccc(c1CN(C)C)F 269982a_100102631434_100009814554 [0,2,0,0,0,0|2,0,0]=4 24262 B12R1.1009 Cc1cccc(c1CN(C)C)F 270004a_100102631434_100000069827 [0,2,0,0,0,0|2,0,0]=4 24263 B12R1.1009 Cc1cccc(c1CN(C)C)I 2230a_100102631434_100010150146 [0,2,0,0,0,0|2,0,0]=4 24264 B12R1.1009 Cc1cccc(c1CN(C)C)I 269982a_100102631434_100010150146 [0,2,0,0,0,0|2,0,0]=4 24265 B12R1.1009 Cc1cccc(c1NC(C)C)Br 34a_100011834072_100000210206 [0,2,0,0,0,0|2,0,0]=4 24266 B12R1.1009 Cc1cccc(c1NC(C)C)C 34a_100000185769_100000210206 [0,2,0,0,0,0|2,0,0]=4 24267 B12R1.1009 Cc1cccc(c1NC(C)C)Cl 34a_100000756524_100000210206 [0,2,0,0,0,0|2,0,0]=4 24268 B12R1.1009 Cc1cccc(c1NC(C)C)F 34a_100000766463_100000210206 [0,2,0,0,0,0|2,0,0]=4 24269 B12R1.1009 Cc1cccc(c1NC(C)C)O 34a_100000743429_100000210206 [0,2,0,0,0,0|1,0,0]=3 24270 B12R1.1009 Cc1cccc(c1OC(C)C)Br 34a_100009817157_100000210206 [0,2,0,0,0,0|2,0,0]=4 24271 B12R1.1009 Cc1cccc(c1OC(C)C)Br 7a_100009817157_100000210206 [0,2,0,0,0,0|2,0,0]=4 24272 B12R1.1009 Cc1cccc(c1OC(C)C)C 34a_100000210341_100000210206 [0,2,0,0,0,0|2,0,0]=4 24273 B12R1.1009 Cc1cccc(c1OC(C)C)C 7a_100000210341_100000210206 [0,2,0,0,0,0|2,0,0]=4 24274 B12R1.1009 Cc1cccc(c1OC(C)C)Cl 34a_100000033731_100000210206 [0,2,0,0,0,0|2,0,0]=4 24275 B12R1.1009 Cc1cccc(c1OC(C)C)Cl 7a_100000033731_100000210206 [0,2,0,0,0,0|2,0,0]=4 24276 B12R1.1009 Cc1cccc(c1OC(C)C)F 34a_100011659162_100000210206 [0,2,0,0,0,0|2,0,0]=4 24277 B12R1.1009 Cc1cccc(c1OC(C)C)F 7a_100011659162_100000210206 [0,2,0,0,0,0|2,0,0]=4 24278 B12R1.1009 Cc1cccc(c1OC(C)C)N 34a_100000756359_100000210206 [0,2,0,0,0,0|2,0,0]=4 24279 B12R1.1009 Cc1cccc(c1OC(C)C)N 7a_100000756359_100000210206 [0,2,0,0,0,0|2,0,0]=4 24280 B12R1.1009 Cc1cccc(c1OC(F)F)O 271570a_203496583355_100010232499 [0,2,0,0,0,0|2,0,0]=4 24281 B12R1.1009 Cc1cccc(c1SC(C)C)Br 62a_100000210206_100010141302 [0,2,0,0,0,0|2,0,0]=4 24282 B12R1.1009 Cc1cccc(c1SC(C)C)Br 62a_100010141302_100000210206 [0,2,0,0,0,0|2,0,0]=4 24283 B12R1.1009 Cc1cccc(c1SC(C)C)C 62a_100000033847_100000210206 [0,2,0,0,0,0|2,0,0]=4 24284 B12R1.1009 Cc1cccc(c1SC(C)C)C 62a_100000210206_100000033847 [0,2,0,0,0,0|2,0,0]=4 24285 B12R1.1009 Cc1cccc(c1SC(C)C)Cl 62a_100000043165_100000210206 [0,2,0,0,0,0|2,0,0]=4 24286 B12R1.1009 Cc1cccc(c1SC(C)C)Cl 62a_100000210206_100000043165 [0,2,0,0,0,0|2,0,0]=4 24287 B12R1.1009 Cc1cccc(c1SC(C)C)F 62a_100000210206_100011218421 [0,2,0,0,0,0|2,0,0]=4 24288 B12R1.1009 Cc1cccc(c1SC(C)C)F 62a_100011218421_100000210206 [0,2,0,0,0,0|2,0,0]=4 24289 B12R1.1009 Cc1cccc(c1SC(C)C)N 62a_100000210206_100000684715 [0,2,0,0,0,0|2,0,0]=4 24290 B12R1.1009 Cc1cccc(c1SC(C)C)N 62a_100000684715_100000210206 [0,2,0,0,0,0|2,0,0]=4 24291 B12R1.1009 Cc1cccc(c1SC(C)C)O 62a_100000210206_100000686692 [0,2,0,0,0,0|1,0,0]=3 24292 B12R1.1009 Cc1cccc(c1SC(C)C)O 62a_100000686692_100000210206 [0,2,0,0,0,0|1,0,0]=3 24293 B12R1.1009 Cc1ccnc(c1SC(C)C)O 62a_100000210206_100012000493 [0,2,0,0,0,0|2,0,0]=4 24294 B12R1.1009 Cc1ccnc(c1SC(C)C)O 62a_100012000493_100000210206 [0,2,0,0,0,0|2,0,0]=4 24295 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1Br)Br 1458a_100010209379_200025704644 [0,2,0,0,0,0|1,0,1]=4 24296 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1Br)Cl 1458a_100013084675_200025704644 [0,2,0,0,0,0|1,0,1]=4 24297 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1Br)F 1458a_100010172741_200025704644 [0,2,0,0,0,0|1,0,1]=4 24298 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_200025704644 [0,2,0,0,0,0|1,0,1]=4 24299 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1Cl)F 1458a_100000185183_200025704644 [0,2,0,0,0,0|1,0,1]=4 24300 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1F)F 1458a_100000684726_200025704644 [0,2,0,0,0,0|1,0,1]=4 24301 B12R1.270 C#Cc1ccc(c(c1)NCC)C 2230a_100012022948_100000210202 [0,2,0,0,0,0|2,0,0]=4 24302 B12R1.270 C#Cc1ccc(c(c1)NCC)C 34a_100012022948_100000210202 [0,2,0,0,0,0|2,0,0]=4 24303 B12R1.270 C#Cc1ccc(c(c1)NCC)C 7a_100012022948_100000210202 [0,2,0,0,0,0|2,0,0]=4 24304 B12R1.270 C#Cc1ccc(c(c1)NCC)F 34a_100000100531_100000210202 [0,2,0,0,0,0|2,0,0]=4 24305 B12R1.270 C=Cc1ccc(c(c1)CNC)C 271570a_100011290941_106744473289 [0,2,0,0,0,0|2,0,0]=4 24306 B12R1.270 C=Cc1ccc(c(c1)CNC)F 271570a_100011290941_100000748472 [0,2,0,0,0,0|2,0,0]=4 24307 B12R1.270 C=Cc1ccc(c(c1)CNC)O 271570a_100011290941_100011602694 [0,2,0,0,0,0|1,0,0]=3 24308 B12R1.270 C=Cc1ccc(c(c1)COC)Br 271570a_100011290941_202125822959 [0,2,0,0,0,0|2,0,0]=4 24309 B12R1.270 C=Cc1ccc(c(c1)COC)F 271570a_100011290941_100010140362 [0,2,0,0,0,0|2,0,0]=4 24310 B12R1.270 C=Cc1ccc(c(c1)NCC)N 271570a_100011290941_100000696630 [0,2,0,0,0,0|2,0,0]=4 24311 B12R1.270 C=Cc1ccc(c(c1)OCC)C 271570a_100011290941_100012361169 [0,2,0,0,0,0|2,0,0]=4 24312 B12R1.270 C=Cc1ccc(c(c1)OCC)F 271570a_100011290941_200012344967 [0,2,0,0,0,0|2,0,0]=4 24313 B12R1.270 C=Cc1ccc(c(c1)OCC)N 271570a_100011290941_100000688918 [0,2,0,0,0,0|2,0,0]=4 24314 B12R1.270 CC=Cc1cc(ccc1O)C#N 271570a_100016259895_100000725478 [0,2,0,0,0,0|0,0,2]=4 24315 B12R1.270 CC=Cc1cc(ccc1O)C=O 271570a_100016259895_100000184552 [0,2,0,0,0,0|0,0,2]=4 24316 B12R1.270 CC=Cc1cc(ccc1O)CC 271570a_100016259895_100012339963 [0,2,0,0,0,0|0,0,2]=4 24317 B12R1.270 CC=Cc1cc(ccc1O)CO 271570a_100016259895_100011191544 [0,2,0,0,0,0|0,0,2]=4 24318 B12R1.270 CC=Cc1cc(ccc1O)OC 271570a_100016259895_100000685887 [0,2,0,0,0,0|0,0,2]=4 24319 B12R1.270 CCNc1cc(ccc1Br)C#N 34a_100012001879_100000210202 [0,2,0,0,0,0|2,0,0]=4 24320 B12R1.270 CCNc1cc(ccc1Br)C#N 7a_100012001879_100000210202 [0,2,0,0,0,0|2,0,0]=4 24321 B12R1.270 CCNc1cc(ccc1Br)CO 34a_100012347568_100000210202 [0,2,0,0,0,0|2,0,0]=4 24322 B12R1.270 CCNc1cc(ccc1Br)OC 34a_100000748603_100000210202 [0,2,0,0,0,0|2,0,0]=4 24323 B12R1.270 CCNc1cc(ccc1C)C#N 34a_100000748024_100000210202 [0,2,0,0,0,0|2,0,0]=4 24324 B12R1.270 CCNc1cc(ccc1C)C#N 7a_100000748024_100000210202 [0,2,0,0,0,0|2,0,0]=4 24325 B12R1.270 CCNc1cc(ccc1C)CC 2230a_200012022522_100000210202 [0,2,0,0,0,0|2,0,0]=4 24326 B12R1.270 CCNc1cc(ccc1C)CC 34a_200012022522_100000210202 [0,2,0,0,0,0|2,0,0]=4 24327 B12R1.270 CCNc1cc(ccc1C)CC 7a_200012022522_100000210202 [0,2,0,0,0,0|2,0,0]=4 24328 B12R1.270 CCNc1cc(ccc1C)CO 2230a_100000758420_100000210202 [0,2,0,0,0,0|2,0,0]=4 24329 B12R1.270 CCNc1cc(ccc1C)CO 34a_100000758420_100000210202 [0,2,0,0,0,0|2,0,0]=4 24330 B12R1.270 CCNc1cc(ccc1C)OC 2230a_100000760359_100000210202 [0,2,0,0,0,0|2,0,0]=4 24331 B12R1.270 CCNc1cc(ccc1C)OC 34a_100000211784_200000210301 [0,2,0,0,0,0|2,0,0]=4 24332 B12R1.270 CCNc1cc(ccc1C)OC 34a_100000760359_100000210202 [0,2,0,0,0,0|2,0,0]=4 24333 B12R1.270 CCNc1cc(ccc1C)OC 7a_100000211784_200000210301 [0,2,0,0,0,0|2,0,0]=4 24334 B12R1.270 CCNc1cc(ccc1C)O[13CH3] 34a_100000211784_200025704644 [0,2,0,0,0,0|2,0,0]=4 24335 B12R1.270 CCNc1cc(ccc1C)O[13CH3] 7a_100000211784_200025704644 [0,2,0,0,0,0|2,0,0]=4 24336 B12R1.270 CCNc1cc(ccc1Cl)C#N 34a_100000766345_100000210202 [0,2,0,0,0,0|2,0,0]=4 24337 B12R1.270 CCNc1cc(ccc1Cl)C#N 7a_100000766345_100000210202 [0,2,0,0,0,0|2,0,0]=4 24338 B12R1.270 CCNc1cc(ccc1Cl)CO 34a_106256033963_100000210202 [0,2,0,0,0,0|2,0,0]=4 24339 B12R1.270 CCNc1cc(ccc1Cl)OC 34a_100000745576_100000210202 [0,2,0,0,0,0|2,0,0]=4 24340 B12R1.270 CCNc1cc(ccc1F)C#N 34a_100011934650_100000210202 [0,2,0,0,0,0|2,0,0]=4 24341 B12R1.270 CCNc1cc(ccc1F)C#N 7a_100011934650_100000210202 [0,2,0,0,0,0|2,0,0]=4 24342 B12R1.270 CCNc1cc(ccc1F)CO 2230a_102125399562_100000210202 [0,2,0,0,0,0|2,0,0]=4 24343 B12R1.270 CCNc1cc(ccc1F)CO 34a_102125399562_100000210202 [0,2,0,0,0,0|2,0,0]=4 24344 B12R1.270 CCNc1cc(ccc1F)OC 34a_100000764331_100000210202 [0,2,0,0,0,0|2,0,0]=4 24345 B12R1.270 CCNc1cc(ccc1I)C#N 34a_200012349464_100000210202 [0,2,0,0,0,0|2,0,0]=4 24346 B12R1.270 CCNc1cc(ccc1I)C#N 7a_200012349464_100000210202 [0,2,0,0,0,0|2,0,0]=4 24347 B12R1.270 CCNc1cc(ccc1I)OC 34a_100000748021_100000210202 [0,2,0,0,0,0|2,0,0]=4 24348 B12R1.270 CCNc1cc(ccc1N)SC 62a_100000696630_200000210301 [0,2,0,0,0,0|2,0,0]=4 24349 B12R1.270 CCNc1cc(ccc1N)SC 62a_200000210301_100000696630 [0,2,0,0,0,0|2,0,0]=4 24350 B12R1.270 CCNc1cc(ccc1N)S[13CH3] 62a_100000696630_200025704644 [0,2,0,0,0,0|2,0,0]=4 24351 B12R1.270 CCNc1cc(ccc1N)S[13CH3] 62a_200025704644_100000696630 [0,2,0,0,0,0|2,0,0]=4 24352 B12R1.270 CCNc1cc(ccc1O)C#N 34a_100000766272_100000210202 [0,2,0,0,0,0|1,0,0]=3 24353 B12R1.270 CCNc1cc(ccc1O)C#N 7a_100000766272_100000210202 [0,2,0,0,0,0|1,0,0]=3 24354 B12R1.270 CCNc1cc(ccc1O)CC 34a_100000765835_100000210202 [0,2,0,0,0,0|1,0,0]=3 24355 B12R1.270 CCNc1cc(ccc1O)CO 34a_100000123545_100000210202 [0,2,0,0,0,0|1,0,0]=3 24356 B12R1.270 CCNc1cc(ccc1O)OC 34a_100000188146_100000210202 [0,2,0,0,0,0|1,0,0]=3 24357 B12R1.270 CCOc1cc(ccc1Br)C#N 34a_100009877741_100000210202 [0,2,0,0,0,0|2,0,0]=4 24358 B12R1.270 CCOc1cc(ccc1Br)C#N 7a_100009877741_100000210202 [0,2,0,0,0,0|2,0,0]=4 24359 B12R1.270 CCOc1cc(ccc1Br)CO 34a_100010191536_100000210202 [0,2,0,0,0,0|2,0,0]=4 24360 B12R1.270 CCOc1cc(ccc1Br)CO 7a_100010191536_100000210202 [0,2,0,0,0,0|2,0,0]=4 24361 B12R1.270 CCOc1cc(ccc1Br)NC 2230a_200016990551_200000210301 [0,2,0,0,0,0|2,0,0]=4 24362 B12R1.270 CCOc1cc(ccc1Br)NC 34a_200016990551_200000210301 [0,2,0,0,0,0|2,0,0]=4 24363 B12R1.270 CCOc1cc(ccc1Br)NC 7a_200016990551_200000210301 [0,2,0,0,0,0|2,0,0]=4 24364 B12R1.270 CCOc1cc(ccc1Br)N[13CH3] 2230a_200016990551_200025704644 [0,2,0,0,0,0|2,0,0]=4 24365 B12R1.270 CCOc1cc(ccc1Br)N[13CH3] 34a_200016990551_200025704644 [0,2,0,0,0,0|2,0,0]=4 24366 B12R1.270 CCOc1cc(ccc1Br)N[13CH3] 7a_200016990551_200025704644 [0,2,0,0,0,0|2,0,0]=4 24367 B12R1.270 CCOc1cc(ccc1Br)OC 34a_100000719091_100000210202 [0,2,0,0,0,0|2,0,0]=4 24368 B12R1.270 CCOc1cc(ccc1Br)OC 7a_100000719091_100000210202 [0,2,0,0,0,0|2,0,0]=4 24369 B12R1.270 CCOc1cc(ccc1C)C#N 34a_100000765541_100000210202 [0,2,0,0,0,0|2,0,0]=4 24370 B12R1.270 CCOc1cc(ccc1C)C#N 7a_100000765541_100000210202 [0,2,0,0,0,0|2,0,0]=4 24371 B12R1.270 CCOc1cc(ccc1C)OC 34a_100012179981_100000210202 [0,2,0,0,0,0|2,0,0]=4 24372 B12R1.270 CCOc1cc(ccc1C)OC 7a_100012179981_100000210202 [0,2,0,0,0,0|2,0,0]=4 24373 B12R1.270 CCOc1cc(ccc1C)SC 62a_100012361169_200000210301 [0,2,0,0,0,0|2,0,0]=4 24374 B12R1.270 CCOc1cc(ccc1C)SC 62a_200000210301_100012361169 [0,2,0,0,0,0|2,0,0]=4 24375 B12R1.270 CCOc1cc(ccc1C)S[13CH3] 62a_100012361169_200025704644 [0,2,0,0,0,0|2,0,0]=4 24376 B12R1.270 CCOc1cc(ccc1C)S[13CH3] 62a_200025704644_100012361169 [0,2,0,0,0,0|2,0,0]=4 24377 B12R1.270 CCOc1cc(ccc1Cl)C#N 34a_100012186312_100000210202 [0,2,0,0,0,0|2,0,0]=4 24378 B12R1.270 CCOc1cc(ccc1Cl)C#N 7a_100012186312_100000210202 [0,2,0,0,0,0|2,0,0]=4 24379 B12R1.270 CCOc1cc(ccc1Cl)CN 34a_100020636435_100000210202 [0,2,0,0,0,0|2,0,0]=4 24380 B12R1.270 CCOc1cc(ccc1Cl)CO 34a_100009876509_100000210202 [0,2,0,0,0,0|2,0,0]=4 24381 B12R1.270 CCOc1cc(ccc1Cl)CO 7a_100009876509_100000210202 [0,2,0,0,0,0|2,0,0]=4 24382 B12R1.270 CCOc1cc(ccc1Cl)NC 2230a_100011964961_200000210301 [0,2,0,0,0,0|2,0,0]=4 24383 B12R1.270 CCOc1cc(ccc1Cl)NC 34a_100011964961_200000210301 [0,2,0,0,0,0|2,0,0]=4 24384 B12R1.270 CCOc1cc(ccc1Cl)N[13CH3] 2230a_100011964961_200025704644 [0,2,0,0,0,0|2,0,0]=4 24385 B12R1.270 CCOc1cc(ccc1Cl)N[13CH3] 34a_100011964961_200025704644 [0,2,0,0,0,0|2,0,0]=4 24386 B12R1.270 CCOc1cc(ccc1Cl)OC 34a_100011516019_100000210202 [0,2,0,0,0,0|2,0,0]=4 24387 B12R1.270 CCOc1cc(ccc1Cl)OC 7a_100011516019_100000210202 [0,2,0,0,0,0|2,0,0]=4 24388 B12R1.270 CCOc1cc(ccc1F)C#N 34a_100000069402_100000210202 [0,2,0,0,0,0|2,0,0]=4 24389 B12R1.270 CCOc1cc(ccc1F)C#N 7a_100000069402_100000210202 [0,2,0,0,0,0|2,0,0]=4 24390 B12R1.270 CCOc1cc(ccc1F)CN 34a_100160469508_100000210202 [0,2,0,0,0,0|2,0,0]=4 24391 B12R1.270 CCOc1cc(ccc1F)CO 34a_100009842347_100000210202 [0,2,0,0,0,0|2,0,0]=4 24392 B12R1.270 CCOc1cc(ccc1F)CO 7a_100009842347_100000210202 [0,2,0,0,0,0|2,0,0]=4 24393 B12R1.270 CCOc1cc(ccc1F)OC 34a_100012178750_100000210202 [0,2,0,0,0,0|2,0,0]=4 24394 B12R1.270 CCOc1cc(ccc1F)OC 7a_100012178750_100000210202 [0,2,0,0,0,0|2,0,0]=4 24395 B12R1.270 CCOc1cc(ccc1F)SC 62a_200000210301_200012344967 [0,2,0,0,0,0|2,0,0]=4 24396 B12R1.270 CCOc1cc(ccc1F)SC 62a_200012344967_200000210301 [0,2,0,0,0,0|2,0,0]=4 24397 B12R1.270 CCOc1cc(ccc1F)S[13CH3] 62a_200012344967_200025704644 [0,2,0,0,0,0|2,0,0]=4 24398 B12R1.270 CCOc1cc(ccc1F)S[13CH3] 62a_200025704644_200012344967 [0,2,0,0,0,0|2,0,0]=4 24399 B12R1.270 CCOc1cc(ccc1I)C#N 34a_100000724445_100000210202 [0,2,0,0,0,0|2,0,0]=4 24400 B12R1.270 CCOc1cc(ccc1I)C#N 7a_100000724445_100000210202 [0,2,0,0,0,0|2,0,0]=4 24401 B12R1.270 CCOc1cc(ccc1I)CO 34a_100000049605_100000210202 [0,2,0,0,0,0|2,0,0]=4 24402 B12R1.270 CCOc1cc(ccc1I)CO 7a_100000049605_100000210202 [0,2,0,0,0,0|2,0,0]=4 24403 B12R1.270 CCOc1cc(ccc1I)OC 34a_100010168831_100000210202 [0,2,0,0,0,0|2,0,0]=4 24404 B12R1.270 CCOc1cc(ccc1I)OC 7a_100010168831_100000210202 [0,2,0,0,0,0|2,0,0]=4 24405 B12R1.270 CCOc1cc(ccc1N)C#N 34a_100011997735_100000210202 [0,2,0,0,0,0|2,0,0]=4 24406 B12R1.270 CCOc1cc(ccc1N)C#N 7a_100011997735_100000210202 [0,2,0,0,0,0|2,0,0]=4 24407 B12R1.270 CCOc1cc(ccc1N)CC 34a_100000124328_100000210202 [0,2,0,0,0,0|2,0,0]=4 24408 B12R1.270 CCOc1cc(ccc1N)CC 7a_100000124328_100000210202 [0,2,0,0,0,0|2,0,0]=4 24409 B12R1.270 CCOc1cc(ccc1N)OC 34a_100016989039_100000210202 [0,2,0,0,0,0|2,0,0]=4 24410 B12R1.270 CCOc1cc(ccc1N)OC 7a_100016989039_100000210202 [0,2,0,0,0,0|2,0,0]=4 24411 B12R1.270 CCOc1cc(ccc1N)SC 62a_100000688918_200000210301 [0,2,0,0,0,0|2,0,0]=4 24412 B12R1.270 CCOc1cc(ccc1N)S[13CH3] 62a_100000688918_200025704644 [0,2,0,0,0,0|2,0,0]=4 24413 B12R1.270 CCOc1cc(ccc1O)C=O 271570a_203496583355_200010381951 [0,2,0,0,0,0|1,0,0]=3 24414 B12R1.270 CCSc1cc(ccc1Br)C#N 62a_100000210202_100012349583 [0,2,0,0,0,0|2,0,0]=4 24415 B12R1.270 CCSc1cc(ccc1Br)C=O 62a_100000210202_100010146563 [0,2,0,0,0,0|2,0,0]=4 24416 B12R1.270 CCSc1cc(ccc1Br)C=O 62a_100010146563_100000210202 [0,2,0,0,0,0|2,0,0]=4 24417 B12R1.270 CCSc1cc(ccc1Br)OC 62a_100000210202_100009992028 [0,2,0,0,0,0|2,0,0]=4 24418 B12R1.270 CCSc1cc(ccc1Br)OC 62a_100009992028_100000210202 [0,2,0,0,0,0|2,0,0]=4 24419 B12R1.270 CCSc1cc(ccc1C)C#N 62a_100000210202_100000690169 [0,2,0,0,0,0|2,0,0]=4 24420 B12R1.270 CCSc1cc(ccc1C)C=O 62a_100000210202_100000695567 [0,2,0,0,0,0|2,0,0]=4 24421 B12R1.270 CCSc1cc(ccc1C)C=O 62a_100000695567_100000210202 [0,2,0,0,0,0|2,0,0]=4 24422 B12R1.270 CCSc1cc(ccc1C)CO 62a_100000210202_100000708995 [0,2,0,0,0,0|2,0,0]=4 24423 B12R1.270 CCSc1cc(ccc1C)CO 62a_100000708995_100000210202 [0,2,0,0,0,0|2,0,0]=4 24424 B12R1.270 CCSc1cc(ccc1C)NC 62a_100000210202_100000707694 [0,2,0,0,0,0|2,0,0]=4 24425 B12R1.270 CCSc1cc(ccc1C)NC 62a_100000707694_100000210202 [0,2,0,0,0,0|2,0,0]=4 24426 B12R1.270 CCSc1cc(ccc1C)NN 62a_100000210202_100016991967 [0,2,0,0,0,0|2,0,0]=4 24427 B12R1.270 CCSc1cc(ccc1C)NN 62a_100016991967_100000210202 [0,2,0,0,0,0|2,0,0]=4 24428 B12R1.270 CCSc1cc(ccc1C)OC 62a_100000210202_100012349166 [0,2,0,0,0,0|2,0,0]=4 24429 B12R1.270 CCSc1cc(ccc1C)OC 62a_100012349166_100000210202 [0,2,0,0,0,0|2,0,0]=4 24430 B12R1.270 CCSc1cc(ccc1Cl)C#N 62a_100000210202_100010199462 [0,2,0,0,0,0|2,0,0]=4 24431 B12R1.270 CCSc1cc(ccc1Cl)C=O 62a_100000210202_100010209939 [0,2,0,0,0,0|2,0,0]=4 24432 B12R1.270 CCSc1cc(ccc1Cl)C=O 62a_100010209939_100000210202 [0,2,0,0,0,0|2,0,0]=4 24433 B12R1.270 CCSc1cc(ccc1Cl)OC 62a_100000210202_100011356938 [0,2,0,0,0,0|2,0,0]=4 24434 B12R1.270 CCSc1cc(ccc1Cl)OC 62a_100011356938_100000210202 [0,2,0,0,0,0|2,0,0]=4 24435 B12R1.270 CCSc1cc(ccc1F)C#N 62a_100000210202_100000188605 [0,2,0,0,0,0|2,0,0]=4 24436 B12R1.270 CCSc1cc(ccc1F)C=O 62a_100000210202_100000211747 [0,2,0,0,0,0|2,0,0]=4 24437 B12R1.270 CCSc1cc(ccc1F)C=O 62a_100000211747_100000210202 [0,2,0,0,0,0|2,0,0]=4 24438 B12R1.270 CCSc1cc(ccc1F)CC 62a_100000210202_200010244628 [0,2,0,0,0,0|2,0,0]=4 24439 B12R1.270 CCSc1cc(ccc1F)CC 62a_200010244628_100000210202 [0,2,0,0,0,0|2,0,0]=4 24440 B12R1.270 CCSc1cc(ccc1F)CN 62a_100000210202_100015193890 [0,2,0,0,0,0|2,0,0]=4 24441 B12R1.270 CCSc1cc(ccc1F)CN 62a_100015193890_100000210202 [0,2,0,0,0,0|2,0,0]=4 24442 B12R1.270 CCSc1cc(ccc1F)CO 62a_100000210202_100000246287 [0,2,0,0,0,0|2,0,0]=4 24443 B12R1.270 CCSc1cc(ccc1F)CO 62a_100000246287_100000210202 [0,2,0,0,0,0|2,0,0]=4 24444 B12R1.270 CCSc1cc(ccc1F)NN 62a_100000210202_200025705588 [0,2,0,0,0,0|2,0,0]=4 24445 B12R1.270 CCSc1cc(ccc1F)NN 62a_200025705588_100000210202 [0,2,0,0,0,0|2,0,0]=4 24446 B12R1.270 CCSc1cc(ccc1F)OC 62a_100000210202_100000699733 [0,2,0,0,0,0|2,0,0]=4 24447 B12R1.270 CCSc1cc(ccc1F)OC 62a_100000699733_100000210202 [0,2,0,0,0,0|2,0,0]=4 24448 B12R1.270 CCSc1cc(ccc1F)SC 62a_100000210202_200010708804 [0,2,0,0,0,0|2,0,0]=4 24449 B12R1.270 CCSc1cc(ccc1F)SC 62a_200010708804_100000210202 [0,2,0,0,0,0|2,0,0]=4 24450 B12R1.270 CCSc1cc(ccc1N)C#N 62a_100000210202_100000736769 [0,2,0,0,0,0|2,0,0]=4 24451 B12R1.270 CCSc1cc(ccc1N)CC 62a_100000210202_100012339725 [0,2,0,0,0,0|2,0,0]=4 24452 B12R1.270 CCSc1cc(ccc1N)CC 62a_100012339725_100000210202 [0,2,0,0,0,0|2,0,0]=4 24453 B12R1.270 CCSc1cc(ccc1N)OC 62a_100000210202_100015195136 [0,2,0,0,0,0|2,0,0]=4 24454 B12R1.270 CCSc1cc(ccc1N)OC 62a_100015195136_100000210202 [0,2,0,0,0,0|2,0,0]=4 24455 B12R1.270 CCSc1cc(ccc1O)C#N 62a_100000210202_100000725478 [0,2,0,0,0,0|1,0,0]=3 24456 B12R1.270 CCSc1cc(ccc1O)C=O 62a_100000184552_100000210202 [0,2,0,0,0,0|1,0,0]=3 24457 B12R1.270 CCSc1cc(ccc1O)C=O 62a_100000210202_100000184552 [0,2,0,0,0,0|1,0,0]=3 24458 B12R1.270 CCSc1cc(ccc1O)CC 62a_100000210202_100012339963 [0,2,0,0,0,0|1,0,0]=3 24459 B12R1.270 CCSc1cc(ccc1O)CC 62a_100012339963_100000210202 [0,2,0,0,0,0|1,0,0]=3 24460 B12R1.270 CCSc1cc(ccc1O)CO 62a_100000210202_100011191544 [0,2,0,0,0,0|1,0,0]=3 24461 B12R1.270 CCSc1cc(ccc1O)CO 62a_100011191544_100000210202 [0,2,0,0,0,0|1,0,0]=3 24462 B12R1.270 CCSc1cc(ccc1O)OC 62a_100000210202_100000685887 [0,2,0,0,0,0|1,0,0]=3 24463 B12R1.270 CCSc1cc(cnc1O)C#N 62a_100000210202_100009819929 [0,2,0,0,0,0|2,0,0]=4 24464 B12R1.270 CCSc1cc(cnc1O)C=O 62a_100000210202_100010064886 [0,2,0,0,0,0|2,0,0]=4 24465 B12R1.270 CCSc1cc(cnc1O)C=O 62a_100010064886_100000210202 [0,2,0,0,0,0|2,0,0]=4 24466 B12R1.270 CCSc1nc(ccc1O)CO 62a_100000210202_200000118097 [0,2,0,0,0,0|2,0,0]=4 24467 B12R1.270 CCSc1nc(ccc1O)CO 62a_200009817064_100000210202 [0,2,0,0,0,0|2,0,0]=4 24468 B12R1.270 CCc1ccc(c(c1)NCF)O 34a_100000765835_100015361967 [0,2,0,0,0,0|2,0,0]=4 24469 B12R1.270 CCc1ccc(c(c1)SCF)O 62a_100012339963_100015361967 [0,2,0,0,0,0|2,0,0]=4 24470 B12R1.270 CCc1ccc(c(c1)SCF)O 62a_100015361967_100012339963 [0,2,0,0,0,0|2,0,0]=4 24471 B12R1.270 CNCc1cc(ccc1Br)C#N 2230a_106832991635_100012145668 [0,2,0,0,0,0|2,0,0]=4 24472 B12R1.270 CNCc1cc(ccc1Br)C#N 26a_100102657272_100009877741 [0,2,0,0,0,0|2,0,0]=4 24473 B12R1.270 CNCc1cc(ccc1Br)C#N 270004a_106832991635_100012361533 [0,2,0,0,0,0|2,0,0]=4 24474 B12R1.270 CNCc1cc(ccc1Br)C#N 34a_100102657272_100012145668 [0,2,0,0,0,0|2,0,0]=4 24475 B12R1.270 CNCc1cc(ccc1Br)C#N 7a_106832991635_100012145668 [0,2,0,0,0,0|2,0,0]=4 24476 B12R1.270 CNCc1cc(ccc1Br)CO 26a_100102657272_100010191536 [0,2,0,0,0,0|2,0,0]=4 24477 B12R1.270 CNCc1cc(ccc1Br)OC 207a_100102657272_100000691568 [0,2,0,0,0,0|2,0,0]=4 24478 B12R1.270 CNCc1cc(ccc1Br)OC 2230a_100000741592_200000210301 [0,2,0,0,0,0|2,0,0]=4 24479 B12R1.270 CNCc1cc(ccc1Br)OC 2230a_106832991635_100000761528 [0,2,0,0,0,0|2,0,0]=4 24480 B12R1.270 CNCc1cc(ccc1Br)OC 26a_100102657272_100000719091 [0,2,0,0,0,0|2,0,0]=4 24481 B12R1.270 CNCc1cc(ccc1Br)OC 270004a_106832991635_100000691568 [0,2,0,0,0,0|2,0,0]=4 24482 B12R1.270 CNCc1cc(ccc1Br)OC 34a_100000741592_200000210301 [0,2,0,0,0,0|2,0,0]=4 24483 B12R1.270 CNCc1cc(ccc1Br)OC 34a_100102657272_100000761528 [0,2,0,0,0,0|2,0,0]=4 24484 B12R1.270 CNCc1cc(ccc1Br)OC 7a_106832991635_100000761528 [0,2,0,0,0,0|2,0,0]=4 24485 B12R1.270 CNCc1cc(ccc1C)OC 207a_100102657272_100012017359 [0,2,0,0,0,0|2,0,0]=4 24486 B12R1.270 CNCc1cc(ccc1C)OC 270004a_106832991635_100012017359 [0,2,0,0,0,0|2,0,0]=4 24487 B12R1.270 CNCc1cc(ccc1C)OC 34a_100012180165_200000210301 [0,2,0,0,0,0|2,0,0]=4 24488 B12R1.270 CNCc1cc(ccc1C)SC 62a_106744473289_200000210301 [0,2,0,0,0,0|2,0,0]=4 24489 B12R1.270 CNCc1cc(ccc1C)SC 62a_200000210301_106744473289 [0,2,0,0,0,0|2,0,0]=4 24490 B12R1.270 CNCc1cc(ccc1C)S[13CH3] 62a_106744473289_200025704644 [0,2,0,0,0,0|2,0,0]=4 24491 B12R1.270 CNCc1cc(ccc1C)S[13CH3] 62a_200025704644_106744473289 [0,2,0,0,0,0|2,0,0]=4 24492 B12R1.270 CNCc1cc(ccc1Cl)C#N 207a_100102657272_100012179093 [0,2,0,0,0,0|2,0,0]=4 24493 B12R1.270 CNCc1cc(ccc1Cl)C#N 26a_100102657272_100012186312 [0,2,0,0,0,0|2,0,0]=4 24494 B12R1.270 CNCc1cc(ccc1Cl)C#N 270004a_106832991635_100012179093 [0,2,0,0,0,0|2,0,0]=4 24495 B12R1.270 CNCc1cc(ccc1Cl)CO 26a_100102657272_100009876509 [0,2,0,0,0,0|2,0,0]=4 24496 B12R1.270 CNCc1cc(ccc1Cl)OC 207a_100102657272_100000117592 [0,2,0,0,0,0|2,0,0]=4 24497 B12R1.270 CNCc1cc(ccc1Cl)OC 2230a_106832991635_100000718613 [0,2,0,0,0,0|2,0,0]=4 24498 B12R1.270 CNCc1cc(ccc1Cl)OC 26a_100102657272_100011516019 [0,2,0,0,0,0|2,0,0]=4 24499 B12R1.270 CNCc1cc(ccc1Cl)OC 270004a_106832991635_100000117592 [0,2,0,0,0,0|2,0,0]=4 24500 B12R1.270 CNCc1cc(ccc1Cl)OC 34a_100102657272_100000718613 [0,2,0,0,0,0|2,0,0]=4 24501 B12R1.270 CNCc1cc(ccc1Cl)OC 7a_106832991635_100000718613 [0,2,0,0,0,0|2,0,0]=4 24502 B12R1.270 CNCc1cc(ccc1F)C#N 207a_100102657272_100011997226 [0,2,0,0,0,0|2,0,0]=4 24503 B12R1.270 CNCc1cc(ccc1F)C#N 2230a_106832991635_100000239971 [0,2,0,0,0,0|2,0,0]=4 24504 B12R1.270 CNCc1cc(ccc1F)C#N 26a_100102657272_100000069402 [0,2,0,0,0,0|2,0,0]=4 24505 B12R1.270 CNCc1cc(ccc1F)C#N 270004a_106832991635_100011997226 [0,2,0,0,0,0|2,0,0]=4 24506 B12R1.270 CNCc1cc(ccc1F)C#N 7a_106832991635_100000239971 [0,2,0,0,0,0|2,0,0]=4 24507 B12R1.270 CNCc1cc(ccc1F)CO 26a_100102657272_100009842347 [0,2,0,0,0,0|2,0,0]=4 24508 B12R1.270 CNCc1cc(ccc1F)OC 207a_100102657272_100000034340 [0,2,0,0,0,0|2,0,0]=4 24509 B12R1.270 CNCc1cc(ccc1F)OC 2230a_106832991635_100010243555 [0,2,0,0,0,0|2,0,0]=4 24510 B12R1.270 CNCc1cc(ccc1F)OC 270004a_106832991635_100000034340 [0,2,0,0,0,0|2,0,0]=4 24511 B12R1.270 CNCc1cc(ccc1F)OC 34a_100016995475_200000210301 [0,2,0,0,0,0|2,0,0]=4 24512 B12R1.270 CNCc1cc(ccc1F)OC 34a_100102657272_100010243555 [0,2,0,0,0,0|2,0,0]=4 24513 B12R1.270 CNCc1cc(ccc1F)OC 7a_106832991635_100010243555 [0,2,0,0,0,0|2,0,0]=4 24514 B12R1.270 CNCc1cc(ccc1F)SC 207a_100102657272_200010946432 [0,2,0,0,0,0|2,0,0]=4 24515 B12R1.270 CNCc1cc(ccc1F)SC 270004a_106832991635_200010946432 [0,2,0,0,0,0|2,0,0]=4 24516 B12R1.270 CNCc1cc(ccc1F)SC 62a_100000748472_200000210301 [0,2,0,0,0,0|2,0,0]=4 24517 B12R1.270 CNCc1cc(ccc1F)SC 62a_200000210301_100000748472 [0,2,0,0,0,0|2,0,0]=4 24518 B12R1.270 CNCc1cc(ccc1F)S[13CH3] 62a_100000748472_200025704644 [0,2,0,0,0,0|2,0,0]=4 24519 B12R1.270 CNCc1cc(ccc1F)S[13CH3] 62a_200025704644_100000748472 [0,2,0,0,0,0|2,0,0]=4 24520 B12R1.270 CNCc1cc(ccc1I)OC 207a_100102657272_100010075557 [0,2,0,0,0,0|2,0,0]=4 24521 B12R1.270 CNCc1cc(ccc1I)OC 270004a_106832991635_100010075557 [0,2,0,0,0,0|2,0,0]=4 24522 B12R1.270 CNCc1cc(ccc1O)SC 62a_100011602694_200000210301 [0,2,0,0,0,0|1,0,0]=3 24523 B12R1.270 CNCc1cc(ccc1O)SC 62a_200000210301_100011602694 [0,2,0,0,0,0|1,0,0]=3 24524 B12R1.270 CNCc1cc(ccc1O)S[13CH3] 62a_100011602694_200025704644 [0,2,0,0,0,0|1,0,0]=3 24525 B12R1.270 CNCc1cc(ccc1O)S[13CH3] 62a_200025704644_100011602694 [0,2,0,0,0,0|1,0,0]=3 24526 B12R1.270 COCc1cc(ccc1Br)C#N 34a_100010246249_200000210301 [0,2,0,0,0,0|2,0,0]=4 24527 B12R1.270 COCc1cc(ccc1Br)C#N 34a_100138415774_100012145668 [0,2,0,0,0,0|2,0,0]=4 24528 B12R1.270 COCc1cc(ccc1Br)C#N 7a_100010246249_200000210301 [0,2,0,0,0,0|2,0,0]=4 24529 B12R1.270 COCc1cc(ccc1Br)OC 34a_100138415774_100000761528 [0,2,0,0,0,0|2,0,0]=4 24530 B12R1.270 COCc1cc(ccc1Br)OC 34a_200011273942_200000210301 [0,2,0,0,0,0|2,0,0]=4 24531 B12R1.270 COCc1cc(ccc1Br)OC 7a_200011273942_200000210301 [0,2,0,0,0,0|2,0,0]=4 24532 B12R1.270 COCc1cc(ccc1Br)SC 62a_200000210301_202125822959 [0,2,0,0,0,0|2,0,0]=4 24533 B12R1.270 COCc1cc(ccc1Br)SC 62a_202125822959_200000210301 [0,2,0,0,0,0|2,0,0]=4 24534 B12R1.270 COCc1cc(ccc1Br)S[13CH3] 62a_200025704644_202125822959 [0,2,0,0,0,0|2,0,0]=4 24535 B12R1.270 COCc1cc(ccc1Br)S[13CH3] 62a_202125822959_200025704644 [0,2,0,0,0,0|2,0,0]=4 24536 B12R1.270 COCc1cc(ccc1C)C#N 34a_200009860882_200000210301 [0,2,0,0,0,0|2,0,0]=4 24537 B12R1.270 COCc1cc(ccc1C)C#N 7a_200009860882_200000210301 [0,2,0,0,0,0|2,0,0]=4 24538 B12R1.270 COCc1cc(ccc1C)OC 34a_100009841904_200000210301 [0,2,0,0,0,0|2,0,0]=4 24539 B12R1.270 COCc1cc(ccc1C)OC 7a_100009841904_200000210301 [0,2,0,0,0,0|2,0,0]=4 24540 B12R1.270 COCc1cc(ccc1Cl)OC 34a_100138415774_100000718613 [0,2,0,0,0,0|2,0,0]=4 24541 B12R1.270 COCc1cc(ccc1F)C#N 34a_100000757149_200000210301 [0,2,0,0,0,0|2,0,0]=4 24542 B12R1.270 COCc1cc(ccc1F)C#N 7a_100000757149_200000210301 [0,2,0,0,0,0|2,0,0]=4 24543 B12R1.270 COCc1cc(ccc1F)OC 34a_100000067870_200000210301 [0,2,0,0,0,0|2,0,0]=4 24544 B12R1.270 COCc1cc(ccc1F)OC 34a_100138415774_100010243555 [0,2,0,0,0,0|2,0,0]=4 24545 B12R1.270 COCc1cc(ccc1F)OC 7a_100000067870_200000210301 [0,2,0,0,0,0|2,0,0]=4 24546 B12R1.270 COCc1cc(ccc1F)SC 62a_100010140362_200000210301 [0,2,0,0,0,0|2,0,0]=4 24547 B12R1.270 COCc1cc(ccc1F)SC 62a_200000210301_100010140362 [0,2,0,0,0,0|2,0,0]=4 24548 B12R1.270 COCc1cc(ccc1F)S[13CH3] 62a_100010140362_200025704644 [0,2,0,0,0,0|2,0,0]=4 24549 B12R1.270 COCc1cc(ccc1F)S[13CH3] 62a_200025704644_100010140362 [0,2,0,0,0,0|2,0,0]=4 24550 B12R1.270 COCc1cc(ccc1N)OC 34a_100012001277_200000210301 [0,2,0,0,0,0|2,0,0]=4 24551 B12R1.270 COc1ccc(c(c1)CC#N)O 271570a_203496583355_100012259381 [0,2,0,0,0,0|1,0,1]=4 24552 B12R1.270 COc1ccc(c(c1)CCO)O 271570a_203496583355_100012259501 [0,2,0,0,0,0|1,0,0]=3 24553 B12R1.270 COc1ccc(c(c1)CN[13CH3])Br 2230a_100000741592_200025704644 [0,2,0,0,0,0|2,0,0]=4 24554 B12R1.270 COc1ccc(c(c1)CN[13CH3])Br 34a_100000741592_200025704644 [0,2,0,0,0,0|2,0,0]=4 24555 B12R1.270 COc1ccc(c(c1)CN[13CH3])C 34a_100012180165_200025704644 [0,2,0,0,0,0|2,0,0]=4 24556 B12R1.270 COc1ccc(c(c1)CN[13CH3])F 34a_100016995475_200025704644 [0,2,0,0,0,0|2,0,0]=4 24557 B12R1.270 COc1ccc(c(c1)CO[13CH3])Br 34a_200011273942_200025704644 [0,2,0,0,0,0|2,0,0]=4 24558 B12R1.270 COc1ccc(c(c1)CO[13CH3])Br 7a_200011273942_200025704644 [0,2,0,0,0,0|2,0,0]=4 24559 B12R1.270 COc1ccc(c(c1)CO[13CH3])C 34a_100009841904_200025704644 [0,2,0,0,0,0|2,0,0]=4 24560 B12R1.270 COc1ccc(c(c1)CO[13CH3])C 7a_100009841904_200025704644 [0,2,0,0,0,0|2,0,0]=4 24561 B12R1.270 COc1ccc(c(c1)CO[13CH3])F 34a_100000067870_200025704644 [0,2,0,0,0,0|2,0,0]=4 24562 B12R1.270 COc1ccc(c(c1)CO[13CH3])F 7a_100000067870_200025704644 [0,2,0,0,0,0|2,0,0]=4 24563 B12R1.270 COc1ccc(c(c1)CO[13CH3])N 34a_100012001277_200025704644 [0,2,0,0,0,0|2,0,0]=4 24564 B12R1.270 COc1ccc(c(c1)CSC)Br 62a_100000761528_200000210301 [0,2,0,0,0,0|2,0,0]=4 24565 B12R1.270 COc1ccc(c(c1)CSC)Br 62a_200000210301_100000761528 [0,2,0,0,0,0|2,0,0]=4 24566 B12R1.270 COc1ccc(c(c1)CSC)Cl 62a_100000718613_200000210301 [0,2,0,0,0,0|2,0,0]=4 24567 B12R1.270 COc1ccc(c(c1)CSC)Cl 62a_200000210301_100000718613 [0,2,0,0,0,0|2,0,0]=4 24568 B12R1.270 COc1ccc(c(c1)CSC)F 62a_100010243555_200000210301 [0,2,0,0,0,0|2,0,0]=4 24569 B12R1.270 COc1ccc(c(c1)CSC)F 62a_200000210301_100010243555 [0,2,0,0,0,0|2,0,0]=4 24570 B12R1.270 COc1ccc(c(c1)CS[13CH3])Br 62a_100000761528_200025704644 [0,2,0,0,0,0|2,0,0]=4 24571 B12R1.270 COc1ccc(c(c1)CS[13CH3])Br 62a_200025704644_100000761528 [0,2,0,0,0,0|2,0,0]=4 24572 B12R1.270 COc1ccc(c(c1)CS[13CH3])Cl 62a_100000718613_200025704644 [0,2,0,0,0,0|2,0,0]=4 24573 B12R1.270 COc1ccc(c(c1)CS[13CH3])Cl 62a_200025704644_100000718613 [0,2,0,0,0,0|2,0,0]=4 24574 B12R1.270 COc1ccc(c(c1)CS[13CH3])F 62a_100010243555_200025704644 [0,2,0,0,0,0|2,0,0]=4 24575 B12R1.270 COc1ccc(c(c1)CS[13CH3])F 62a_200025704644_100010243555 [0,2,0,0,0,0|2,0,0]=4 24576 B12R1.270 COc1ccc(c(c1)NCF)O 34a_100000188146_100015361967 [0,2,0,0,0,0|2,0,0]=4 24577 B12R1.270 COc1ccc(c(c1)SCF)O 62a_100015361967_100000685887 [0,2,0,0,0,0|2,0,0]=4 24578 B12R1.270 CSCc1cc(ccc1Br)C#N 62a_100012145668_200000210301 [0,2,0,0,0,0|2,0,0]=4 24579 B12R1.270 CSCc1cc(ccc1Br)C#N 62a_200000210301_100012145668 [0,2,0,0,0,0|2,0,0]=4 24580 B12R1.270 CSCc1cc(ccc1F)C#N 62a_200000210301_100000239971 [0,2,0,0,0,0|2,0,0]=4 24581 B12R1.270 Cc1ccc(cc1CO[13CH3])C#N 34a_200009860882_200025704644 [0,2,0,0,0,0|2,0,0]=4 24582 B12R1.270 Cc1ccc(cc1CO[13CH3])C#N 7a_200009860882_200025704644 [0,2,0,0,0,0|2,0,0]=4 24583 B12R1.270 N#Cc1ccc(c(c1)NCF)O 34a_100000766272_100015361967 [0,2,0,0,0,0|2,0,0]=4 24584 B12R1.270 N#Cc1ccc(c(c1)NCF)O 7a_100000766272_100015361967 [0,2,0,0,0,0|2,0,0]=4 24585 B12R1.270 N#Cc1ccc(c(c1)SCF)O 62a_100015361967_100000725478 [0,2,0,0,0,0|2,0,0]=4 24586 B12R1.270 O=Cc1ccc(c(c1)SCF)O 62a_100000184552_100015361967 [0,2,0,0,0,0|2,0,0]=4 24587 B12R1.270 O=Cc1ccc(c(c1)SCF)O 62a_100015361967_100000184552 [0,2,0,0,0,0|2,0,0]=4 24588 B12R1.270 OCc1ccc(c(c1)NCF)O 34a_100000123545_100015361967 [0,2,0,0,0,0|2,0,0]=4 24589 B12R1.270 OCc1ccc(c(c1)SCF)O 62a_100011191544_100015361967 [0,2,0,0,0,0|2,0,0]=4 24590 B12R1.270 OCc1ccc(c(c1)SCF)O 62a_100015361967_100011191544 [0,2,0,0,0,0|2,0,0]=4 24591 B12R1.270 [13CH3]OCc1cc(ccc1Br)C#N 34a_100010246249_200025704644 [0,2,0,0,0,0|2,0,0]=4 24592 B12R1.270 [13CH3]OCc1cc(ccc1Br)C#N 7a_100010246249_200025704644 [0,2,0,0,0,0|2,0,0]=4 24593 B12R1.270 [13CH3]OCc1cc(ccc1F)C#N 34a_100000757149_200025704644 [0,2,0,0,0,0|2,0,0]=4 24594 B12R1.270 [13CH3]OCc1cc(ccc1F)C#N 7a_100000757149_200025704644 [0,2,0,0,0,0|2,0,0]=4 24595 B12R1.270 [13CH3]SCc1cc(ccc1Br)C#N 62a_100012145668_200025704644 [0,2,0,0,0,0|2,0,0]=4 24596 B12R1.270 [13CH3]SCc1cc(ccc1Br)C#N 62a_200025704644_100012145668 [0,2,0,0,0,0|2,0,0]=4 24597 B12R1.270 [13CH3]SCc1cc(ccc1F)C#N 62a_200025704644_100000239971 [0,2,0,0,0,0|2,0,0]=4 24598 B12R1.354 CC(N[13CH3])c1cc(ccc1Br)F 2230a_100012343209_200025704644 [0,2,0,0,0,0|2,0,0]=4 24599 B12R1.354 CC(N[13CH3])c1cc(ccc1Br)F 34a_100012343209_200025704644 [0,2,0,0,0,0|2,0,0]=4 24600 B12R1.354 CC(N[13CH3])c1cc(ccc1Cl)Cl 2230a_100000737532_200025704644 [0,2,0,0,0,0|2,0,0]=4 24601 B12R1.354 CC(N[13CH3])c1cc(ccc1Cl)Cl 34a_100000737532_200025704644 [0,2,0,0,0,0|2,0,0]=4 24602 B12R1.354 CC(N[13CH3])c1cc(ccc1F)F 2230a_100000737541_200025704644 [0,2,0,0,0,0|2,0,0]=4 24603 B12R1.354 CC(N[13CH3])c1cc(ccc1F)F 34a_100000737541_200025704644 [0,2,0,0,0,0|2,0,0]=4 24604 B12R1.354 CC(O[13CH3])c1cc(ccc1Cl)Cl 34a_100000742519_200025704644 [0,2,0,0,0,0|2,0,0]=4 24605 B12R1.354 CC(O[13CH3])c1cc(ccc1Cl)Cl 7a_100000742519_200025704644 [0,2,0,0,0,0|2,0,0]=4 24606 B12R1.354 CC(O[13CH3])c1cc(ccc1F)Br 34a_100011943926_200025704644 [0,2,0,0,0,0|2,0,0]=4 24607 B12R1.354 CC(O[13CH3])c1cc(ccc1F)Br 7a_100011943926_200025704644 [0,2,0,0,0,0|2,0,0]=4 24608 B12R1.354 CC(O[13CH3])c1cc(ccc1F)F 34a_100000246540_200025704644 [0,2,0,0,0,0|2,0,0]=4 24609 B12R1.354 CC(O[13CH3])c1cc(ccc1F)F 7a_100000246540_200025704644 [0,2,0,0,0,0|2,0,0]=4 24610 B12R1.354 CCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210202 [0,2,0,0,0,0|1,0,1]=4 24611 B12R1.354 CCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000210202 [0,2,0,0,0,0|1,0,1]=4 24612 B12R1.354 CCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210202 [0,2,0,0,0,0|1,0,1]=4 24613 B12R1.354 CCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210202 [0,2,0,0,0,0|1,0,1]=4 24614 B12R1.354 CCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210202 [0,2,0,0,0,0|1,0,1]=4 24615 B12R1.354 CCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210202 [0,2,0,0,0,0|1,0,1]=4 24616 B12R1.354 CCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000210202 [0,2,0,0,0,0|1,0,1]=4 24617 B12R1.354 CCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000210202 [0,2,0,0,0,0|1,0,1]=4 24618 B12R1.354 CCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000210202 [0,2,0,0,0,0|1,0,1]=4 24619 B12R1.354 CCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000210202 [0,2,0,0,0,0|1,0,1]=4 24620 B12R1.354 CCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000210202 [0,2,0,0,0,0|1,0,1]=4 24621 B12R1.354 CCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000210202 [0,2,0,0,0,0|1,0,1]=4 24622 B12R1.354 CCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210202 [0,2,0,0,0,0|1,0,1]=4 24623 B12R1.354 CCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000210202 [0,2,0,0,0,0|1,0,1]=4 24624 B12R1.354 CCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210202 [0,2,0,0,0,0|1,0,1]=4 24625 B12R1.354 CCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210202 [0,2,0,0,0,0|1,0,1]=4 24626 B12R1.354 CCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210202 [0,2,0,0,0,0|1,0,1]=4 24627 B12R1.354 CCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210202 [0,2,0,0,0,0|1,0,1]=4 24628 B12R1.354 CCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210202 [0,2,0,0,0,0|1,0,1]=4 24629 B12R1.354 CCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000210202 [0,2,0,0,0,0|1,0,1]=4 24630 B12R1.354 CCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210202 [0,2,0,0,0,0|1,0,1]=4 24631 B12R1.354 CCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000210202 [0,2,0,0,0,0|1,0,1]=4 24632 B12R1.354 CCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210202 [0,2,0,0,0,0|1,0,1]=4 24633 B12R1.354 CCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210202 [0,2,0,0,0,0|1,0,1]=4 24634 B12R1.354 CCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210202 [0,2,0,0,0,0|1,0,1]=4 24635 B12R1.354 CCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000210202 [0,2,0,0,0,0|1,0,1]=4 24636 B12R1.354 CCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210202 [0,2,0,0,0,0|1,0,1]=4 24637 B12R1.354 CCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000210202 [0,2,0,0,0,0|1,0,1]=4 24638 B12R1.354 CCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210202 [0,2,0,0,0,0|1,0,1]=4 24639 B12R1.354 CCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210202 [0,2,0,0,0,0|1,0,1]=4 24640 B12R1.354 CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210202 [0,2,0,0,0,0|0,0,1]=3 24641 B12R1.354 CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210202 [0,2,0,0,0,0|0,0,1]=3 24642 B12R1.354 CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210202 [0,2,0,0,0,0|0,0,1]=3 24643 B12R1.354 CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210202 [0,2,0,0,0,0|0,0,1]=3 24644 B12R1.354 CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210202 [0,2,0,0,0,0|0,0,1]=3 24645 B12R1.354 CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210202 [0,2,0,0,0,0|0,0,1]=3 24646 B12R1.354 CCC(=O)c1cc(ccc1O)O 271570a_203496583355_100000183607 [0,2,0,0,0,0|0,0,1]=3 24647 B12R1.354 CCN(C)c1cc(ccc1Br)Cl 269982a_100020633006_100000204670 [0,2,0,0,0,0|2,0,0]=4 24648 B12R1.354 CCN(C)c1cc(ccc1Br)Cl 34a_100020633006_100000210202 [0,2,0,0,0,0|2,0,0]=4 24649 B12R1.354 CCN(C)c1cc(ccc1Br)F 2230a_100020633008_100000210202 [0,2,0,0,0,0|2,0,0]=4 24650 B12R1.354 CCN(C)c1cc(ccc1Br)F 269982a_100020633008_100000204670 [0,2,0,0,0,0|2,0,0]=4 24651 B12R1.354 CCN(C)c1cc(ccc1Br)F 34a_100020633008_100000210202 [0,2,0,0,0,0|2,0,0]=4 24652 B12R1.354 CCN(C)c1cc(ccc1C)Br 2230a_100020629602_100000210202 [0,2,0,0,0,0|2,0,0]=4 24653 B12R1.354 CCN(C)c1cc(ccc1C)Br 269982a_100020629602_100000204670 [0,2,0,0,0,0|2,0,0]=4 24654 B12R1.354 CCN(C)c1cc(ccc1C)Br 34a_100020629602_100000210202 [0,2,0,0,0,0|2,0,0]=4 24655 B12R1.354 CCN(C)c1cc(ccc1C)Br 38a_100020629602_100000204670 [0,2,0,0,0,0|2,0,0]=4 24656 B12R1.354 CCN(C)c1cc(ccc1C)C 2230a_100000743043_200000210301 [0,2,0,0,0,0|2,0,0]=4 24657 B12R1.354 CCN(C)c1cc(ccc1C)C 269982a_100000743043_200000210301 [0,2,0,0,0,0|2,0,0]=4 24658 B12R1.354 CCN(C)c1cc(ccc1C)C 34a_100000743043_200000210301 [0,2,0,0,0,0|2,0,0]=4 24659 B12R1.354 CCN(C)c1cc(ccc1C)C 7a_100000743043_200000210301 [0,2,0,0,0,0|2,0,0]=4 24660 B12R1.354 CCN(C)c1cc(ccc1C)Cl 2230a_100000221440_100000210202 [0,2,0,0,0,0|2,0,0]=4 24661 B12R1.354 CCN(C)c1cc(ccc1C)Cl 269982a_100000221440_100000204670 [0,2,0,0,0,0|2,0,0]=4 24662 B12R1.354 CCN(C)c1cc(ccc1C)Cl 34a_100000221440_100000210202 [0,2,0,0,0,0|2,0,0]=4 24663 B12R1.354 CCN(C)c1cc(ccc1C)Cl 38a_100000221440_100000204670 [0,2,0,0,0,0|2,0,0]=4 24664 B12R1.354 CCN(C)c1cc(ccc1C)F 2230a_114849113390_100000210202 [0,2,0,0,0,0|2,0,0]=4 24665 B12R1.354 CCN(C)c1cc(ccc1C)F 269982a_114849113390_100000204670 [0,2,0,0,0,0|2,0,0]=4 24666 B12R1.354 CCN(C)c1cc(ccc1C)F 34a_114849113390_100000210202 [0,2,0,0,0,0|2,0,0]=4 24667 B12R1.354 CCN(C)c1cc(ccc1C)F 38a_114849113390_100000204670 [0,2,0,0,0,0|2,0,0]=4 24668 B12R1.354 CCN(C)c1cc(ccc1C)O 269982a_100000211784_200000210301 [0,2,0,0,0,0|2,0,0]=4 24669 B12R1.354 CCN(C)c1cc(ccc1C)O 34a_100000211784_200000210301 [0,2,0,0,0,0|2,0,0]=4 24670 B12R1.354 CCN(C)c1cc(ccc1Cl)Br 269982a_100011772073_100000204670 [0,2,0,0,0,0|2,0,0]=4 24671 B12R1.354 CCN(C)c1cc(ccc1Cl)Br 34a_100011772073_100000210202 [0,2,0,0,0,0|2,0,0]=4 24672 B12R1.354 CCN(C)c1cc(ccc1Cl)Cl 269982a_100000742562_100000204670 [0,2,0,0,0,0|2,0,0]=4 24673 B12R1.354 CCN(C)c1cc(ccc1Cl)Cl 34a_100000742562_100000210202 [0,2,0,0,0,0|2,0,0]=4 24674 B12R1.354 CCN(C)c1cc(ccc1F)Br 2230a_100011314990_100000210202 [0,2,0,0,0,0|2,0,0]=4 24675 B12R1.354 CCN(C)c1cc(ccc1F)Br 269982a_100011314990_100000204670 [0,2,0,0,0,0|2,0,0]=4 24676 B12R1.354 CCN(C)c1cc(ccc1F)Br 34a_100011314990_100000210202 [0,2,0,0,0,0|2,0,0]=4 24677 B12R1.354 CCN(C)c1cc(ccc1F)Br 38a_100011314990_100000204670 [0,2,0,0,0,0|2,0,0]=4 24678 B12R1.354 CCN([13CH3])c1cc(ccc1C)C 2230a_100000743043_200025704644 [0,2,0,0,0,0|2,0,0]=4 24679 B12R1.354 CCN([13CH3])c1cc(ccc1C)C 269982a_100000743043_200025704644 [0,2,0,0,0,0|2,0,0]=4 24680 B12R1.354 CCN([13CH3])c1cc(ccc1C)C 34a_100000743043_200025704644 [0,2,0,0,0,0|2,0,0]=4 24681 B12R1.354 CCN([13CH3])c1cc(ccc1C)C 7a_100000743043_200025704644 [0,2,0,0,0,0|2,0,0]=4 24682 B12R1.354 CCN([13CH3])c1cc(ccc1C)O 269982a_100000211784_200025704644 [0,2,0,0,0,0|2,0,0]=4 24683 B12R1.354 CCN([13CH3])c1cc(ccc1C)O 34a_100000211784_200025704644 [0,2,0,0,0,0|2,0,0]=4 24684 B12R1.354 CNC(=O)c1cc(ccc1O)Br 1626a_100102657272_100000212140 [0,2,0,0,0,0|1,0,1]=4 24685 B12R1.354 CNC(=O)c1cc(ccc1O)Br 240690a_100102657272_100000212140 [0,2,0,0,0,0|1,0,1]=4 24686 B12R1.354 CNC(=O)c1cc(ccc1O)Br 527a_100102657272_100000212140 [0,2,0,0,0,0|1,0,1]=4 24687 B12R1.354 CNC(=O)c1cc(ccc1O)C 240690a_100102657272_100000229998 [0,2,0,0,0,0|1,0,1]=4 24688 B12R1.354 CNC(=O)c1cc(ccc1O)C 527a_100102657272_100000229998 [0,2,0,0,0,0|1,0,1]=4 24689 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 11a_106832991635_100000212143 [0,2,0,0,0,0|1,0,1]=4 24690 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 1626a_100102657272_100000212143 [0,2,0,0,0,0|1,0,1]=4 24691 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 240690a_100102657272_100000212143 [0,2,0,0,0,0|1,0,1]=4 24692 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 271570a_203496583355_200011279454 [0,2,0,0,0,0|1,0,1]=4 24693 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 527a_100102657272_100000212143 [0,2,0,0,0,0|1,0,1]=4 24694 B12R1.354 CNC(=O)c1cc(ccc1O)F 240690a_100102657272_100000742286 [0,2,0,0,0,0|1,0,1]=4 24695 B12R1.354 CNC(=O)c1cc(ccc1O)F 271570a_203496583355_200000206232 [0,2,0,0,0,0|1,0,1]=4 24696 B12R1.354 CNC(=O)c1cc(ccc1O)F 527a_100102657272_100000742286 [0,2,0,0,0,0|1,0,1]=4 24697 B12R1.354 CNC(=O)c1cc(ccc1O)I 240690a_100102657272_100000212111 [0,2,0,0,0,0|1,0,1]=4 24698 B12R1.354 CNC(=O)c1cc(ccc1O)I 527a_100102657272_100000212111 [0,2,0,0,0,0|1,0,1]=4 24699 B12R1.354 CNC(C)c1cc(ccc1Br)Br 269862a_106832991636_100011206948 [0,2,0,0,0,0|2,0,0]=4 24700 B12R1.354 CNC(C)c1cc(ccc1Br)C 269862a_106832991636_100012361225 [0,2,0,0,0,0|2,0,0]=4 24701 B12R1.354 CNC(C)c1cc(ccc1Br)Cl 269862a_106832991636_100012361343 [0,2,0,0,0,0|2,0,0]=4 24702 B12R1.354 CNC(C)c1cc(ccc1Br)F 2230a_100012343209_200000210301 [0,2,0,0,0,0|2,0,0]=4 24703 B12R1.354 CNC(C)c1cc(ccc1Br)F 269862a_106832991636_100012353695 [0,2,0,0,0,0|2,0,0]=4 24704 B12R1.354 CNC(C)c1cc(ccc1Br)F 34a_100012343209_200000210301 [0,2,0,0,0,0|2,0,0]=4 24705 B12R1.354 CNC(C)c1cc(ccc1C)Br 269862a_106832991636_100012706819 [0,2,0,0,0,0|2,0,0]=4 24706 B12R1.354 CNC(C)c1cc(ccc1C)C 269862a_106832991636_100000211711 [0,2,0,0,0,0|2,0,0]=4 24707 B12R1.354 CNC(C)c1cc(ccc1C)Cl 269862a_106832991636_100012002457 [0,2,0,0,0,0|2,0,0]=4 24708 B12R1.354 CNC(C)c1cc(ccc1C)F 2230a_100011191733_200000210301 [0,2,0,0,0,0|2,0,0]=4 24709 B12R1.354 CNC(C)c1cc(ccc1C)F 269862a_106832991636_100011220403 [0,2,0,0,0,0|2,0,0]=4 24710 B12R1.354 CNC(C)c1cc(ccc1C)F 34a_100011191733_200000210301 [0,2,0,0,0,0|2,0,0]=4 24711 B12R1.354 CNC(C)c1cc(ccc1Cl)Br 269862a_106832991636_100011934286 [0,2,0,0,0,0|2,0,0]=4 24712 B12R1.354 CNC(C)c1cc(ccc1Cl)Cl 2230a_100000737532_200000210301 [0,2,0,0,0,0|2,0,0]=4 24713 B12R1.354 CNC(C)c1cc(ccc1Cl)Cl 269862a_106832991636_100000184594 [0,2,0,0,0,0|2,0,0]=4 24714 B12R1.354 CNC(C)c1cc(ccc1Cl)Cl 34a_100000737532_200000210301 [0,2,0,0,0,0|2,0,0]=4 24715 B12R1.354 CNC(C)c1cc(ccc1Cl)F 269862a_106832991636_100011218795 [0,2,0,0,0,0|2,0,0]=4 24716 B12R1.354 CNC(C)c1cc(ccc1Cl)I 269862a_106832991636_100010712560 [0,2,0,0,0,0|2,0,0]=4 24717 B12R1.354 CNC(C)c1cc(ccc1F)Br 269862a_106832991636_100000689017 [0,2,0,0,0,0|2,0,0]=4 24718 B12R1.354 CNC(C)c1cc(ccc1F)C 269862a_106832991636_100000760338 [0,2,0,0,0,0|2,0,0]=4 24719 B12R1.354 CNC(C)c1cc(ccc1F)Cl 269862a_106832991636_100011218796 [0,2,0,0,0,0|2,0,0]=4 24720 B12R1.354 CNC(C)c1cc(ccc1F)F 2230a_100000737541_200000210301 [0,2,0,0,0,0|2,0,0]=4 24721 B12R1.354 CNC(C)c1cc(ccc1F)F 269862a_106832991636_100000185199 [0,2,0,0,0,0|2,0,0]=4 24722 B12R1.354 CNC(C)c1cc(ccc1F)F 34a_100000737541_200000210301 [0,2,0,0,0,0|2,0,0]=4 24723 B12R1.354 CNC(C)c1cc(ccc1F)I 269862a_106832991636_100010254839 [0,2,0,0,0,0|2,0,0]=4 24724 B12R1.354 CNC(C)c1cc(ccc1I)Br 269862a_106832991636_100012349576 [0,2,0,0,0,0|2,0,0]=4 24725 B12R1.354 CNC(C)c1cc(ccc1I)F 269862a_106832991636_100010200798 [0,2,0,0,0,0|2,0,0]=4 24726 B12R1.354 CNC(C)c1cc(ccc1O)Br 269862a_106832991636_100000212127 [0,2,0,0,0,0|1,0,0]=3 24727 B12R1.354 CNC(C)c1cc(ccc1O)C 269862a_106832991636_100000195442 [0,2,0,0,0,0|1,0,0]=3 24728 B12R1.354 CNC(C)c1cc(ccc1O)Cl 269862a_106832991636_100000185566 [0,2,0,0,0,0|1,0,0]=3 24729 B12R1.354 CNC(C)c1cc(ccc1O)F 269862a_106832991636_100000182812 [0,2,0,0,0,0|1,0,0]=3 24730 B12R1.354 CNC(C)c1cc(ccc1O)I 269862a_106832991636_100010712555 [0,2,0,0,0,0|1,0,0]=3 24731 B12R1.354 CN[C@@H](C)c1cc(ccc1C)C 2230a_100000695983_200000210301 [0,2,0,0,0,0|2,0,0]=4 24732 B12R1.354 CN[C@@H](C)c1cc(ccc1C)C 34a_100000695983_200000210301 [0,2,0,0,0,0|2,0,0]=4 24733 B12R1.354 CN[C@@H](C)c1cc(ccc1F)Cl 2230a_100000695052_200000210301 [0,2,0,0,0,0|2,0,0]=4 24734 B12R1.354 CN[C@@H](C)c1cc(ccc1F)Cl 34a_100000695052_200000210301 [0,2,0,0,0,0|2,0,0]=4 24735 B12R1.354 CN[C@@H](C)c1cc(ccc1O)F 2230a_100160469477_200000210301 [0,2,0,0,0,0|1,0,0]=3 24736 B12R1.354 CN[C@@H](C)c1cc(ccc1O)F 34a_100160469477_200000210301 [0,2,0,0,0,0|1,0,0]=3 24737 B12R1.354 CN[C@H](C)c1cc(ccc1O)Cl 2230a_100011853016_200000210301 [0,2,0,0,0,0|1,0,0]=3 24738 B12R1.354 CN[C@H](C)c1cc(ccc1O)Cl 34a_100011853016_200000210301 [0,2,0,0,0,0|1,0,0]=3 24739 B12R1.354 COC(=O)c1cc(ccc1O)Br 271570a_203496583355_100000148213 [0,2,0,0,0,0|1,0,1]=4 24740 B12R1.354 COC(=O)c1cc(ccc1O)C 271570a_203496583355_100012339458 [0,2,0,0,0,0|1,0,1]=4 24741 B12R1.354 COC(=O)c1cc(ccc1O)Cl 271570a_203496583355_100011294804 [0,2,0,0,0,0|1,0,1]=4 24742 B12R1.354 COC(=O)c1cc(ccc1O)F 271570a_203496583355_100000205820 [0,2,0,0,0,0|1,0,1]=4 24743 B12R1.354 COC(=O)c1cc(ccc1O)N 271570a_203496583355_100000696289 [0,2,0,0,0,0|1,0,1]=4 24744 B12R1.354 COC(=O)c1cc(ccc1O)O 271570a_203496583355_100000149868 [0,2,0,0,0,0|1,0,1]=4 24745 B12R1.354 COC(=O)c1cc(ccc1O)O 271570a_203496583355_100010230369 [0,2,0,0,0,0|1,0,1]=4 24746 B12R1.354 COC(C)c1cc(ccc1C)C 34a_200000246511_200000210301 [0,2,0,0,0,0|2,0,0]=4 24747 B12R1.354 COC(C)c1cc(ccc1C)C 7a_200000246511_200000210301 [0,2,0,0,0,0|2,0,0]=4 24748 B12R1.354 COC(C)c1cc(ccc1C)Cl 34a_100012002745_200000210301 [0,2,0,0,0,0|2,0,0]=4 24749 B12R1.354 COC(C)c1cc(ccc1C)Cl 7a_100012002745_200000210301 [0,2,0,0,0,0|2,0,0]=4 24750 B12R1.354 COC(C)c1cc(ccc1Cl)Cl 34a_100000742519_200000210301 [0,2,0,0,0,0|2,0,0]=4 24751 B12R1.354 COC(C)c1cc(ccc1Cl)Cl 7a_100000742519_200000210301 [0,2,0,0,0,0|2,0,0]=4 24752 B12R1.354 COC(C)c1cc(ccc1F)Br 34a_100011943926_200000210301 [0,2,0,0,0,0|2,0,0]=4 24753 B12R1.354 COC(C)c1cc(ccc1F)Br 7a_100011943926_200000210301 [0,2,0,0,0,0|2,0,0]=4 24754 B12R1.354 COC(C)c1cc(ccc1F)F 34a_100000246540_200000210301 [0,2,0,0,0,0|2,0,0]=4 24755 B12R1.354 COC(C)c1cc(ccc1F)F 7a_100000246540_200000210301 [0,2,0,0,0,0|2,0,0]=4 24756 B12R1.354 CO[C@@H](C)c1cc(ccc1I)F 34a_100134768474_200000210301 [0,2,0,0,0,0|2,0,0]=4 24757 B12R1.354 CO[C@@H](C)c1cc(ccc1I)F 7a_100134768474_200000210301 [0,2,0,0,0,0|2,0,0]=4 24758 B12R1.354 C[C@@H](N[13CH3])c1cc(ccc1O)Cl 2230a_100011853016_200025704644 [0,2,0,0,0,0|1,0,0]=3 24759 B12R1.354 C[C@@H](N[13CH3])c1cc(ccc1O)Cl 34a_100011853016_200025704644 [0,2,0,0,0,0|1,0,0]=3 24760 B12R1.354 C[C@H](N[13CH3])c1cc(ccc1F)Cl 2230a_100000695052_200025704644 [0,2,0,0,0,0|2,0,0]=4 24761 B12R1.354 C[C@H](N[13CH3])c1cc(ccc1F)Cl 34a_100000695052_200025704644 [0,2,0,0,0,0|2,0,0]=4 24762 B12R1.354 C[C@H](N[13CH3])c1cc(ccc1O)F 2230a_100160469477_200025704644 [0,2,0,0,0,0|1,0,0]=3 24763 B12R1.354 C[C@H](N[13CH3])c1cc(ccc1O)F 34a_100160469477_200025704644 [0,2,0,0,0,0|1,0,0]=3 24764 B12R1.354 C[C@H](O[13CH3])c1cc(ccc1I)F 34a_100134768474_200025704644 [0,2,0,0,0,0|2,0,0]=4 24765 B12R1.354 C[C@H](O[13CH3])c1cc(ccc1I)F 7a_100134768474_200025704644 [0,2,0,0,0,0|2,0,0]=4 24766 B12R1.354 Cc1ccc(c(c1)C(=O)CF)O 1458a_100000229998_100015361967 [0,2,0,0,0,0|1,0,1]=4 24767 B12R1.354 Cc1ccc(c(c1)C(C)O[13CH3])C 34a_200000246511_200025704644 [0,2,0,0,0,0|2,0,0]=4 24768 B12R1.354 Cc1ccc(c(c1)C(C)O[13CH3])C 7a_200000246511_200025704644 [0,2,0,0,0,0|2,0,0]=4 24769 B12R1.354 Cc1ccc(c(c1)[C@H](C)N[13CH3])C 2230a_100000695983_200025704644 [0,2,0,0,0,0|2,0,0]=4 24770 B12R1.354 Cc1ccc(c(c1)[C@H](C)N[13CH3])C 34a_100000695983_200025704644 [0,2,0,0,0,0|2,0,0]=4 24771 B12R1.354 Cc1ccc(cc1C(C)N[13CH3])F 2230a_100011191733_200025704644 [0,2,0,0,0,0|2,0,0]=4 24772 B12R1.354 Cc1ccc(cc1C(C)N[13CH3])F 34a_100011191733_200025704644 [0,2,0,0,0,0|2,0,0]=4 24773 B12R1.354 Cc1ccc(cc1C(C)O[13CH3])Cl 34a_100012002745_200025704644 [0,2,0,0,0,0|2,0,0]=4 24774 B12R1.354 Cc1ccc(cc1C(C)O[13CH3])Cl 7a_100012002745_200025704644 [0,2,0,0,0,0|2,0,0]=4 24775 B12R1.354 N[C@H](CO)c1cc(ccc1F)O 271570a_203496583355_100010142275 [0,2,0,0,0,0|2,0,0]=4 24776 B12R1.354 O=C(CF)c1cc(ccc1O)Br 1458a_100000212140_100015361967 [0,2,0,0,0,0|1,0,1]=4 24777 B12R1.354 O=C(CF)c1cc(ccc1O)Cl 1458a_100000212143_100015361967 [0,2,0,0,0,0|1,0,1]=4 24778 B12R1.354 O=C(CF)c1cc(ccc1O)F 1458a_100000742286_100015361967 [0,2,0,0,0,0|1,0,1]=4 24779 B12R1.354 O=C(CF)c1cc(ccc1O)I 1458a_100000212111_100015361967 [0,2,0,0,0,0|1,0,1]=4 24780 B12R1.354 O=C(CF)c1cc(ccc1O)O 1458a_100000758025_100015361967 [0,2,0,0,0,0|1,0,1]=4 24781 B12R1.195 CC(C)(C#N)c1ccccc1O 271570a_203496583355_100000716882 [0,2,0,0,0,0|1,0,1]=4 24782 B12R1.195 CC(C)(N[13CH3])c1ccccc1Br 2230a_100020606264_200025704644 [0,2,0,0,0,0|2,0,0]=4 24783 B12R1.195 CC(C)(N[13CH3])c1ccccc1Cl 2230a_100020606166_200025704644 [0,2,0,0,0,0|2,0,0]=4 24784 B12R1.195 CC(C)(N[13CH3])c1ccccc1Cl 34a_100020606166_200025704644 [0,2,0,0,0,0|2,0,0]=4 24785 B12R1.195 CC(C)(N[13CH3])c1ccccc1F 2230a_100000734538_200025704644 [0,2,0,0,0,0|2,0,0]=4 24786 B12R1.195 CC(C)(N[13CH3])c1ccccc1F 34a_100000734538_200025704644 [0,2,0,0,0,0|2,0,0]=4 24787 B12R1.195 CC(C)(O[13CH3])c1ccccc1Br 34a_100011346021_200025704644 [0,2,0,0,0,0|2,0,0]=4 24788 B12R1.195 CC(C)(O[13CH3])c1ccccc1Br 7a_100011346021_200025704644 [0,2,0,0,0,0|2,0,0]=4 24789 B12R1.195 CC(C)(O[13CH3])c1ccccc1Cl 34a_100000690508_200025704644 [0,2,0,0,0,0|2,0,0]=4 24790 B12R1.195 CC(C)(O[13CH3])c1ccccc1Cl 7a_100000690508_200025704644 [0,2,0,0,0,0|2,0,0]=4 24791 B12R1.195 CC(C)(O[13CH3])c1ccccc1F 34a_100011345963_200025704644 [0,2,0,0,0,0|2,0,0]=4 24792 B12R1.195 CC(C)(O[13CH3])c1ccccc1F 7a_100011345963_200025704644 [0,2,0,0,0,0|2,0,0]=4 24793 B12R1.195 CC(C)(O[13CH3])c1ccccc1I 34a_100010296449_200025704644 [0,2,0,0,0,0|2,0,0]=4 24794 B12R1.195 CC(C)(O[13CH3])c1ccccc1I 7a_100010296449_200025704644 [0,2,0,0,0,0|2,0,0]=4 24795 B12R1.195 CC(C)(O[13CH3])c1ccccc1N 7a_100000081495_200025704644 [0,2,0,0,0,0|2,0,0]=4 24796 B12R1.195 CCS(=O)(=O)c1cccnc1O 271570a_203496583355_100000702504 [0,2,0,0,0,0|2,0,0]=4 24797 B12R1.195 CNC(C)(C)c1ccccc1Br 2230a_100020606264_200000210301 [0,2,0,0,0,0|2,0,0]=4 24798 B12R1.195 CNC(C)(C)c1ccccc1Cl 2230a_100020606166_200000210301 [0,2,0,0,0,0|2,0,0]=4 24799 B12R1.195 CNC(C)(C)c1ccccc1Cl 34a_100020606166_200000210301 [0,2,0,0,0,0|2,0,0]=4 24800 B12R1.195 CNC(C)(C)c1ccccc1F 2230a_100000734538_200000210301 [0,2,0,0,0,0|2,0,0]=4 24801 B12R1.195 CNC(C)(C)c1ccccc1F 34a_100000734538_200000210301 [0,2,0,0,0,0|2,0,0]=4 24802 B12R1.195 CNC(F)(F)c1ccccc1F 2230a_106832991635_100000070671 [0,2,0,0,0,0|2,0,0]=4 24803 B12R1.195 CNC(F)(F)c1ccccc1F 34a_100102657272_100000070671 [0,2,0,0,0,0|2,0,0]=4 24804 B12R1.195 CNC(F)(F)c1ccccc1F 7a_106832991635_100000070671 [0,2,0,0,0,0|2,0,0]=4 24805 B12R1.195 CNS(=O)(=O)c1ccccc1O 271570a_203496583355_200000165157 [0,2,0,0,0,0|2,0,0]=4 24806 B12R1.195 COC(C)(C)c1ccccc1Br 34a_100011346021_200000210301 [0,2,0,0,0,0|2,0,0]=4 24807 B12R1.195 COC(C)(C)c1ccccc1Br 7a_100011346021_200000210301 [0,2,0,0,0,0|2,0,0]=4 24808 B12R1.195 COC(C)(C)c1ccccc1Cl 34a_100000690508_200000210301 [0,2,0,0,0,0|2,0,0]=4 24809 B12R1.195 COC(C)(C)c1ccccc1Cl 7a_100000690508_200000210301 [0,2,0,0,0,0|2,0,0]=4 24810 B12R1.195 COC(C)(C)c1ccccc1F 34a_100011345963_200000210301 [0,2,0,0,0,0|2,0,0]=4 24811 B12R1.195 COC(C)(C)c1ccccc1F 7a_100011345963_200000210301 [0,2,0,0,0,0|2,0,0]=4 24812 B12R1.195 COC(C)(C)c1ccccc1I 34a_100010296449_200000210301 [0,2,0,0,0,0|2,0,0]=4 24813 B12R1.195 COC(C)(C)c1ccccc1I 7a_100010296449_200000210301 [0,2,0,0,0,0|2,0,0]=4 24814 B12R1.195 COC(C)(C)c1ccccc1N 7a_100000081495_200000210301 [0,2,0,0,0,0|2,0,0]=4 24815 B12R1.195 COC(F)(F)c1ccccc1F 34a_100138415774_100000070671 [0,2,0,0,0,0|2,0,0]=4 24816 B12R1.195 CSC(F)(F)c1ccccc1F 62a_100000070671_200000210301 [0,2,0,0,0,0|2,0,0]=4 24817 B12R1.195 CSC(F)(F)c1ccccc1F 62a_200000210301_100000070671 [0,2,0,0,0,0|2,0,0]=4 24818 B12R1.195 [13CH3]SC(F)(F)c1ccccc1F 62a_100000070671_200025704644 [0,2,0,0,0,0|2,0,0]=4 24819 B12R1.195 [13CH3]SC(F)(F)c1ccccc1F 62a_200025704644_100000070671 [0,2,0,0,0,0|2,0,0]=4 24820 B12R1.243 CCC(NC)c1ccccc1C 269862a_106832991636_100011350723 [0,2,0,0,0,0|1,0,0]=3 24821 B12R1.243 CCC(NC)c1ccccc1Cl 269862a_106832991636_100011400563 [0,2,0,0,0,0|1,0,0]=3 24822 B12R1.243 CCC(NC)c1ccccc1F 269862a_106832991636_100000686739 [0,2,0,0,0,0|1,0,0]=3 24823 B12R1.243 CCC(NC)c1ncccc1C 2230a_200011536107_200000210301 [0,2,0,0,0,0|2,0,0]=4 24824 B12R1.243 CCC(NC)c1ncccc1C 269862a_106832991636_100000725274 [0,2,0,0,0,0|2,0,0]=4 24825 B12R1.243 CCC(N[13CH3])c1ncccc1C 2230a_200011536107_200025704644 [0,2,0,0,0,0|2,0,0]=4 24826 B12R1.243 CCC(OC)c1ccccc1F 34a_200011689290_200000210301 [0,2,0,0,0,0|1,0,0]=3 24827 B12R1.243 CCC(OC)c1ccccc1F 7a_200011689290_200000210301 [0,2,0,0,0,0|1,0,0]=3 24828 B12R1.243 CCC(O[13CH3])c1ccccc1F 34a_200011689290_200025704644 [0,2,0,0,0,0|1,0,0]=3 24829 B12R1.243 CCC(O[13CH3])c1ccccc1F 7a_200011689290_200025704644 [0,2,0,0,0,0|1,0,0]=3 24830 B12R1.243 CCN(CC)c1ccccc1Br 2230a_114873767003_100000210202 [0,2,0,0,0,0|2,0,0]=4 24831 B12R1.243 CCN(CC)c1ccccc1Br 269982a_114873767003_100000204670 [0,2,0,0,0,0|2,0,0]=4 24832 B12R1.243 CCN(CC)c1ccccc1Br 34a_114873767003_100000210202 [0,2,0,0,0,0|2,0,0]=4 24833 B12R1.243 CCN(CC)c1ccccc1C 2230a_100000211084_100000210202 [0,2,0,0,0,0|2,0,0]=4 24834 B12R1.243 CCN(CC)c1ccccc1C 269982a_100000211084_100000204670 [0,2,0,0,0,0|2,0,0]=4 24835 B12R1.243 CCN(CC)c1ccccc1C 34a_100000211084_100000210202 [0,2,0,0,0,0|2,0,0]=4 24836 B12R1.243 CCN(CC)c1ccccc1F 2230a_100000220365_100000210202 [0,2,0,0,0,0|2,0,0]=4 24837 B12R1.243 CCN(CC)c1ccccc1F 269982a_100000220365_100000204670 [0,2,0,0,0,0|2,0,0]=4 24838 B12R1.243 CCN(CC)c1ccccc1F 34a_100000220365_100000210202 [0,2,0,0,0,0|2,0,0]=4 24839 B12R1.243 CCN(CC)c1ccccc1O 269982a_103624766699_100000204670 [0,2,0,0,0,0|1,0,0]=3 24840 B12R1.243 CCN(CF)c1ccccc1Br 269982a_114873767003_100015361967 [0,2,0,0,0,0|2,0,0]=4 24841 B12R1.243 CCN(CF)c1ccccc1Br 34a_114873767003_100015361967 [0,2,0,0,0,0|2,0,0]=4 24842 B12R1.243 CCN(CF)c1ccccc1C 269982a_100000211084_100015361967 [0,2,0,0,0,0|2,0,0]=4 24843 B12R1.243 CCN(CF)c1ccccc1C 34a_100000211084_100015361967 [0,2,0,0,0,0|2,0,0]=4 24844 B12R1.243 CCN(CF)c1ccccc1F 269982a_100000220365_100015361967 [0,2,0,0,0,0|2,0,0]=4 24845 B12R1.243 CCN(CF)c1ccccc1F 34a_100000220365_100015361967 [0,2,0,0,0,0|2,0,0]=4 24846 B12R1.243 CCN(CF)c1ccccc1O 269982a_103624766699_100015361967 [0,2,0,0,0,0|1,0,0]=3 24847 B12R1.243 CC[C@H](NC)c1ccccc1Cl 2230a_200016987949_200000210301 [0,2,0,0,0,0|1,0,0]=3 24848 B12R1.243 CC[C@H](NC)c1ccccc1Cl 34a_200016987949_200000210301 [0,2,0,0,0,0|1,0,0]=3 24849 B12R1.243 CC[C@H](NC)c1ccccc1F 2230a_100015190424_200000210301 [0,2,0,0,0,0|1,0,0]=3 24850 B12R1.243 CC[C@H](NC)c1ccccc1F 34a_100015190424_200000210301 [0,2,0,0,0,0|1,0,0]=3 24851 B12R1.243 CC[C@H](N[13CH3])c1ccccc1Cl 2230a_200016987949_200025704644 [0,2,0,0,0,0|1,0,0]=3 24852 B12R1.243 CC[C@H](N[13CH3])c1ccccc1Cl 34a_200016987949_200025704644 [0,2,0,0,0,0|1,0,0]=3 24853 B12R1.243 CC[C@H](N[13CH3])c1ccccc1F 2230a_100015190424_200025704644 [0,2,0,0,0,0|1,0,0]=3 24854 B12R1.243 CC[C@H](N[13CH3])c1ccccc1F 34a_100015190424_200025704644 [0,2,0,0,0,0|1,0,0]=3 24855 B12R1.243 CNC(C#N)c1ccccc1C 2230a_102495364774_200000210301 [0,2,0,0,0,0|2,0,0]=4 24856 B12R1.243 CNC(CO)c1ccccc1Cl 2230a_100138412506_200000210301 [0,2,0,0,0,0|2,0,0]=4 24857 B12R1.243 CNC(CO)c1ccccc1Cl 34a_100138412506_200000210301 [0,2,0,0,0,0|2,0,0]=4 24858 B12R1.243 CN[C@@H](CO)c1ccccc1F 2230a_100009818778_200000210301 [0,2,0,0,0,0|2,0,0]=4 24859 B12R1.243 CN[C@@H](CO)c1ccccc1F 34a_100009818778_200000210301 [0,2,0,0,0,0|2,0,0]=4 24860 B12R1.243 CN[C@H](CO)c1ccccc1Br 2230a_100161155918_200000210301 [0,2,0,0,0,0|2,0,0]=4 24861 B12R1.243 CN[C@H](CO)c1ccccc1Br 34a_100161155918_200000210301 [0,2,0,0,0,0|2,0,0]=4 24862 B12R1.243 COC(C#N)c1ccccc1Cl 7a_200011294979_200000210301 [0,2,0,0,0,0|2,0,0]=4 24863 B12R1.243 COC(CN)c1ccccc1Br 34a_100011236429_200000210301 [0,2,0,0,0,0|2,0,0]=4 24864 B12R1.243 COC(CN)c1ccccc1Cl 34a_200000759403_200000210301 [0,2,0,0,0,0|2,0,0]=4 24865 B12R1.243 COC(OC)c1ccccc1O 271570a_203496583355_100010185899 [0,2,0,0,0,0|1,0,0]=3 24866 B12R1.243 CSC(C#N)c1ccccc1Br 62a_200000210301_200011581958 [0,2,0,0,0,0|2,0,0]=4 24867 B12R1.243 CSC(C#N)c1ccccc1Br 62a_200011581958_200000210301 [0,2,0,0,0,0|2,0,0]=4 24868 B12R1.243 Cc1ccccc1C(C#N)N[13CH3] 2230a_102495364774_200025704644 [0,2,0,0,0,0|2,0,0]=4 24869 B12R1.243 [13CH3]NC(CO)c1ccccc1Cl 2230a_100138412506_200025704644 [0,2,0,0,0,0|2,0,0]=4 24870 B12R1.243 [13CH3]NC(CO)c1ccccc1Cl 34a_100138412506_200025704644 [0,2,0,0,0,0|2,0,0]=4 24871 B12R1.243 [13CH3]N[C@@H](CO)c1ccccc1F 2230a_100009818778_200025704644 [0,2,0,0,0,0|2,0,0]=4 24872 B12R1.243 [13CH3]N[C@@H](CO)c1ccccc1F 34a_100009818778_200025704644 [0,2,0,0,0,0|2,0,0]=4 24873 B12R1.243 [13CH3]N[C@H](CO)c1ccccc1Br 2230a_100161155918_200025704644 [0,2,0,0,0,0|2,0,0]=4 24874 B12R1.243 [13CH3]N[C@H](CO)c1ccccc1Br 34a_100161155918_200025704644 [0,2,0,0,0,0|2,0,0]=4 24875 B12R1.243 [13CH3]OC(C#N)c1ccccc1Cl 7a_200011294979_200025704644 [0,2,0,0,0,0|2,0,0]=4 24876 B12R1.243 [13CH3]OC(CN)c1ccccc1Br 34a_100011236429_200025704644 [0,2,0,0,0,0|2,0,0]=4 24877 B12R1.243 [13CH3]OC(CN)c1ccccc1Cl 34a_200000759403_200025704644 [0,2,0,0,0,0|2,0,0]=4 24878 B12R1.243 [13CH3]SC(C#N)c1ccccc1Br 62a_200011581958_200025704644 [0,2,0,0,0,0|2,0,0]=4 24879 B12R1.243 [13CH3]SC(C#N)c1ccccc1Br 62a_200025704644_200011581958 [0,2,0,0,0,0|2,0,0]=4 24880 B12R1.3441 CC(N[13CH3])c1c(cccc1F)F 2230a_100025772709_200025704644 [0,2,0,0,0,0|2,0,0]=4 24881 B12R1.3441 CC(N[13CH3])c1c(cccc1F)F 34a_100025772709_200025704644 [0,2,0,0,0,0|2,0,0]=4 24882 B12R1.3441 CC(O[13CH3])c1c(cccc1Br)F 34a_100013085324_200025704644 [0,2,0,0,0,0|2,0,0]=4 24883 B12R1.3441 CC(O[13CH3])c1c(cccc1Br)F 7a_100013085324_200025704644 [0,2,0,0,0,0|2,0,0]=4 24884 B12R1.3441 CC(O[13CH3])c1c(cccc1Cl)Cl 34a_100011215154_200025704644 [0,2,0,0,0,0|2,0,0]=4 24885 B12R1.3441 CC(O[13CH3])c1c(cccc1Cl)Cl 7a_100011215154_200025704644 [0,2,0,0,0,0|2,0,0]=4 24886 B12R1.3441 CC(O[13CH3])c1c(cccc1F)F 34a_100000742607_200025704644 [0,2,0,0,0,0|2,0,0]=4 24887 B12R1.3441 CC(O[13CH3])c1c(cccc1F)F 7a_100000742607_200025704644 [0,2,0,0,0,0|2,0,0]=4 24888 B12R1.3441 CCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000210202 [0,2,0,0,0,0|1,0,1]=4 24889 B12R1.3441 CCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000210202 [0,2,0,0,0,0|1,0,1]=4 24890 B12R1.3441 CCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000210202 [0,2,0,0,0,0|1,0,1]=4 24891 B12R1.3441 CCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000210202 [0,2,0,0,0,0|1,0,1]=4 24892 B12R1.3441 CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000210202 [0,2,0,0,0,0|0,0,1]=3 24893 B12R1.3441 CCC(=O)c1c(cccc1C)C 1458a_100000758298_100000210202 [0,2,0,0,0,0|1,0,1]=4 24894 B12R1.3441 CCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000210202 [0,2,0,0,0,0|1,0,1]=4 24895 B12R1.3441 CCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000210202 [0,2,0,0,0,0|1,0,1]=4 24896 B12R1.3441 CCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000210202 [0,2,0,0,0,0|1,0,1]=4 24897 B12R1.3441 CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000210202 [0,2,0,0,0,0|0,0,1]=3 24898 B12R1.3441 CCC(=O)c1c(cccc1F)C 1458a_100000762013_100000210202 [0,2,0,0,0,0|1,0,1]=4 24899 B12R1.3441 CCC(=O)c1c(cccc1F)F 1458a_100000210804_100000210202 [0,2,0,0,0,0|1,0,1]=4 24900 B12R1.3441 CCC(=O)c1c(cccc1F)O 1458a_100000763259_100000210202 [0,2,0,0,0,0|0,0,1]=3 24901 B12R1.3441 CCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000210202 [0,2,0,0,0,0|1,0,1]=4 24902 B12R1.3441 CCC(=O)c1c(cccc1I)C 1458a_100000688020_100000210202 [0,2,0,0,0,0|1,0,1]=4 24903 B12R1.3441 CCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000210202 [0,2,0,0,0,0|1,0,1]=4 24904 B12R1.3441 CCC(=O)c1c(cccc1I)F 1458a_100000023732_100000210202 [0,2,0,0,0,0|1,0,1]=4 24905 B12R1.3441 CCC(=O)c1c(cccc1O)C 1458a_100011934116_100000210202 [0,2,0,0,0,0|0,0,1]=3 24906 B12R1.3441 CCC(=O)c1c(cccc1O)O 1458a_100000755285_100000210202 [0,2,0,0,0,0|0,0,1]=3 24907 B12R1.3441 CCN(C)c1c(cccc1C)C 2230a_100011645471_100000210202 [0,2,0,0,0,0|2,0,0]=4 24908 B12R1.3441 CCN(C)c1c(cccc1C)C 269982a_100011645471_100000204670 [0,2,0,0,0,0|2,0,0]=4 24909 B12R1.3441 CCN(C)c1c(cccc1C)C 34a_100011645471_100000210202 [0,2,0,0,0,0|2,0,0]=4 24910 B12R1.3441 CCN(C)c1c(cccc1Cl)Cl 269982a_100000691019_100000204670 [0,2,0,0,0,0|2,0,0]=4 24911 B12R1.3441 CCN(C)c1c(cccc1Cl)Cl 34a_100000691019_100000210202 [0,2,0,0,0,0|2,0,0]=4 24912 B12R1.3441 CCN(C)c1c(cccc1F)F 2230a_100000743377_100000210202 [0,2,0,0,0,0|2,0,0]=4 24913 B12R1.3441 CCN(C)c1c(cccc1F)F 269982a_100000743377_100000204670 [0,2,0,0,0,0|2,0,0]=4 24914 B12R1.3441 CCN(C)c1c(cccc1F)F 34a_100000743377_100000210202 [0,2,0,0,0,0|2,0,0]=4 24915 B12R1.3441 CCN(C)c1c(cccc1F)F 38a_100000743377_100000204670 [0,2,0,0,0,0|2,0,0]=4 24916 B12R1.3441 CNC(=O)c1c(cccc1Br)O 240690a_100102657272_100011935254 [0,2,0,0,0,0|1,0,1]=4 24917 B12R1.3441 CNC(=O)c1c(cccc1Br)O 527a_100102657272_100011935254 [0,2,0,0,0,0|1,0,1]=4 24918 B12R1.3441 CNC(=O)c1c(cccc1Cl)O 240690a_100102657272_100000745519 [0,2,0,0,0,0|1,0,1]=4 24919 B12R1.3441 CNC(=O)c1c(cccc1Cl)O 527a_100102657272_100000745519 [0,2,0,0,0,0|1,0,1]=4 24920 B12R1.3441 CNC(=O)c1c(cccc1F)O 271570a_203496583355_100012642803 [0,2,0,0,0,0|1,0,1]=4 24921 B12R1.3441 CNC(=O)c1c(cccc1F)O 527a_100102657272_100000763259 [0,2,0,0,0,0|1,0,1]=4 24922 B12R1.3441 CNC(=O)c1c(cccc1O)O 527a_100102657272_100000755285 [0,2,0,0,0,0|1,0,1]=4 24923 B12R1.3441 CNC(C)c1c(cccc1F)F 2230a_100025772709_200000210301 [0,2,0,0,0,0|2,0,0]=4 24924 B12R1.3441 CNC(C)c1c(cccc1F)F 34a_100025772709_200000210301 [0,2,0,0,0,0|2,0,0]=4 24925 B12R1.3441 CN[C@@H](C)c1c(cccc1C)C 2230a_100016987977_200000210301 [0,2,0,0,0,0|2,0,0]=4 24926 B12R1.3441 CN[C@@H](C)c1c(cccc1C)C 34a_100016987977_200000210301 [0,2,0,0,0,0|2,0,0]=4 24927 B12R1.3441 CN[C@H](C)c1c(cccc1Cl)Cl 2230a_100016989663_200000210301 [0,2,0,0,0,0|2,0,0]=4 24928 B12R1.3441 CN[C@H](C)c1c(cccc1Cl)Cl 34a_100016989663_200000210301 [0,2,0,0,0,0|2,0,0]=4 24929 B12R1.3441 CN[C@H](C)c1c(cccc1Cl)F 2230a_100011997870_200000210301 [0,2,0,0,0,0|2,0,0]=4 24930 B12R1.3441 CN[C@H](C)c1c(cccc1Cl)F 34a_100011997870_200000210301 [0,2,0,0,0,0|2,0,0]=4 24931 B12R1.3441 COC(=O)c1c(cccc1Br)O 271570a_203496583355_100010247157 [0,2,0,0,0,0|1,0,1]=4 24932 B12R1.3441 COC(=O)c1c(cccc1Cl)O 271570a_203496583355_100010150959 [0,2,0,0,0,0|1,0,1]=4 24933 B12R1.3441 COC(=O)c1c(cccc1F)O 271570a_203496583355_100000150693 [0,2,0,0,0,0|1,0,1]=4 24934 B12R1.3441 COC(=O)c1c(cccc1O)C 271570a_203496583355_100010204206 [0,2,0,0,0,0|1,0,1]=4 24935 B12R1.3441 COC(=O)c1c(cccc1O)N 271570a_203496583355_100010253892 [0,2,0,0,0,0|1,0,1]=4 24936 B12R1.3441 COC(C)c1c(cccc1Br)F 34a_100013085324_200000210301 [0,2,0,0,0,0|2,0,0]=4 24937 B12R1.3441 COC(C)c1c(cccc1Br)F 7a_100013085324_200000210301 [0,2,0,0,0,0|2,0,0]=4 24938 B12R1.3441 COC(C)c1c(cccc1C)C 34a_200000695261_200000210301 [0,2,0,0,0,0|2,0,0]=4 24939 B12R1.3441 COC(C)c1c(cccc1C)C 7a_200000695261_200000210301 [0,2,0,0,0,0|2,0,0]=4 24940 B12R1.3441 COC(C)c1c(cccc1Cl)Cl 34a_100011215154_200000210301 [0,2,0,0,0,0|2,0,0]=4 24941 B12R1.3441 COC(C)c1c(cccc1Cl)Cl 7a_100011215154_200000210301 [0,2,0,0,0,0|2,0,0]=4 24942 B12R1.3441 COC(C)c1c(cccc1F)F 34a_100000742607_200000210301 [0,2,0,0,0,0|2,0,0]=4 24943 B12R1.3441 COC(C)c1c(cccc1F)F 7a_100000742607_200000210301 [0,2,0,0,0,0|2,0,0]=4 24944 B12R1.3441 CO[C@H](C)c1c(cccc1Cl)F 34a_200012136785_200000210301 [0,2,0,0,0,0|2,0,0]=4 24945 B12R1.3441 CO[C@H](C)c1c(cccc1Cl)F 7a_200012136785_200000210301 [0,2,0,0,0,0|2,0,0]=4 24946 B12R1.3441 C[C@@H](N[13CH3])c1c(cccc1Cl)Cl 2230a_100016989663_200025704644 [0,2,0,0,0,0|2,0,0]=4 24947 B12R1.3441 C[C@@H](N[13CH3])c1c(cccc1Cl)Cl 34a_100016989663_200025704644 [0,2,0,0,0,0|2,0,0]=4 24948 B12R1.3441 C[C@@H](N[13CH3])c1c(cccc1Cl)F 2230a_100011997870_200025704644 [0,2,0,0,0,0|2,0,0]=4 24949 B12R1.3441 C[C@@H](N[13CH3])c1c(cccc1Cl)F 34a_100011997870_200025704644 [0,2,0,0,0,0|2,0,0]=4 24950 B12R1.3441 C[C@@H](O[13CH3])c1c(cccc1Cl)F 34a_200012136785_200025704644 [0,2,0,0,0,0|2,0,0]=4 24951 B12R1.3441 C[C@@H](O[13CH3])c1c(cccc1Cl)F 7a_200012136785_200025704644 [0,2,0,0,0,0|2,0,0]=4 24952 B12R1.3441 Cc1cccc(c1C(=O)CF)O 1458a_100011934116_100015361967 [0,2,0,0,0,0|1,0,1]=4 24953 B12R1.3441 Cc1cccc(c1C(C)O[13CH3])C 34a_200000695261_200025704644 [0,2,0,0,0,0|2,0,0]=4 24954 B12R1.3441 Cc1cccc(c1C(C)O[13CH3])C 7a_200000695261_200025704644 [0,2,0,0,0,0|2,0,0]=4 24955 B12R1.3441 Cc1cccc(c1[C@H](C)N[13CH3])C 2230a_100016987977_200025704644 [0,2,0,0,0,0|2,0,0]=4 24956 B12R1.3441 Cc1cccc(c1[C@H](C)N[13CH3])C 34a_100016987977_200025704644 [0,2,0,0,0,0|2,0,0]=4 24957 B12R1.3441 O=C(CF)c1c(cccc1Br)O 1458a_100011935254_100015361967 [0,2,0,0,0,0|1,0,1]=4 24958 B12R1.3441 O=C(CF)c1c(cccc1Cl)O 1458a_100000745519_100015361967 [0,2,0,0,0,0|1,0,1]=4 24959 B12R1.3441 O=C(CF)c1c(cccc1F)O 1458a_100000763259_100015361967 [0,2,0,0,0,0|1,0,1]=4 24960 B12R1.3441 O=C(CF)c1c(cccc1O)O 1458a_100000755285_100015361967 [0,2,0,0,0,0|1,0,1]=4 24961 B10R1.178 C=CC=CC(=O)C1CCC1 1458a_100016291481_100000749161 [0,0,1,1,0,0|0,0,2]=4 24962 B10R1.180 C=CC=CC(=O)CC1CC1 1458a_100016291481_100000742324 [0,0,1,1,0,0|0,0,2]=4 24963 B10R1.180 C=CC=CC(=O)NC1CC1 1626a_100000212008_100016291481 [0,0,1,1,0,0|1,0,1]=4 24964 B10R1.11 C=CCC(=O)C1=CCCC1 1458a_100000038896_100000210623 [0,0,1,1,0,0|0,0,2]=4 24965 B10R1.11 CNCC(=O)c1ccco1 7a_106832991635_100000211439 [0,0,1,1,0,0|2,0,0]=4 24966 B10R1.11 CSCC(=O)c1ccco1 62a_100000211439_200000210301 [0,0,1,1,0,0|2,0,0]=4 24967 B10R1.11 CSCC(=O)c1ccco1 62a_200000210301_100000211439 [0,0,1,1,0,0|2,0,0]=4 24968 B10R1.11 [13CH3]SCC(=O)c1ccco1 62a_100000211439_200025704644 [0,0,1,1,0,0|2,0,0]=4 24969 B10R1.11 [13CH3]SCC(=O)c1ccco1 62a_200025704644_100000211439 [0,0,1,1,0,0|2,0,0]=4 24970 B10R1.96 C=Cc1ccc(s1)CCC 271570a_100011290941_100010157708 [0,0,1,1,0,0|2,0,0]=4 24971 B10R1.96 CCSc1coc(c1)C=O 62a_100000210202_100000747035 [0,0,1,1,0,0|2,0,0]=4 24972 B10R1.96 CCSc1coc(c1)C=O 62a_100000747035_100000210202 [0,0,1,1,0,0|2,0,0]=4 24973 B10R1.21 CCCC=Cc1c[nH]cn1 271570a_100016258520_100000756875 [0,0,1,1,0,0|2,0,0]=4 24974 B10R1.21 CCCC=Cc1cc[nH]n1 271570a_100016258520_100000062575 [0,0,1,1,0,0|2,0,0]=4 24975 B10R1.21 CCCC=Cc1ccco1 271570a_100016258520_100009814098 [0,0,1,1,0,0|0,0,0]=2 24976 B10R1.21 CCCC=Cc1cccs1 271570a_100016258520_100011215356 [0,0,1,1,0,0|0,1,0]=3 24977 B10R1.21 CCCC=Cc1ccoc1 271570a_100016258520_100011215275 [0,0,1,1,0,0|2,0,0]=4 24978 B10R1.21 CCCC=Cc1ccsc1 271570a_100016258520_100000738268 [0,0,1,1,0,0|2,0,0]=4 24979 B10R1.21 CCCC=Cc1ccsn1 271570a_100016258520_100009818082 [0,0,1,1,0,0|2,0,0]=4 24980 B10R1.21 CCCC=Cc1cnco1 271570a_100016258520_100020591547 [0,0,1,1,0,0|1,0,0]=3 24981 B10R1.21 CCCC=Cc1cncs1 271570a_100016258520_100011934649 [0,0,1,1,0,0|1,1,0]=4 24982 B10R1.21 CCCC=Cc1cscn1 271570a_100016258520_100000751502 [0,0,1,1,0,0|2,0,0]=4 24983 B10R1.21 CCCC=Cc1ncc[nH]1 271570a_100016258520_100025796157 [0,0,1,1,0,0|2,0,0]=4 24984 B10R1.21 CCCC=Cc1ncco1 271570a_100016258520_100011787736 [0,0,1,1,0,0|1,0,0]=3 24985 B10R1.21 CCCC=Cc1nccs1 271570a_100016258520_100000211983 [0,0,1,1,0,0|1,1,0]=4 24986 B10R1.21 CCCCSc1ccco1 62a_100000210211_100009814098 [0,0,1,1,0,0|1,0,1]=4 24987 B10R1.21 CCCCSc1ccco1 62a_100009814098_100000210210 [0,0,1,1,0,0|1,0,1]=4 24988 B10R1.21 CCCNCc1ccco1 207a_100020643023_100000186105 [0,0,1,1,0,0|1,0,1]=4 24989 B10R1.21 CCCNCc1ccco1 2230a_100000185738_100000210303 [0,0,1,1,0,0|1,0,1]=4 24990 B10R1.21 CCCNCc1ccco1 270004a_100020643023_100000186105 [0,0,1,1,0,0|1,0,1]=4 24991 B10R1.21 CCCNCc1ccco1 34a_100000185738_100000210303 [0,0,1,1,0,0|1,0,1]=4 24992 B10R1.21 CCCOCc1ccco1 34a_100000210059_100000210303 [0,0,1,1,0,0|1,0,1]=4 24993 B10R1.21 CCNN=Cc1ccco1 4a_100000756455_100000186105 [0,0,1,1,0,0|2,0,0]=4 24994 B10R1.21 CCOC=Cc1ccco1 271570a_100016256518_100009814098 [0,0,1,1,0,0|1,0,0]=3 24995 B10R1.21 CCOC=Cc1cccs1 271570a_100016256518_100011215356 [0,0,1,1,0,0|1,1,0]=4 24996 B10R1.21 CCOC=Cc1cnco1 271570a_100016256518_100020591547 [0,0,1,1,0,0|2,0,0]=4 24997 B10R1.21 CCOC=Cc1ncco1 271570a_100016256518_100011787736 [0,0,1,1,0,0|2,0,0]=4 24998 B10R1.21 CNCC=Cc1ccco1 270004a_106832991635_100000185671 [0,0,1,1,0,0|1,0,0]=3 24999 B10R1.21 COCC=Cc1ccco1 271570a_100016286323_100009814098 [0,0,1,1,0,0|1,0,0]=3 25000 B10R1.21 COCC=Cc1cccs1 271570a_100016286323_100011215356 [0,0,1,1,0,0|1,1,0]=4 25001 B10R1.21 COCC=Cc1cnco1 271570a_100016286323_100020591547 [0,0,1,1,0,0|2,0,0]=4 25002 B10R1.21 COCC=Cc1ncco1 271570a_100016286323_100011787736 [0,0,1,1,0,0|2,0,0]=4 25003 B10R2.6 c1cc(ccn1)C2CC2 271570a_100011220607_100000035832 [1,0,0,1,0,0|1,0,0]=3 25004 B10R2.6 c1cc(cnn1)C2CC2 271570a_100011220607_100000732662 [1,0,0,1,0,0|2,0,0]=4 25005 B10R2.6 c1cc(ncn1)C2CC2 271570a_100011220607_100000703185 [1,0,0,1,0,0|2,0,0]=4 25006 B10R2.6 c1ccc(cc1)C2CC2 271570a_100011220607_100000210277 [1,0,0,1,0,0|0,0,0]=2 25007 B10R2.6 c1ccc(nc1)C2CC2 271570a_100011220607_100011216584 [1,0,0,1,0,0|1,0,0]=3 25008 B10R2.6 c1cnc(cn1)C2CC2 271570a_100011220607_100000758340 [1,0,0,1,0,0|2,0,0]=4 25009 B10R2.6 c1cnc(nc1)C2CC2 271570a_100011220607_100000211032 [1,0,0,1,0,0|2,0,0]=4 25010 B10R2.6 c1cncc(c1)C2CC2 271570a_100011220607_100000752921 [1,0,0,1,0,0|1,0,0]=3 25011 B10R2.6 c1cnnc(c1)C2CC2 271570a_100011220607_100016991348 [1,0,0,1,0,0|2,0,0]=4 25012 B10R2.6 c1ncc(cn1)C2CC2 271570a_100011220607_100011206942 [1,0,0,1,0,0|2,0,0]=4 25013 B10R2.21 Brc1ccsc1C2CC2 271570a_100011220607_100012361411 [0,0,0,1,1,0|2,0,0]=4 25014 B10R2.21 Brc1cscc1C2CC2 271570a_100011220607_100010143727 [0,0,0,1,1,0|2,0,0]=4 25015 B10R2.21 Cc1ccsc1C2CC2 271570a_100011220607_100000742657 [0,0,0,1,1,0|2,0,0]=4 25016 B10R2.21 Cc1cscc1C2CC2 271570a_100011220607_100000759966 [0,0,0,1,1,0|2,0,0]=4 25017 B10R2.21 Cc1sccc1C2CC2 271570a_100011220607_100000684487 [0,0,0,1,1,0|2,0,0]=4 25018 B10R2.21 Oc1c[nH]nc1C2CC2 271570a_203496583355_100011471633 [0,0,0,1,1,0|2,0,0]=4 25019 B10R2.21 Oc1sccc1C2CC2 271570a_203496583355_100010071141 [0,0,0,1,1,0|1,0,0]=3 25020 B10R2.32 Oc1cnc2n1CCC2 271570a_203496583355_100000717441 [0,0,0,1,1,0|2,0,0]=4 25021 B10R2.32 Oc1n[nH]c2c1CCC2 271570a_203496583355_100010892149 [0,0,0,1,1,0|2,0,0]=4 25022 B12R2.81 Cc1c(cccc1C2CC2)Br 271570a_100011220607_100012353703 [0,1,0,1,0,0|1,0,0]=3 25023 B12R2.81 Cc1c(cccc1C2CC2)Cl 271570a_100011220607_100000726075 [0,1,0,1,0,0|1,0,0]=3 25024 B12R2.81 Cc1c(cccc1C2CC2)F 271570a_100011220607_100011216893 [0,1,0,1,0,0|1,0,0]=3 25025 B12R2.81 Cc1c(cccc1C2CC2)N 271570a_100011220607_100000761887 [0,1,0,1,0,0|1,0,0]=3 25026 B12R2.81 Cc1c(cccc1C2CC2)O 271570a_100011220607_100012002258 [0,1,0,1,0,0|1,0,0]=3 25027 B12R2.81 Cc1c(ccnc1C2CC2)F 271570a_100011220607_100009846374 [0,1,0,1,0,0|2,0,0]=4 25028 B12R2.81 Cc1c(ccnc1C2CC2)N 271570a_100011220607_100009980296 [0,1,0,1,0,0|2,0,0]=4 25029 B12R2.81 Cc1c(ccnc1Cl)C2CC2 271570a_100011220607_100000047055 [0,1,0,1,0,0|2,0,0]=4 25030 B12R2.81 Cc1c(ccnc1F)C2CC2 271570a_100011220607_100010006593 [0,1,0,1,0,0|2,0,0]=4 25031 B12R2.81 Cc1c(ccnc1N)C2CC2 271570a_100011220607_100009865460 [0,1,0,1,0,0|2,0,0]=4 25032 B12R2.81 Cc1c(ccnc1O)C2CC2 271570a_100011220607_100009858498 [0,1,0,1,0,0|2,0,0]=4 25033 B12R2.81 Cc1c(cncc1C2CC2)Br 271570a_100011220607_100010109657 [0,1,0,1,0,0|2,0,0]=4 25034 B12R2.81 Cc1c(cncc1C2CC2)F 271570a_100011220607_100009881546 [0,1,0,1,0,0|2,0,0]=4 25035 B12R2.81 Cc1c(cncc1C2CC2)N 271570a_100011220607_100011998293 [0,1,0,1,0,0|2,0,0]=4 25036 B12R2.81 Cc1cccc(c1C)C2CC2 271570a_100011220607_100011214922 [0,1,0,1,0,0|1,0,0]=3 25037 B12R2.81 Cc1cccc(c1Cl)C2CC2 271570a_100011220607_200012352035 [0,1,0,1,0,0|1,0,0]=3 25038 B12R2.81 Cc1cccc(c1F)C2CC2 271570a_100011220607_100000717567 [0,1,0,1,0,0|1,0,0]=3 25039 B12R2.81 Cc1cccc(c1N)C2CC2 271570a_100011220607_100011834072 [0,1,0,1,0,0|1,0,0]=3 25040 B12R2.81 Cc1cccc(c1O)C2CC2 271570a_100011220607_100009817157 [0,1,0,1,0,0|0,0,0]=2 25041 B12R2.81 Cc1ccnc(c1C)C2CC2 271570a_100011220607_100009847204 [0,1,0,1,0,0|2,0,0]=4 25042 B12R2.81 Cc1ccnc(c1F)C2CC2 271570a_100011220607_100009817629 [0,1,0,1,0,0|2,0,0]=4 25043 B12R2.81 Cc1ccnc(c1N)C2CC2 271570a_100011220607_100000763560 [0,1,0,1,0,0|2,0,0]=4 25044 B12R2.81 Cc1ccnc(c1O)C2CC2 271570a_100011220607_100000696282 [0,1,0,1,0,0|1,0,0]=3 25045 B12R2.81 Cc1cncc(c1C)C2CC2 271570a_100011220607_100009864703 [0,1,0,1,0,0|2,0,0]=4 25046 B12R2.81 Cc1cncc(c1N)C2CC2 271570a_100011220607_100009818025 [0,1,0,1,0,0|2,0,0]=4 25047 B12R2.81 Cc1nccc(c1C)C2CC2 271570a_100011220607_100009846815 [0,1,0,1,0,0|2,0,0]=4 25048 B12R2.81 Cc1nccc(c1Cl)C2CC2 271570a_100011220607_100000698670 [0,1,0,1,0,0|2,0,0]=4 25049 B12R2.81 Cc1nccc(c1F)C2CC2 271570a_100011220607_100009849794 [0,1,0,1,0,0|2,0,0]=4 25050 B12R2.81 Cc1nccc(c1N)C2CC2 271570a_100011220607_100009885578 [0,1,0,1,0,0|2,0,0]=4 25051 B12R2.81 Clc1c(cccc1C2CC2)Br 271570a_100011220607_100010142854 [0,1,0,1,0,0|1,0,0]=3 25052 B12R2.81 Clc1cccc(c1Cl)C2CC2 271570a_100011220607_100011215384 [0,1,0,1,0,0|1,0,0]=3 25053 B12R2.81 Clc1nccc(c1Cl)C2CC2 271570a_100011220607_100010246212 [0,1,0,1,0,0|2,0,0]=4 25054 B12R2.81 Cn1c(cccc1=O)C2CC2 271570a_100011220607_100000726605 [0,1,0,1,0,0|2,0,0]=4 25055 B12R2.81 Cn1cccc(c1=O)C2CC2 271570a_100011220607_100000687173 [0,1,0,1,0,0|1,0,1]=4 25056 B12R2.81 Fc1c(cccc1C2CC2)Br 271570a_100011220607_100000702267 [0,1,0,1,0,0|1,0,0]=3 25057 B12R2.81 Fc1c(cccc1C2CC2)Cl 271570a_100011220607_100011217346 [0,1,0,1,0,0|1,0,0]=3 25058 B12R2.81 Fc1c(ccnc1Br)C2CC2 271570a_100011220607_200015269031 [0,1,0,1,0,0|2,0,0]=4 25059 B12R2.81 Fc1c(ccnc1Cl)C2CC2 271570a_100011220607_100010150473 [0,1,0,1,0,0|2,0,0]=4 25060 B12R2.81 Fc1cccc(c1Cl)C2CC2 271570a_100011220607_200010234923 [0,1,0,1,0,0|1,0,0]=3 25061 B12R2.81 Fc1cccc(c1F)C2CC2 271570a_100011220607_100000694657 [0,1,0,1,0,0|1,0,0]=3 25062 B12R2.81 Fc1nccc(c1Cl)C2CC2 271570a_100011220607_100010067886 [0,1,0,1,0,0|2,0,0]=4 25063 B12R2.81 Fc1nccc(c1F)C2CC2 271570a_100011220607_100010214882 [0,1,0,1,0,0|2,0,0]=4 25064 B12R2.81 Nc1c(cccc1C2CC2)Br 271570a_100011220607_100010146558 [0,1,0,1,0,0|1,0,0]=3 25065 B12R2.81 Nc1c(cccc1C2CC2)Cl 271570a_100011220607_100010190421 [0,1,0,1,0,0|1,0,0]=3 25066 B12R2.81 Nc1c(cccc1C2CC2)F 271570a_100011220607_100000042321 [0,1,0,1,0,0|1,0,0]=3 25067 B12R2.81 Nc1c(cccc1C2CC2)O 271570a_100011220607_100011934926 [0,1,0,1,0,0|1,0,0]=3 25068 B12R2.81 Nc1c(ccnc1C2CC2)O 271570a_100011220607_100000128729 [0,1,0,1,0,0|2,0,0]=4 25069 B12R2.81 Nc1c(cncc1C2CC2)Br 271570a_100011220607_100011290786 [0,1,0,1,0,0|2,0,0]=4 25070 B12R2.81 Nc1c(cncc1C2CC2)Cl 271570a_100011220607_100000684942 [0,1,0,1,0,0|2,0,0]=4 25071 B12R2.81 Nc1c(cncc1C2CC2)F 271570a_100011220607_100009880649 [0,1,0,1,0,0|2,0,0]=4 25072 B12R2.81 Nc1cccc(c1F)C2CC2 271570a_100011220607_100011935091 [0,1,0,1,0,0|1,0,0]=3 25073 B12R2.81 Nc1cccc(c1N)C2CC2 271570a_100011220607_100015191791 [0,1,0,1,0,0|1,0,0]=3 25074 B12R2.81 Nc1cccc(c1O)C2CC2 271570a_100011220607_100011934915 [0,1,0,1,0,0|0,0,0]=2 25075 B12R2.81 Nc1ccnc(c1F)C2CC2 271570a_100011220607_100015205195 [0,1,0,1,0,0|2,0,0]=4 25076 B12R2.81 Nc1ccnc(c1N)C2CC2 271570a_100011220607_100000085203 [0,1,0,1,0,0|2,0,0]=4 25077 B12R2.81 Nc1cncc(c1N)C2CC2 271570a_100011220607_100000694774 [0,1,0,1,0,0|2,0,0]=4 25078 B12R2.81 Nc1nccc(c1Cl)C2CC2 271570a_100011220607_100010735111 [0,1,0,1,0,0|2,0,0]=4 25079 B12R2.81 Nc1nccc(c1F)C2CC2 271570a_100011220607_100010077785 [0,1,0,1,0,0|2,0,0]=4 25080 B12R2.81 Nc1nccc(c1N)C2CC2 271570a_100011220607_100000124095 [0,1,0,1,0,0|2,0,0]=4 25081 B12R2.81 Oc1c(cccc1C2CC2)Br 271570a_100011220607_100010084509 [0,1,0,1,0,0|0,0,0]=2 25082 B12R2.81 Oc1c(cccc1C2CC2)Cl 271570a_100011220607_100010202889 [0,1,0,1,0,0|0,0,0]=2 25083 B12R2.81 Oc1c(cccc1C2CC2)F 271570a_100011220607_100009813666 [0,1,0,1,0,0|0,0,0]=2 25084 B12R2.81 Oc1c(ccnc1C2CC2)F 271570a_100011220607_100009867227 [0,1,0,1,0,0|1,0,0]=3 25085 B12R2.81 Oc1cccc(c1Br)C2CC2 271570a_100011220607_100010187914 [0,1,0,1,0,0|1,0,0]=3 25086 B12R2.81 Oc1cccc(c1Cl)C2CC2 271570a_100011220607_100000049636 [0,1,0,1,0,0|1,0,0]=3 25087 B12R2.81 Oc1cccc(c1F)C2CC2 271570a_100011220607_100009817021 [0,1,0,1,0,0|1,0,0]=3 25088 B12R2.81 Oc1cccc(c1O)C2CC2 271570a_100011220607_100009815950 [0,1,0,1,0,0|0,0,0]=2 25089 B12R2.81 Oc1cccc(c1O)C2CC2 271570a_203496583355_100010664954 [0,1,0,1,0,0|0,0,0]=2 25090 B12R2.81 Oc1ccnc(c1F)C2CC2 271570a_100011220607_100009876375 [0,1,0,1,0,0|2,0,0]=4 25091 B12R2.82 Nc1c(ccc2c1CCC2)O 271570a_203496583355_202495424074 [0,1,0,1,0,0|1,0,0]=3 25092 B12R2.82 Oc1ccc2c(c1F)CCN2 271570a_203496583355_100011013764 [0,1,0,1,0,0|2,0,0]=4 25093 B12R2.82 Oc1ccc2c(c1O)CCC2 271570a_203496583355_100010662108 [0,1,0,1,0,0|0,0,0]=2 25094 B12R2.202 CC1=Cc2cccc(c2C1)O 271570a_203496583355_100010271545 [0,1,0,1,0,0|0,0,1]=3 25095 B12R2.202 CN1Cc2cccc(c2C1)Br 2230a_100000703859_200000210301 [0,1,0,1,0,0|2,0,0]=4 25096 B12R2.202 CN1Cc2cccc(c2C1)Br 269982a_100000703859_200000210301 [0,1,0,1,0,0|2,0,0]=4 25097 B12R2.202 CN1Cc2cccc(c2C1)Br 34a_100000703859_200000210301 [0,1,0,1,0,0|2,0,0]=4 25098 B12R2.202 CN1Cc2cccc(c2C1)Cl 2230a_100000731892_200000210301 [0,1,0,1,0,0|2,0,0]=4 25099 B12R2.202 CN1Cc2cccc(c2C1)Cl 269982a_100000731892_200000210301 [0,1,0,1,0,0|2,0,0]=4 25100 B12R2.202 CN1Cc2cccc(c2C1)Cl 34a_100000731892_200000210301 [0,1,0,1,0,0|2,0,0]=4 25101 B12R2.202 CN1Cc2cccc(c2C1)F 269982a_100000051403_200000210301 [0,1,0,1,0,0|2,0,0]=4 25102 B12R2.202 CN1Cc2cccc(c2C1)F 34a_100000051403_200000210301 [0,1,0,1,0,0|2,0,0]=4 25103 B12R2.202 CN1Cc2cccc(c2C1)O 269982a_100015191671_200000210301 [0,1,0,1,0,0|1,0,0]=3 25104 B12R2.202 CN1Cc2cccc(c2C1)O 34a_100015191671_200000210301 [0,1,0,1,0,0|1,0,0]=3 25105 B12R2.202 Cc1cc2c(cccc2[nH]1)O 271570a_203496583355_100010143266 [0,1,0,1,0,0|0,0,2]=4 25106 B12R2.202 Cc1cccc2c1CN(C2)C 2230a_100020635169_200000210301 [0,1,0,1,0,0|2,0,0]=4 25107 B12R2.202 Cc1cccc2c1CN(C2)C 269982a_100020635169_200000210301 [0,1,0,1,0,0|2,0,0]=4 25108 B12R2.202 Cc1cccc2c1CN(C2)C 34a_100020635169_200000210301 [0,1,0,1,0,0|2,0,0]=4 25109 B12R2.202 Cc1cccc2c1CN(C2)[13CH3] 2230a_100020635169_200025704644 [0,1,0,1,0,0|2,0,0]=4 25110 B12R2.202 Cc1cccc2c1CN(C2)[13CH3] 269982a_100020635169_200025704644 [0,1,0,1,0,0|2,0,0]=4 25111 B12R2.202 Cc1cccc2c1CN(C2)[13CH3] 34a_100020635169_200025704644 [0,1,0,1,0,0|2,0,0]=4 25112 B12R2.202 Cc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012360556 [0,1,0,1,0,0|1,0,1]=4 25113 B12R2.202 Cc1nc2c(cccc2o1)O 271570a_203496583355_100010883239 [0,1,0,1,0,0|1,0,1]=4 25114 B12R2.202 Cc1nc2c(cccc2s1)O 271570a_203496583355_100010236672 [0,1,0,1,0,0|1,0,1]=4 25115 B12R2.202 Cc1nc2cccc(c2o1)O 271570a_203496583355_100010168998 [0,1,0,1,0,0|1,0,1]=4 25116 B12R2.202 Cc1nc2cccc(c2s1)O 271570a_203496583355_100010236699 [0,1,0,1,0,0|1,0,1]=4 25117 B12R2.202 Cn1cc2c(cccc2n1)O 271570a_203496583355_100009817162 [0,1,0,1,0,0|1,0,1]=4 25118 B12R2.202 Cn1cc2cccc(c2n1)O 271570a_203496583355_100009817170 [0,1,0,1,0,0|2,0,0]=4 25119 B12R2.202 O=C1Cc2c(cccc2N1)O 271570a_203496583355_100009816812 [0,1,0,1,0,0|1,0,1]=4 25120 B12R2.202 O=C1Cc2cccc(c2C1)O 271570a_203496583355_100010205903 [0,1,0,1,0,0|0,0,1]=3 25121 B12R2.202 O=C1Cc2cccc(c2N1)O 271570a_203496583355_100000767046 [0,1,0,1,0,0|1,0,1]=4 25122 B12R2.202 Oc1cccc2c1CC(C2)O 271570a_203496583355_100010752598 [0,1,0,1,0,0|0,0,0]=2 25123 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Br 2230a_100000703859_200025704644 [0,1,0,1,0,0|2,0,0]=4 25124 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Br 269982a_100000703859_200025704644 [0,1,0,1,0,0|2,0,0]=4 25125 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Br 34a_100000703859_200025704644 [0,1,0,1,0,0|2,0,0]=4 25126 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Cl 2230a_100000731892_200025704644 [0,1,0,1,0,0|2,0,0]=4 25127 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Cl 269982a_100000731892_200025704644 [0,1,0,1,0,0|2,0,0]=4 25128 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Cl 34a_100000731892_200025704644 [0,1,0,1,0,0|2,0,0]=4 25129 B12R2.202 [13CH3]N1Cc2cccc(c2C1)F 269982a_100000051403_200025704644 [0,1,0,1,0,0|2,0,0]=4 25130 B12R2.202 [13CH3]N1Cc2cccc(c2C1)F 34a_100000051403_200025704644 [0,1,0,1,0,0|2,0,0]=4 25131 B12R2.202 [13CH3]N1Cc2cccc(c2C1)O 269982a_100015191671_200025704644 [0,1,0,1,0,0|1,0,0]=3 25132 B12R2.202 [13CH3]N1Cc2cccc(c2C1)O 34a_100015191671_200025704644 [0,1,0,1,0,0|1,0,0]=3 25133 B12R2.1081 Oc1cccc2c1CCCC2 271570a_203496583355_100012354034 [0,1,0,1,0,0|0,0,0]=2 25134 B12R2.1081 Oc1cccc2c1CCCN2 271570a_203496583355_100010196365 [0,1,0,1,0,0|0,0,0]=2 25135 B12R2.1081 Oc1cccc2c1CCCO2 271570a_203496583355_100010188023 [0,1,0,1,0,0|0,0,0]=2 25136 B12R2.1081 Oc1cccc2c1CCN=C2 271570a_203496583355_100010982778 [0,1,0,1,0,0|0,0,1]=3 25137 B12R2.1081 Oc1cccc2c1CCNC2 271570a_203496583355_100000756787 [0,1,0,1,0,0|0,0,0]=2 25138 B12R2.1081 Oc1cccc2c1CNCC2 271570a_203496583355_100000687140 [0,1,0,1,0,0|0,0,0]=2 25139 B12R2.1081 Oc1cccc2c1NCCO2 271570a_203496583355_100015018771 [0,1,0,1,0,0|1,0,0]=3 25140 B12R2.1081 Oc1cccc2c1OCCC2 271570a_203496583355_100010204675 [0,1,0,1,0,0|0,0,0]=2 25141 B12R2.1081 Oc1cccc2c1OCCN2 271570a_203496583355_100000726803 [0,1,0,1,0,0|1,0,0]=3 25142 B12R2.1081 Oc1cccc2c1OCCO2 271570a_203496583355_100009815980 [0,1,0,1,0,0|1,0,0]=3 25143 B12R2.1081 Oc1nccc2c1NCCO2 271570a_203496583355_100009829486 [0,1,0,1,0,0|2,0,0]=4 25144 B12R2.1081 Oc1ncnc2c1CCCC2 271570a_203496583355_100011467579 [0,1,0,1,0,0|2,0,0]=4 25145 B12R2.24 CN1CCc2ccccc2C1 2230a_100000188457_200000210301 [0,1,0,1,0,0|1,0,0]=3 25146 B12R2.24 CN1CCc2ccccc2C1 269982a_100000188457_200000210301 [0,1,0,1,0,0|1,0,0]=3 25147 B12R2.24 CN1CCc2ccccc2C1 34a_100000188457_200000210301 [0,1,0,1,0,0|1,0,0]=3 25148 B12R2.24 CN1CCc2cccnc2C1 2230a_100015206102_200000210301 [0,1,0,1,0,0|2,0,0]=4 25149 B12R2.24 CN1CCc2cccnc2C1 269982a_100015206102_200000210301 [0,1,0,1,0,0|2,0,0]=4 25150 B12R2.24 CN1CCc2ccncc2C1 2230a_100015190008_200000210301 [0,1,0,1,0,0|2,0,0]=4 25151 B12R2.24 CN1CCc2ccncc2C1 269982a_100015190008_200000210301 [0,1,0,1,0,0|2,0,0]=4 25152 B12R2.24 CN1CCc2cnccc2C1 2230a_100020645890_200000210301 [0,1,0,1,0,0|2,0,0]=4 25153 B12R2.24 CN1CCc2cnccc2C1 269982a_100020645890_200000210301 [0,1,0,1,0,0|2,0,0]=4 25154 B12R2.24 CN1CCc2ncccc2C1 2230a_100000699647_200000210301 [0,1,0,1,0,0|2,0,0]=4 25155 B12R2.24 CN1CCc2ncccc2C1 269982a_100000699647_200000210301 [0,1,0,1,0,0|2,0,0]=4 25156 B12R2.24 Oc1ccc2c(c1)CCCC2 271570a_203496583355_100011221367 [0,1,0,1,0,0|1,0,0]=3 25157 B12R2.24 Oc1ccc2c(c1)CCCN2 271570a_203496583355_100016994925 [0,1,0,1,0,0|1,0,0]=3 25158 B12R2.24 Oc1ccc2c(c1)CCCO2 271570a_203496583355_100011393166 [0,1,0,1,0,0|0,0,0]=2 25159 B12R2.24 Oc1ccc2c(c1)CCNC2 271570a_203496583355_100000686056 [0,1,0,1,0,0|2,0,0]=4 25160 B12R2.24 Oc1ccc2c(c1)CNCC2 271570a_203496583355_100015189961 [0,1,0,1,0,0|2,0,0]=4 25161 B12R2.24 Oc1ccc2c(c1)COCC2 271570a_203496583355_100010128096 [0,1,0,1,0,0|2,0,0]=4 25162 B12R2.24 Oc1ccc2c(c1)NCCC2 271570a_203496583355_100010196366 [0,1,0,1,0,0|1,0,0]=3 25163 B12R2.24 Oc1ccc2c(c1)NCCO2 271570a_203496583355_100000708519 [0,1,0,1,0,0|1,0,0]=3 25164 B12R2.24 Oc1ccc2c(c1)NCCS2 271570a_203496583355_100013243616 [0,1,0,1,0,0|1,1,0]=4 25165 B12R2.24 Oc1ccc2c(c1)OCCC2 271570a_203496583355_100010700467 [0,1,0,1,0,0|0,0,0]=2 25166 B12R2.24 Oc1ccc2c(c1)OCCN2 271570a_203496583355_100012355470 [0,1,0,1,0,0|1,0,0]=3 25167 B12R2.24 Oc1ccc2c(c1)OCCO2 271570a_203496583355_100000184379 [0,1,0,1,0,0|1,0,0]=3 25168 B12R2.24 Oc1ccc2c(n1)CCCC2 271570a_203496583355_100000046135 [0,1,0,1,0,0|2,0,0]=4 25169 B12R2.24 Oc1ccc2c(n1)CCCN2 271570a_203496583355_100010277722 [0,1,0,1,0,0|2,0,0]=4 25170 B12R2.24 Oc1ccc2c(n1)NCCC2 271570a_203496583355_100009952728 [0,1,0,1,0,0|2,0,0]=4 25171 B12R2.24 Oc1ccc2c(n1)NCCO2 271570a_203496583355_100010209492 [0,1,0,1,0,0|2,0,0]=4 25172 B12R2.24 Oc1cnc2c(c1)CCCC2 271570a_203496583355_100010236098 [0,1,0,1,0,0|2,0,0]=4 25173 B12R2.24 Oc1cnc2c(c1)CCCO2 271570a_203496583355_100010109689 [0,1,0,1,0,0|1,0,0]=3 25174 B12R2.24 Oc1cnc2c(c1)NCCO2 271570a_203496583355_100000700286 [0,1,0,1,0,0|2,0,0]=4 25175 B12R2.24 Oc1cnc2c(c1)OCCN2 271570a_203496583355_100009816924 [0,1,0,1,0,0|2,0,0]=4 25176 B12R2.24 [13CH3]N1CCc2ccccc2C1 2230a_100000188457_200025704644 [0,1,0,1,0,0|1,0,0]=3 25177 B12R2.24 [13CH3]N1CCc2ccccc2C1 269982a_100000188457_200025704644 [0,1,0,1,0,0|1,0,0]=3 25178 B12R2.24 [13CH3]N1CCc2ccccc2C1 34a_100000188457_200025704644 [0,1,0,1,0,0|1,0,0]=3 25179 B12R2.24 [13CH3]N1CCc2cccnc2C1 2230a_100015206102_200025704644 [0,1,0,1,0,0|2,0,0]=4 25180 B12R2.24 [13CH3]N1CCc2cccnc2C1 269982a_100015206102_200025704644 [0,1,0,1,0,0|2,0,0]=4 25181 B12R2.24 [13CH3]N1CCc2ccncc2C1 2230a_100015190008_200025704644 [0,1,0,1,0,0|2,0,0]=4 25182 B12R2.24 [13CH3]N1CCc2ccncc2C1 269982a_100015190008_200025704644 [0,1,0,1,0,0|2,0,0]=4 25183 B12R2.24 [13CH3]N1CCc2cnccc2C1 2230a_100020645890_200025704644 [0,1,0,1,0,0|2,0,0]=4 25184 B12R2.24 [13CH3]N1CCc2cnccc2C1 269982a_100020645890_200025704644 [0,1,0,1,0,0|2,0,0]=4 25185 B12R2.24 [13CH3]N1CCc2ncccc2C1 2230a_100000699647_200025704644 [0,1,0,1,0,0|2,0,0]=4 25186 B12R2.24 [13CH3]N1CCc2ncccc2C1 269982a_100000699647_200025704644 [0,1,0,1,0,0|2,0,0]=4 25187 B12R2.32 CCN1Cc2ccccc2C1 2230a_100000752595_100000210202 [0,1,0,1,0,0|1,0,0]=3 25188 B12R2.32 CCN1Cc2ccccc2C1 269982a_100000752595_100000204670 [0,1,0,1,0,0|1,0,0]=3 25189 B12R2.32 CCN1Cc2ccccc2C1 34a_100000752595_100000210202 [0,1,0,1,0,0|1,0,0]=3 25190 B12R2.32 CCN1Cc2cccnc2C1 269982a_100000726175_100000204670 [0,1,0,1,0,0|2,0,0]=4 25191 B12R2.32 CCN1Cc2ccncc2C1 2230a_100000730608_100000210202 [0,1,0,1,0,0|2,0,0]=4 25192 B12R2.32 CCN1Cc2ccncc2C1 269982a_100000730608_100000204670 [0,1,0,1,0,0|2,0,0]=4 25193 B12R2.32 CNC1Cc2ccccc2C1 2230a_100000753258_200000210301 [0,1,0,1,0,0|1,0,0]=3 25194 B12R2.32 CNC1Cc2ccccc2C1 34a_100000753258_200000210301 [0,1,0,1,0,0|1,0,0]=3 25195 B12R2.32 CNC1Cc2ccccc2C1 34a_100102657272_100000753484 [0,1,0,1,0,0|1,0,0]=3 25196 B12R2.32 CNC1Cc2ccccc2C1 7a_106832991635_100000753484 [0,1,0,1,0,0|1,0,0]=3 25197 B12R2.32 COC1Cc2ccccc2C1 34a_100011215286_200000210301 [0,1,0,1,0,0|1,0,0]=3 25198 B12R2.32 COC1Cc2ccccc2C1 34a_100138415774_100000753484 [0,1,0,1,0,0|1,0,0]=3 25199 B12R2.32 CSC1Cc2ccccc2C1 62a_200000210301_100000753484 [0,1,0,1,0,0|1,0,0]=3 25200 B12R2.32 CSc1cc2ccccc2o1 62a_200000210301_100010159458 [0,1,0,1,0,0|0,0,2]=4 25201 B12R2.32 FCN1Cc2ccccc2C1 269982a_100000752595_100015361967 [0,1,0,1,0,0|2,0,0]=4 25202 B12R2.32 FCN1Cc2ccccc2C1 34a_100000752595_100015361967 [0,1,0,1,0,0|2,0,0]=4 25203 B12R2.32 [13CH3]NC1Cc2ccccc2C1 2230a_100000753258_200025704644 [0,1,0,1,0,0|1,0,0]=3 25204 B12R2.32 [13CH3]NC1Cc2ccccc2C1 34a_100000753258_200025704644 [0,1,0,1,0,0|1,0,0]=3 25205 B12R2.32 [13CH3]OC1Cc2ccccc2C1 34a_100011215286_200025704644 [0,1,0,1,0,0|1,0,0]=3 25206 B12R2.32 [13CH3]SC1Cc2ccccc2C1 62a_200025704644_100000753484 [0,1,0,1,0,0|1,0,0]=3 25207 B12R2.32 [13CH3]Sc1cc2ccccc2o1 62a_200025704644_100010159458 [0,1,0,1,0,0|0,0,2]=4 25208 B12R2.196 Cc1c[nH]c2c1cccc2O 271570a_203496583355_100010186758 [0,1,0,1,0,0|0,0,2]=4 25209 B12R2.196 Cc1n[nH]c2c1cccc2O 271570a_203496583355_100010255084 [0,1,0,1,0,0|1,0,1]=4 25210 B12R2.196 Cn1ccc2c1cccc2O 271570a_203496583355_200011934935 [0,1,0,1,0,0|0,0,2]=4 25211 B12R2.196 Cn1cnc2c1cccc2O 271570a_203496583355_100000696766 [0,1,0,1,0,0|1,0,1]=4 25212 B12R2.196 Cn1ncc2c1cccc2O 271570a_203496583355_100009817161 [0,1,0,1,0,0|1,0,1]=4 25213 B12R2.196 NC1CCc2c1cccc2O 271570a_203496583355_100000751068 [0,1,0,1,0,0|0,0,0]=2 25214 B12R2.196 NC1COc2c1cccc2O 271570a_203496583355_100025715106 [0,1,0,1,0,0|1,0,0]=3 25215 B12R2.196 O=C1CCc2c1cccc2O 271570a_203496583355_100000744605 [0,1,0,1,0,0|0,0,1]=3 25216 B12R2.196 O=C1COc2c1cccc2O 271570a_203496583355_100011230590 [0,1,0,1,0,0|1,0,1]=4 25217 B12R2.196 O=C1NCc2c1cccc2O 271570a_203496583355_100000688282 [0,1,0,1,0,0|1,0,1]=4 25218 B12R2.196 O=C1OCc2c1cccc2O 271570a_203496583355_100010167076 [0,1,0,1,0,0|1,0,1]=4 25219 B12R2.196 Oc1cccc2c1CC[C@@H]2O 271570a_203496583355_100010080924 [0,1,0,1,0,0|0,0,0]=2 25220 B12R2.196 Oc1ccnc2c1CCC2O 271570a_203496583355_100009868430 [0,1,0,1,0,0|1,0,0]=3 25221 B12R2.225 Brc1ccccc1NC2CC2 34a_100000210017_100000211595 [0,1,0,1,0,0|1,0,0]=3 25222 B12R2.225 Brc1ccccc1OC2CC2 34a_100000181306_100000211595 [0,1,0,1,0,0|1,0,0]=3 25223 B12R2.225 Brc1ccccc1SC2CC2 62a_100000695589_100000211595 [0,1,0,1,0,0|1,0,0]=3 25224 B12R2.225 Brc1cccnc1NC2CC2 27a_100000212008_100000696092 [0,1,0,1,0,0|2,0,0]=4 25225 B12R2.225 Brc1cccnc1SC2CC2 62a_100000696092_100000211595 [0,1,0,1,0,0|2,0,0]=4 25226 B12R2.225 Brc1ccncc1SC2CC2 62a_100010138639_100000211595 [0,1,0,1,0,0|2,0,0]=4 25227 B12R2.225 Brc1cnccc1NC2CC2 27a_100000212008_100000726257 [0,1,0,1,0,0|2,0,0]=4 25228 B12R2.225 Brc1cnccc1OC2CC2 34a_100011996408_100000211595 [0,1,0,1,0,0|2,0,0]=4 25229 B12R2.225 Brc1cnccc1SC2CC2 62a_100000726257_100000211595 [0,1,0,1,0,0|2,0,0]=4 25230 B12R2.225 Brc1ncccc1OC2CC2 34a_100000744436_100000211595 [0,1,0,1,0,0|2,0,0]=4 25231 B12R2.225 Brc1ncccc1SC2CC2 62a_100010202626_100000211595 [0,1,0,1,0,0|2,0,0]=4 25232 B12R2.225 Cc1ccccc1NC2CC2 34a_100015192222_100000211595 [0,1,0,1,0,0|1,0,0]=3 25233 B12R2.225 Cc1ccccc1OC2CC2 34a_100000210338_100000211595 [0,1,0,1,0,0|1,0,0]=3 25234 B12R2.225 Cc1ccccc1SC2CC2 62a_100000210755_100000211595 [0,1,0,1,0,0|1,0,0]=3 25235 B12R2.225 Cc1cccnc1SC2CC2 62a_100000751373_100000211595 [0,1,0,1,0,0|2,0,0]=4 25236 B12R2.225 Cc1ccncc1OC2CC2 34a_100011997053_100000211595 [0,1,0,1,0,0|2,0,0]=4 25237 B12R2.225 Cc1ccncc1SC2CC2 62a_100000761580_100000211595 [0,1,0,1,0,0|2,0,0]=4 25238 B12R2.225 Cc1cnccc1NC2CC2 27a_100000212008_100000765111 [0,1,0,1,0,0|2,0,0]=4 25239 B12R2.225 Cc1cnccc1OC2CC2 34a_100000694293_100000211595 [0,1,0,1,0,0|2,0,0]=4 25240 B12R2.225 Cc1cnccc1SC2CC2 62a_100000765111_100000211595 [0,1,0,1,0,0|2,0,0]=4 25241 B12R2.225 Cc1ncccc1OC2CC2 34a_100000745507_100000211595 [0,1,0,1,0,0|2,0,0]=4 25242 B12R2.225 Cc1ncccc1SC2CC2 62a_100000751574_100000211595 [0,1,0,1,0,0|2,0,0]=4 25243 B12R2.225 Clc1ccccc1NC2CC2 34a_100000185783_100000211595 [0,1,0,1,0,0|1,0,0]=3 25244 B12R2.225 Clc1ccccc1OC2CC2 34a_100000210172_100000211595 [0,1,0,1,0,0|1,0,0]=3 25245 B12R2.225 Clc1ccccc1SC2CC2 62a_100000764095_100000211595 [0,1,0,1,0,0|1,0,0]=3 25246 B12R2.225 Clc1cccnc1OC2CC2 34a_100011290957_100000211595 [0,1,0,1,0,0|2,0,0]=4 25247 B12R2.225 Clc1cccnc1SC2CC2 62a_100011356963_100000211595 [0,1,0,1,0,0|2,0,0]=4 25248 B12R2.225 Clc1ccncc1OC2CC2 34a_100011996695_100000211595 [0,1,0,1,0,0|2,0,0]=4 25249 B12R2.225 Clc1ccncc1SC2CC2 62a_100009995489_100000211595 [0,1,0,1,0,0|2,0,0]=4 25250 B12R2.225 Clc1cnccc1OC2CC2 34a_100011997054_100000211595 [0,1,0,1,0,0|2,0,0]=4 25251 B12R2.225 Clc1cnccc1SC2CC2 62a_100000708259_100000211595 [0,1,0,1,0,0|2,0,0]=4 25252 B12R2.225 Clc1ncccc1OC2CC2 34a_100000757616_100000211595 [0,1,0,1,0,0|2,0,0]=4 25253 B12R2.225 Clc1ncccc1SC2CC2 62a_100000036424_100000211595 [0,1,0,1,0,0|2,0,0]=4 25254 B12R2.225 Fc1ccccc1NC2CC2 34a_100000210422_100000211595 [0,1,0,1,0,0|1,0,0]=3 25255 B12R2.225 Fc1ccccc1OC2CC2 34a_100000210171_100000211595 [0,1,0,1,0,0|1,0,0]=3 25256 B12R2.225 Fc1ccccc1SC2CC2 62a_100011215700_100000211595 [0,1,0,1,0,0|1,0,0]=3 25257 B12R2.225 Fc1cccnc1OC2CC2 34a_100011219419_100000211595 [0,1,0,1,0,0|2,0,0]=4 25258 B12R2.225 Fc1cccnc1SC2CC2 62a_100000685392_100000211595 [0,1,0,1,0,0|2,0,0]=4 25259 B12R2.225 Fc1ccncc1SC2CC2 62a_100009820683_100000211595 [0,1,0,1,0,0|2,0,0]=4 25260 B12R2.225 Fc1cnccc1NC2CC2 27a_100000212008_100000035921 [0,1,0,1,0,0|2,0,0]=4 25261 B12R2.225 Fc1cnccc1OC2CC2 34a_200000081243_100000211595 [0,1,0,1,0,0|2,0,0]=4 25262 B12R2.225 Fc1cnccc1SC2CC2 62a_100000047030_100000211595 [0,1,0,1,0,0|2,0,0]=4 25263 B12R2.225 Fc1ncccc1OC2CC2 34a_100000061740_100000211595 [0,1,0,1,0,0|2,0,0]=4 25264 B12R2.225 Fc1ncccc1SC2CC2 62a_100009816115_100000211595 [0,1,0,1,0,0|2,0,0]=4 25265 B12R2.225 Ic1ccccc1NC2CC2 34a_100000210053_100000211595 [0,1,0,1,0,0|1,0,0]=3 25266 B12R2.225 Ic1ccccc1OC2CC2 34a_100000739446_100000211595 [0,1,0,1,0,0|1,0,0]=3 25267 B12R2.225 Ic1ccncc1OC2CC2 34a_100000050107_100000211595 [0,1,0,1,0,0|2,0,0]=4 25268 B12R2.225 Ic1ncccc1OC2CC2 34a_100000034122_100000211595 [0,1,0,1,0,0|2,0,0]=4 25269 B12R2.225 Nc1ccccc1OC2CC2 34a_100000185747_100000211595 [0,1,0,1,0,0|1,0,0]=3 25270 B12R2.225 Nc1ccccc1SC2CC2 62a_100000210017_100000211595 [0,1,0,1,0,0|1,0,0]=3 25271 B12R2.225 Nc1cccnc1OC2CC2 34a_100000746358_100000211595 [0,1,0,1,0,0|2,0,0]=4 25272 B12R2.225 Nc1cccnc1SC2CC2 62a_100000688686_100000211595 [0,1,0,1,0,0|2,0,0]=4 25273 B12R2.225 Nc1ccncc1OC2CC2 34a_100000753702_100000211595 [0,1,0,1,0,0|2,0,0]=4 25274 B12R2.225 Nc1ccncc1SC2CC2 62a_100000047001_100000211595 [0,1,0,1,0,0|2,0,0]=4 25275 B12R2.225 Nc1cnccc1SC2CC2 62a_100000756074_100000211595 [0,1,0,1,0,0|2,0,0]=4 25276 B12R2.225 Nc1ncccc1OC2CC2 34a_100000211975_100000211595 [0,1,0,1,0,0|2,0,0]=4 25277 B12R2.225 Nc1ncccc1SC2CC2 62a_100000045569_100000211595 [0,1,0,1,0,0|2,0,0]=4 25278 B12R2.225 O=c1cc[nH]cc1SC2CC2 62a_100009998708_100000211595 [0,1,0,1,0,0|1,0,1]=4 25279 B12R2.225 O=c1ccocc1OC2CC2 34a_100000060831_100000211595 [0,1,0,1,0,0|1,0,1]=4 25280 B12R2.225 O=c1occcc1OC2CC2 34a_100000077404_100000211595 [0,1,0,1,0,0|1,0,1]=4 25281 B12R2.225 Oc1ccccc1NC2CC2 34a_100000185747_100000211595 [0,1,0,1,0,0|0,0,0]=2 25282 B12R2.225 Oc1ccccc1OC2CC2 271570a_203496583355_100012344913 [0,1,0,1,0,0|0,0,0]=2 25283 B12R2.225 Oc1ccccc1SC2CC2 62a_100000739446_100000211595 [0,1,0,1,0,0|0,0,0]=2 25284 B12R2.225 Oc1cccnc1SC2CC2 62a_100000034122_100000211595 [0,1,0,1,0,0|1,0,0]=3 25285 B12R2.225 Oc1cnccc1SC2CC2 62a_100009817591_100000211595 [0,1,0,1,0,0|1,0,0]=3 25286 B12R2.225 Oc1ncccc1SC2CC2 62a_100000760158_100000211595 [0,1,0,1,0,0|1,0,0]=3 25287 B12R2.225 Oc1ncncc1SC2CC2 62a_100000751107_100000211595 [0,1,0,1,0,0|2,0,0]=4 25288 B12R2.225 S=c1cc[nH]cc1SC2CC2 62a_200012280681_100000211595 [0,1,0,1,0,0|1,1,0]=4 25289 B12R2.517 Brc1cccnc1N2CCC2 27a_100000754969_100000696092 [0,1,0,1,0,0|2,0,0]=4 25290 B12R2.517 Brc1cnccc1N2CCC2 27a_100000754969_100000726257 [0,1,0,1,0,0|2,0,0]=4 25291 B12R2.517 Cc1cnccc1N2CCC2 27a_100000754969_100000765111 [0,1,0,1,0,0|2,0,0]=4 25292 B12R2.517 Fc1cnccc1N2CCC2 27a_100000754969_100000035921 [0,1,0,1,0,0|2,0,0]=4 25293 B12R2.931 CCSC1Cc2c1cccc2 62a_100000210202_100009813401 [0,1,0,1,0,0|1,0,0]=3 25294 B12R2.931 CCSC1Cc2c1cccc2 62a_100009813401_100000210202 [0,1,0,1,0,0|1,0,0]=3 25295 B12R2.931 COCC1Cc2c1cccc2 34a_100012476685_200000210301 [0,1,0,1,0,0|1,0,0]=3 25296 B12R2.931 COCC1Cc2c1cccc2 7a_100012476685_200000210301 [0,1,0,1,0,0|1,0,0]=3 25297 B12R2.931 FCSC1Cc2c1cccc2 62a_100009813401_100015361967 [0,1,0,1,0,0|2,0,0]=4 25298 B12R2.931 FCSC1Cc2c1cccc2 62a_100015361967_100009813401 [0,1,0,1,0,0|2,0,0]=4 25299 B12R2.931 [13CH3]OCC1Cc2c1cccc2 34a_100012476685_200025704644 [0,1,0,1,0,0|1,0,0]=3 25300 B12R2.931 [13CH3]OCC1Cc2c1cccc2 7a_100012476685_200025704644 [0,1,0,1,0,0|1,0,0]=3 25301 B12R2.1 CNC1CCc2c1cccc2 2230a_106832991635_200000721974 [0,1,0,1,0,0|2,0,0]=4 25302 B12R2.1 CNC1CCc2c1cccc2 269862a_106832991636_100000212051 [0,1,0,1,0,0|2,0,0]=4 25303 B12R2.1 CNC1COc2c1cccc2 2230a_100000747519_200000210301 [0,1,0,1,0,0|1,0,0]=3 25304 B12R2.1 CN[C@H]1CCc2c1cccc2 2230a_100016989578_200000210301 [0,1,0,1,0,0|2,0,0]=4 25305 B12R2.1 CN[C@H]1CCc2c1cccc2 34a_100016989578_200000210301 [0,1,0,1,0,0|2,0,0]=4 25306 B12R2.1 COC1CCc2c1cccc2 34a_100000212247_200000210301 [0,1,0,1,0,0|2,0,0]=4 25307 B12R2.1 COC1CCc2c1cccc2 7a_100000212247_200000210301 [0,1,0,1,0,0|2,0,0]=4 25308 B12R2.1 CSC1CCc2c1cccc2 62a_200000210301_200000721974 [0,1,0,1,0,0|2,0,0]=4 25309 B12R2.1 CSc1coc2c1cccc2 62a_200000210301_100009812202 [0,1,0,1,0,0|1,0,1]=4 25310 B12R2.1 CSc1noc2c1cccc2 62a_200000210301_200000703156 [0,1,0,1,0,0|1,0,1]=4 25311 B12R2.1 CSc1noc2c1cccc2 62a_200000703156_200000210301 [0,1,0,1,0,0|1,0,1]=4 25312 B12R2.1 [13CH3]NC1COc2c1cccc2 2230a_100000747519_200025704644 [0,1,0,1,0,0|1,0,0]=3 25313 B12R2.1 [13CH3]N[C@H]1CCc2c1cccc2 2230a_100016989578_200025704644 [0,1,0,1,0,0|2,0,0]=4 25314 B12R2.1 [13CH3]N[C@H]1CCc2c1cccc2 34a_100016989578_200025704644 [0,1,0,1,0,0|2,0,0]=4 25315 B12R2.1 [13CH3]OC1CCc2c1cccc2 34a_100000212247_200025704644 [0,1,0,1,0,0|2,0,0]=4 25316 B12R2.1 [13CH3]OC1CCc2c1cccc2 7a_100000212247_200025704644 [0,1,0,1,0,0|2,0,0]=4 25317 B12R2.1 [13CH3]SC1CCc2c1cccc2 62a_200025704644_200000721974 [0,1,0,1,0,0|2,0,0]=4 25318 B12R2.1 [13CH3]Sc1coc2c1cccc2 62a_200025704644_100009812202 [0,1,0,1,0,0|1,0,1]=4 25319 B12R2.1 [13CH3]Sc1noc2c1cccc2 62a_200000703156_200025704644 [0,1,0,1,0,0|1,0,1]=4 25320 B12R2.1 [13CH3]Sc1noc2c1cccc2 62a_200025704644_200000703156 [0,1,0,1,0,0|1,0,1]=4 25321 B12R2.18 Cc1oc2ccccc2c1O 271570a_203496583355_200010236113 [0,1,0,1,0,0|0,0,2]=4 25322 B12R2.18 Cc1sc2ccccc2c1O 271570a_203496583355_100010002616 [0,1,0,1,0,0|1,0,1]=4 25323 B12R2.18 Cn1nc2ccccc2c1O 271570a_203496583355_100010163699 [0,1,0,1,0,0|2,0,0]=4 25324 B12R2.315 C=Cc1cccc2c1CCC2 271570a_100011290941_100010343934 [0,1,0,1,0,0|1,0,0]=3 25325 B12R2.315 C=Cc1cccc2c1CCN2 271570a_100011290941_100009817896 [0,1,0,1,0,0|2,0,0]=4 25326 B12R2.315 C=Cc1cccc2c1CCO2 271570a_100011290941_100009819624 [0,1,0,1,0,0|2,0,0]=4 25327 B12R2.315 C=Cc1cccc2c1CNC2 271570a_100011290941_100000703859 [0,1,0,1,0,0|2,0,0]=4 25328 B12R2.315 C=Cc1cccc2c1COC2 271570a_100011290941_100010384907 [0,1,0,1,0,0|2,0,0]=4 25329 B12R2.315 C=Cc1cccc2c1NCC2 271570a_100011290941_100016995435 [0,1,0,1,0,0|2,0,0]=4 25330 B12R2.315 C=Cc1cccc2c1OCC2 271570a_100011290941_100009818991 [0,1,0,1,0,0|2,0,0]=4 25331 B12R2.315 C=Cc1ccnc2c1CCC2 271570a_100011290941_100000102697 [0,1,0,1,0,0|2,0,0]=4 25332 B12R2.315 CNc1cccc2c1CCC2 2230a_100000043548_200000210301 [0,1,0,1,0,0|1,0,0]=3 25333 B12R2.315 CNc1cccc2c1CCC2 34a_100000043548_200000210301 [0,1,0,1,0,0|1,0,0]=3 25334 B12R2.315 CNc1cccc2c1CCO2 2230a_100000084147_200000210301 [0,1,0,1,0,0|2,0,0]=4 25335 B12R2.315 CNc1cccc2c1CCO2 34a_100000084147_200000210301 [0,1,0,1,0,0|2,0,0]=4 25336 B12R2.315 CNc1cccc2c1COC2 2230a_100000125316_200000210301 [0,1,0,1,0,0|2,0,0]=4 25337 B12R2.315 CNc1cccc2c1COC2 34a_100000125316_200000210301 [0,1,0,1,0,0|2,0,0]=4 25338 B12R2.315 CNc1cccc2c1OCC2 2230a_100000102157_200000210301 [0,1,0,1,0,0|2,0,0]=4 25339 B12R2.315 CNc1cccc2c1OCC2 34a_100000102157_200000210301 [0,1,0,1,0,0|2,0,0]=4 25340 B12R2.315 CNc1ccnc2c1CCC2 27a_100102657272_100000102697 [0,1,0,1,0,0|2,0,0]=4 25341 B12R2.315 COc1cccc2c1CCC2 34a_100000074356_200000210301 [0,1,0,1,0,0|0,0,0]=2 25342 B12R2.315 COc1cccc2c1CCC2 7a_100000074356_200000210301 [0,1,0,1,0,0|0,0,0]=2 25343 B12R2.315 COc1cccc2c1CCN2 34a_100000703684_200000210301 [0,1,0,1,0,0|1,0,0]=3 25344 B12R2.315 COc1cccc2c1CCO2 34a_100000090053_200000210301 [0,1,0,1,0,0|1,0,0]=3 25345 B12R2.315 COc1cccc2c1CCO2 7a_100000090053_200000210301 [0,1,0,1,0,0|1,0,0]=3 25346 B12R2.315 COc1cccc2c1CNC2 34a_100015191671_200000210301 [0,1,0,1,0,0|1,0,0]=3 25347 B12R2.315 COc1cccc2c1OCO2 34a_100000046630_200000210301 [0,1,0,1,0,0|2,0,0]=4 25348 B12R2.315 COc1cccc2c1OCO2 7a_100000046630_200000210301 [0,1,0,1,0,0|2,0,0]=4 25349 B12R2.315 CSc1cccc2c1CCC2 62a_100010343934_200000210301 [0,1,0,1,0,0|0,1,0]=3 25350 B12R2.315 CSc1cccc2c1CCC2 62a_200000210301_100010343934 [0,1,0,1,0,0|0,1,0]=3 25351 B12R2.315 CSc1cccc2c1CCN2 62a_100009817896_200000210301 [0,1,0,1,0,0|1,1,0]=4 25352 B12R2.315 CSc1cccc2c1CCN2 62a_200000210301_100009817896 [0,1,0,1,0,0|1,1,0]=4 25353 B12R2.315 CSc1cccc2c1CCO2 62a_100009819624_200000210301 [0,1,0,1,0,0|1,1,0]=4 25354 B12R2.315 CSc1cccc2c1CCO2 62a_200000210301_100009819624 [0,1,0,1,0,0|1,1,0]=4 25355 B12R2.315 CSc1cccc2c1CNC2 62a_100000703859_200000210301 [0,1,0,1,0,0|1,1,0]=4 25356 B12R2.315 CSc1cccc2c1CNC2 62a_200000210301_100000703859 [0,1,0,1,0,0|1,1,0]=4 25357 B12R2.315 CSc1cccc2c1COC2 62a_100010384907_200000210301 [0,1,0,1,0,0|1,1,0]=4 25358 B12R2.315 CSc1cccc2c1COC2 62a_200000210301_100010384907 [0,1,0,1,0,0|1,1,0]=4 25359 B12R2.315 CSc1cccc2c1NCC2 62a_100016995435_200000210301 [0,1,0,1,0,0|1,1,0]=4 25360 B12R2.315 CSc1cccc2c1NCC2 62a_200000210301_100016995435 [0,1,0,1,0,0|1,1,0]=4 25361 B12R2.315 CSc1cccc2c1OCC2 62a_100009818991_200000210301 [0,1,0,1,0,0|1,1,0]=4 25362 B12R2.315 CSc1cccc2c1OCC2 62a_200000210301_100009818991 [0,1,0,1,0,0|1,1,0]=4 25363 B12R2.315 CSc1ccnc2c1CCC2 62a_100000102697_200000210301 [0,1,0,1,0,0|1,1,0]=4 25364 B12R2.315 CSc1ccnc2c1CCC2 62a_200000210301_100000102697 [0,1,0,1,0,0|1,1,0]=4 25365 B12R2.315 [13CH3]Nc1cccc2c1CCC2 2230a_100000043548_200025704644 [0,1,0,1,0,0|1,0,0]=3 25366 B12R2.315 [13CH3]Nc1cccc2c1CCC2 34a_100000043548_200025704644 [0,1,0,1,0,0|1,0,0]=3 25367 B12R2.315 [13CH3]Nc1cccc2c1CCO2 2230a_100000084147_200025704644 [0,1,0,1,0,0|2,0,0]=4 25368 B12R2.315 [13CH3]Nc1cccc2c1CCO2 34a_100000084147_200025704644 [0,1,0,1,0,0|2,0,0]=4 25369 B12R2.315 [13CH3]Nc1cccc2c1COC2 2230a_100000125316_200025704644 [0,1,0,1,0,0|2,0,0]=4 25370 B12R2.315 [13CH3]Nc1cccc2c1COC2 34a_100000125316_200025704644 [0,1,0,1,0,0|2,0,0]=4 25371 B12R2.315 [13CH3]Nc1cccc2c1OCC2 2230a_100000102157_200025704644 [0,1,0,1,0,0|2,0,0]=4 25372 B12R2.315 [13CH3]Nc1cccc2c1OCC2 34a_100000102157_200025704644 [0,1,0,1,0,0|2,0,0]=4 25373 B12R2.315 [13CH3]Oc1cccc2c1CCC2 34a_100000074356_200025704644 [0,1,0,1,0,0|0,0,0]=2 25374 B12R2.315 [13CH3]Oc1cccc2c1CCC2 7a_100000074356_200025704644 [0,1,0,1,0,0|0,0,0]=2 25375 B12R2.315 [13CH3]Oc1cccc2c1CCN2 34a_100000703684_200025704644 [0,1,0,1,0,0|1,0,0]=3 25376 B12R2.315 [13CH3]Oc1cccc2c1CCO2 34a_100000090053_200025704644 [0,1,0,1,0,0|1,0,0]=3 25377 B12R2.315 [13CH3]Oc1cccc2c1CCO2 7a_100000090053_200025704644 [0,1,0,1,0,0|1,0,0]=3 25378 B12R2.315 [13CH3]Oc1cccc2c1CNC2 34a_100015191671_200025704644 [0,1,0,1,0,0|1,0,0]=3 25379 B12R2.315 [13CH3]Oc1cccc2c1OCO2 34a_100000046630_200025704644 [0,1,0,1,0,0|2,0,0]=4 25380 B12R2.315 [13CH3]Oc1cccc2c1OCO2 7a_100000046630_200025704644 [0,1,0,1,0,0|2,0,0]=4 25381 B12R2.315 [13CH3]Sc1cccc2c1CCC2 62a_100010343934_200025704644 [0,1,0,1,0,0|0,1,0]=3 25382 B12R2.315 [13CH3]Sc1cccc2c1CCC2 62a_200025704644_100010343934 [0,1,0,1,0,0|0,1,0]=3 25383 B12R2.315 [13CH3]Sc1cccc2c1CCN2 62a_100009817896_200025704644 [0,1,0,1,0,0|1,1,0]=4 25384 B12R2.315 [13CH3]Sc1cccc2c1CCN2 62a_200025704644_100009817896 [0,1,0,1,0,0|1,1,0]=4 25385 B12R2.315 [13CH3]Sc1cccc2c1CCO2 62a_100009819624_200025704644 [0,1,0,1,0,0|1,1,0]=4 25386 B12R2.315 [13CH3]Sc1cccc2c1CCO2 62a_200025704644_100009819624 [0,1,0,1,0,0|1,1,0]=4 25387 B12R2.315 [13CH3]Sc1cccc2c1CNC2 62a_100000703859_200025704644 [0,1,0,1,0,0|1,1,0]=4 25388 B12R2.315 [13CH3]Sc1cccc2c1CNC2 62a_200025704644_100000703859 [0,1,0,1,0,0|1,1,0]=4 25389 B12R2.315 [13CH3]Sc1cccc2c1COC2 62a_100010384907_200025704644 [0,1,0,1,0,0|1,1,0]=4 25390 B12R2.315 [13CH3]Sc1cccc2c1COC2 62a_200025704644_100010384907 [0,1,0,1,0,0|1,1,0]=4 25391 B12R2.315 [13CH3]Sc1cccc2c1NCC2 62a_100016995435_200025704644 [0,1,0,1,0,0|1,1,0]=4 25392 B12R2.315 [13CH3]Sc1cccc2c1NCC2 62a_200025704644_100016995435 [0,1,0,1,0,0|1,1,0]=4 25393 B12R2.315 [13CH3]Sc1cccc2c1OCC2 62a_100009818991_200025704644 [0,1,0,1,0,0|1,1,0]=4 25394 B12R2.315 [13CH3]Sc1cccc2c1OCC2 62a_200025704644_100009818991 [0,1,0,1,0,0|1,1,0]=4 25395 B12R2.315 [13CH3]Sc1ccnc2c1CCC2 62a_100000102697_200025704644 [0,1,0,1,0,0|1,1,0]=4 25396 B12R2.315 [13CH3]Sc1ccnc2c1CCC2 62a_200025704644_100000102697 [0,1,0,1,0,0|1,1,0]=4 25397 B12R2.2048 C=Cc1ccccc1C2CC2 271570a_100011290941_100009819954 [0,1,0,1,0,0|1,0,0]=3 25398 B12R2.2048 C=Cc1ncccc1C2CC2 271570a_100011290941_100009851976 [0,1,0,1,0,0|2,0,0]=4 25399 B12R2.2048 CCc1ccccc1C2CC2 271570a_100011220607_100011215823 [0,1,0,1,0,0|1,0,0]=3 25400 B12R2.2048 CCc1ccncc1C2CC2 271570a_100011220607_100009819861 [0,1,0,1,0,0|2,0,0]=4 25401 B12R2.2048 CCc1cnccc1C2CC2 271570a_100011220607_100025704421 [0,1,0,1,0,0|2,0,0]=4 25402 B12R2.2048 CCc1ncccc1C2CC2 271570a_100011220607_100009877225 [0,1,0,1,0,0|2,0,0]=4 25403 B12R2.2048 CNc1ccccc1C2CC2 271570a_100011220607_100020606079 [0,1,0,1,0,0|1,0,0]=3 25404 B12R2.2048 CNc1ccccc1C2CC2 34a_100011236190_200000210301 [0,1,0,1,0,0|1,0,0]=3 25405 B12R2.2048 CNc1cccnc1C2CC2 271570a_100011220607_200011806188 [0,1,0,1,0,0|2,0,0]=4 25406 B12R2.2048 CNc1ccncc1C2CC2 271570a_100011220607_100010069531 [0,1,0,1,0,0|2,0,0]=4 25407 B12R2.2048 CNc1ncccc1C2CC2 271570a_100011220607_100000700899 [0,1,0,1,0,0|2,0,0]=4 25408 B12R2.2048 COc1ccccc1C2CC2 271570a_100011220607_100000174000 [0,1,0,1,0,0|0,0,0]=2 25409 B12R2.2048 COc1cccnc1C2CC2 271570a_100011220607_100000690851 [0,1,0,1,0,0|1,0,0]=3 25410 B12R2.2048 COc1ccncc1C2CC2 271570a_100011220607_100011997281 [0,1,0,1,0,0|1,0,0]=3 25411 B12R2.2048 COc1cnccc1C2CC2 271570a_100011220607_100016988167 [0,1,0,1,0,0|1,0,0]=3 25412 B12R2.2048 COc1cncnc1C2CC2 271570a_100011220607_100012001275 [0,1,0,1,0,0|2,0,0]=4 25413 B12R2.2048 COc1ncccc1C2CC2 271570a_100011220607_100000047025 [0,1,0,1,0,0|1,0,0]=3 25414 B12R2.2048 COc1nccnc1C2CC2 271570a_100011220607_100000749998 [0,1,0,1,0,0|2,0,0]=4 25415 B12R2.2048 COc1ncncc1C2CC2 271570a_100011220607_100000719902 [0,1,0,1,0,0|2,0,0]=4 25416 B12R2.2048 CSc1ccccc1C2CC2 271570a_100011220607_100011217816 [0,1,0,1,0,0|0,1,0]=3 25417 B12R2.2048 CSc1ccccc1C2CC2 62a_100009819954_200000210301 [0,1,0,1,0,0|0,1,0]=3 25418 B12R2.2048 CSc1ccccc1C2CC2 62a_200000210301_100009819954 [0,1,0,1,0,0|0,1,0]=3 25419 B12R2.2048 CSc1ncccc1C2CC2 271570a_100011220607_100011465278 [0,1,0,1,0,0|1,1,0]=4 25420 B12R2.2048 CSc1ncccc1C2CC2 62a_200000210301_100009851976 [0,1,0,1,0,0|1,1,0]=4 25421 B12R2.2048 CSc1ncccc1C2CC2 62a_200009850273_200000210301 [0,1,0,1,0,0|1,1,0]=4 25422 B12R2.2048 N#Cc1ccccc1C2CC2 271570a_100011220607_100000188569 [0,1,0,1,0,0|1,0,0]=3 25423 B12R2.2048 N#Cc1cccnc1C2CC2 271570a_100011220607_100000211984 [0,1,0,1,0,0|2,0,0]=4 25424 B12R2.2048 N#Cc1ccncc1C2CC2 271570a_100011220607_100000684818 [0,1,0,1,0,0|2,0,0]=4 25425 B12R2.2048 N#Cc1cnccc1C2CC2 271570a_100011220607_100000687039 [0,1,0,1,0,0|2,0,0]=4 25426 B12R2.2048 N#Cc1ncccc1C2CC2 271570a_100011220607_100000685805 [0,1,0,1,0,0|2,0,0]=4 25427 B12R2.2048 NCc1ccccc1C2CC2 271570a_100011220607_100000689332 [0,1,0,1,0,0|1,0,0]=3 25428 B12R2.2048 NCc1cccnc1C2CC2 271570a_100011220607_100015189234 [0,1,0,1,0,0|2,0,0]=4 25429 B12R2.2048 NCc1ccncc1C2CC2 271570a_100011220607_100020640021 [0,1,0,1,0,0|2,0,0]=4 25430 B12R2.2048 NCc1ncccc1C2CC2 271570a_100011220607_100020591323 [0,1,0,1,0,0|2,0,0]=4 25431 B12R2.2048 NNc1ccccc1C2CC2 271570a_100011220607_100000241748 [0,1,0,1,0,0|1,0,0]=3 25432 B12R2.2048 NNc1ccncc1C2CC2 271570a_100011220607_100013404636 [0,1,0,1,0,0|2,0,0]=4 25433 B12R2.2048 NNc1ncccc1C2CC2 271570a_100011220607_100011464834 [0,1,0,1,0,0|2,0,0]=4 25434 B12R2.2048 O=Cc1ccccc1C2CC2 271570a_100011220607_100000211189 [0,1,0,1,0,0|0,0,1]=3 25435 B12R2.2048 O=Cc1cccnc1C2CC2 271570a_100011220607_100009816751 [0,1,0,1,0,0|1,0,1]=4 25436 B12R2.2048 O=Cc1ccncc1C2CC2 271570a_100011220607_100011934409 [0,1,0,1,0,0|1,0,1]=4 25437 B12R2.2048 O=Cc1cnccc1C2CC2 271570a_100011220607_100000050567 [0,1,0,1,0,0|1,0,1]=4 25438 B12R2.2048 O=Cc1ncccc1C2CC2 271570a_100011220607_100011934733 [0,1,0,1,0,0|1,0,1]=4 25439 B12R2.2048 OCc1ccccc1C2CC2 271570a_100011220607_100000187465 [0,1,0,1,0,0|0,0,0]=2 25440 B12R2.2048 OCc1cccnc1C2CC2 271570a_100011220607_100000748726 [0,1,0,1,0,0|1,0,0]=3 25441 B12R2.2048 OCc1ccncc1C2CC2 271570a_100011220607_100009873359 [0,1,0,1,0,0|1,0,0]=3 25442 B12R2.2048 OCc1cnccc1C2CC2 271570a_100011220607_100000117392 [0,1,0,1,0,0|1,0,0]=3 25443 B12R2.2048 OCc1ncccc1C2CC2 271570a_100011220607_100011996772 [0,1,0,1,0,0|1,0,0]=3 25444 B12R2.2048 OCc1nccnc1C2CC2 271570a_100011220607_100000057004 [0,1,0,1,0,0|2,0,0]=4 25445 B12R2.2048 [13CH3]Nc1ccccc1C2CC2 34a_100011236190_200025704644 [0,1,0,1,0,0|1,0,0]=3 25446 B12R2.2048 [13CH3]Sc1ccccc1C2CC2 62a_100009819954_200025704644 [0,1,0,1,0,0|0,1,0]=3 25447 B12R2.2048 [13CH3]Sc1ccccc1C2CC2 62a_200025704644_100009819954 [0,1,0,1,0,0|0,1,0]=3 25448 B12R2.2048 [13CH3]Sc1ncccc1C2CC2 62a_200009850273_200025704644 [0,1,0,1,0,0|1,1,0]=4 25449 B12R2.2048 [13CH3]Sc1ncccc1C2CC2 62a_200025704644_100009851976 [0,1,0,1,0,0|1,1,0]=4 25450 B12R2.246 Cc1nc(c2c(n1)CCC2)O 271570a_203496583355_100011240833 [0,1,0,1,0,0|2,0,0]=4 25451 B12R2.606 CN1Cc2ccc(cc2C1)Br 2230a_100000702344_200000210301 [0,1,0,1,0,0|2,0,0]=4 25452 B12R2.606 CN1Cc2ccc(cc2C1)Br 269982a_100000702344_200000210301 [0,1,0,1,0,0|2,0,0]=4 25453 B12R2.606 CN1Cc2ccc(cc2C1)Br 34a_100000702344_200000210301 [0,1,0,1,0,0|2,0,0]=4 25454 B12R2.606 CN1Cc2ccc(cc2C1)Cl 2230a_100015205306_200000210301 [0,1,0,1,0,0|2,0,0]=4 25455 B12R2.606 CN1Cc2ccc(cc2C1)Cl 269982a_100015205306_200000210301 [0,1,0,1,0,0|2,0,0]=4 25456 B12R2.606 CN1Cc2ccc(cc2C1)Cl 34a_100015205306_200000210301 [0,1,0,1,0,0|2,0,0]=4 25457 B12R2.606 CN1Cc2ccc(cc2C1)F 2230a_100000766377_200000210301 [0,1,0,1,0,0|2,0,0]=4 25458 B12R2.606 CN1Cc2ccc(cc2C1)F 269982a_100000766377_200000210301 [0,1,0,1,0,0|2,0,0]=4 25459 B12R2.606 CN1Cc2ccc(cc2C1)F 34a_100000766377_200000210301 [0,1,0,1,0,0|2,0,0]=4 25460 B12R2.606 CN1Cc2ccc(cc2C1)O 2230a_100015195982_200000210301 [0,1,0,1,0,0|2,0,0]=4 25461 B12R2.606 CN1Cc2ccc(cc2C1)O 269982a_100015195982_200000210301 [0,1,0,1,0,0|2,0,0]=4 25462 B12R2.606 CN1Cc2ccc(cc2C1)O 34a_100015195982_200000210301 [0,1,0,1,0,0|2,0,0]=4 25463 B12R2.606 Cc1nc2cc(ccc2o1)O 271570a_203496583355_100009816932 [0,1,0,1,0,0|1,0,1]=4 25464 B12R2.606 Cc1nc2ccc(cc2o1)O 271570a_203496583355_100010171164 [0,1,0,1,0,0|1,0,1]=4 25465 B12R2.606 NC1Cc2ccc(cc2C1)O 271570a_203496583355_100015193702 [0,1,0,1,0,0|2,0,0]=4 25466 B12R2.606 Oc1ccc2c(c1)CC(C2)O 271570a_203496583355_100010161096 [0,1,0,1,0,0|2,0,0]=4 25467 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Br 2230a_100000702344_200025704644 [0,1,0,1,0,0|2,0,0]=4 25468 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Br 269982a_100000702344_200025704644 [0,1,0,1,0,0|2,0,0]=4 25469 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Br 34a_100000702344_200025704644 [0,1,0,1,0,0|2,0,0]=4 25470 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Cl 2230a_100015205306_200025704644 [0,1,0,1,0,0|2,0,0]=4 25471 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Cl 269982a_100015205306_200025704644 [0,1,0,1,0,0|2,0,0]=4 25472 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Cl 34a_100015205306_200025704644 [0,1,0,1,0,0|2,0,0]=4 25473 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)F 2230a_100000766377_200025704644 [0,1,0,1,0,0|2,0,0]=4 25474 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)F 269982a_100000766377_200025704644 [0,1,0,1,0,0|2,0,0]=4 25475 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)F 34a_100000766377_200025704644 [0,1,0,1,0,0|2,0,0]=4 25476 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 2230a_100015195982_200025704644 [0,1,0,1,0,0|2,0,0]=4 25477 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 269982a_100015195982_200025704644 [0,1,0,1,0,0|2,0,0]=4 25478 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 34a_100015195982_200025704644 [0,1,0,1,0,0|2,0,0]=4 25479 B12R2.1317 Brc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100011484698 [0,1,0,1,0,0|1,0,0]=3 25480 B12R2.1317 Cc1c[n+](ccc1C2CC2)[O-] 271570a_100011220607_100000074940 [0,1,0,1,0,0|2,0,0]=4 25481 B12R2.1317 Cc1cc(c(cn1)C2CC2)C 271570a_100011220607_100009819613 [0,1,0,1,0,0|2,0,0]=4 25482 B12R2.1317 Cc1cc(c(cn1)C2CC2)N 271570a_100011220607_100009817891 [0,1,0,1,0,0|2,0,0]=4 25483 B12R2.1317 Cc1cc(c(cn1)C2CC2)O 271570a_100011220607_100011016184 [0,1,0,1,0,0|1,0,0]=3 25484 B12R2.1317 Cc1cc(ccc1C2CC2)Br 271570a_100011220607_100000701812 [0,1,0,1,0,0|1,0,0]=3 25485 B12R2.1317 Cc1cc(ccc1C2CC2)Cl 271570a_100011220607_100011219607 [0,1,0,1,0,0|1,0,0]=3 25486 B12R2.1317 Cc1cc(ccc1C2CC2)F 271570a_100011220607_100011205405 [0,1,0,1,0,0|1,0,0]=3 25487 B12R2.1317 Cc1cc(ccc1C2CC2)N 271570a_100011220607_100000210723 [0,1,0,1,0,0|1,0,0]=3 25488 B12R2.1317 Cc1cc(ccc1C2CC2)O 271570a_100011220607_100000729255 [0,1,0,1,0,0|1,0,0]=3 25489 B12R2.1317 Cc1cc(cnc1C2CC2)Br 271570a_100011220607_100012353652 [0,1,0,1,0,0|2,0,0]=4 25490 B12R2.1317 Cc1cc(cnc1C2CC2)F 271570a_100011220607_100009817009 [0,1,0,1,0,0|2,0,0]=4 25491 B12R2.1317 Cc1cc(cnc1C2CC2)N 271570a_100011220607_100000761747 [0,1,0,1,0,0|2,0,0]=4 25492 B12R2.1317 Cc1cc(cnc1C2CC2)O 271570a_100011220607_100012000486 [0,1,0,1,0,0|2,0,0]=4 25493 B12R2.1317 Cc1cc(ncc1C2CC2)Br 271570a_100011220607_100009816104 [0,1,0,1,0,0|2,0,0]=4 25494 B12R2.1317 Cc1cc(ncc1C2CC2)Cl 271570a_100011220607_100010172789 [0,1,0,1,0,0|2,0,0]=4 25495 B12R2.1317 Cc1cc(ncc1C2CC2)F 271570a_100011220607_100009820716 [0,1,0,1,0,0|2,0,0]=4 25496 B12R2.1317 Cc1cc(ncc1C2CC2)N 271570a_100011220607_100000050067 [0,1,0,1,0,0|2,0,0]=4 25497 B12R2.1317 Cc1cc(ncc1C2CC2)O 271570a_100011220607_100010114363 [0,1,0,1,0,0|2,0,0]=4 25498 B12R2.1317 Cc1ccc([n+](c1)[O-])C2CC2 271570a_100011220607_100009819918 [0,1,0,1,0,0|1,0,1]=4 25499 B12R2.1317 Cc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100009813563 [0,1,0,1,0,0|1,0,0]=3 25500 B12R2.1317 Cc1ccc(c(c1)C)C2CC2 271570a_100011220607_100011217332 [0,1,0,1,0,0|1,0,0]=3 25501 B12R2.1317 Cc1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100011263221 [0,1,0,1,0,0|1,0,0]=3 25502 B12R2.1317 Cc1ccc(c(c1)F)C2CC2 271570a_100011220607_100011216119 [0,1,0,1,0,0|1,0,0]=3 25503 B12R2.1317 Cc1ccc(c(c1)N)C2CC2 271570a_100011220607_100011216686 [0,1,0,1,0,0|1,0,0]=3 25504 B12R2.1317 Cc1ccc(c(c1)O)C2CC2 271570a_100011220607_100012002257 [0,1,0,1,0,0|0,0,0]=2 25505 B12R2.1317 Cc1ccc(c(n1)C)C2CC2 271570a_100011220607_100009813853 [0,1,0,1,0,0|2,0,0]=4 25506 B12R2.1317 Cc1ccc(c(n1)F)C2CC2 271570a_100011220607_100010006597 [0,1,0,1,0,0|2,0,0]=4 25507 B12R2.1317 Cc1ccc(c(n1)N)C2CC2 271570a_100011220607_100009816662 [0,1,0,1,0,0|2,0,0]=4 25508 B12R2.1317 Cc1ccc(c(n1)O)C2CC2 271570a_100011220607_100009817604 [0,1,0,1,0,0|1,0,0]=3 25509 B12R2.1317 Cc1cnc(c(c1)C)C2CC2 271570a_100011220607_100009864548 [0,1,0,1,0,0|2,0,0]=4 25510 B12R2.1317 Cc1cnc(c(c1)F)C2CC2 271570a_100011220607_100009819633 [0,1,0,1,0,0|2,0,0]=4 25511 B12R2.1317 Cc1cnc(c(c1)N)C2CC2 271570a_100011220607_100000733613 [0,1,0,1,0,0|2,0,0]=4 25512 B12R2.1317 Cc1cnc(c(c1)O)C2CC2 271570a_100011220607_100012000487 [0,1,0,1,0,0|1,0,0]=3 25513 B12R2.1317 Cc1nc(ccc1C2CC2)Cl 271570a_100011220607_100000062408 [0,1,0,1,0,0|2,0,0]=4 25514 B12R2.1317 Cc1nc(ccc1C2CC2)F 271570a_100011220607_100000688911 [0,1,0,1,0,0|2,0,0]=4 25515 B12R2.1317 Cc1nc(ccc1C2CC2)N 271570a_100011220607_100000013003 [0,1,0,1,0,0|2,0,0]=4 25516 B12R2.1317 Cc1nc(ccc1C2CC2)O 271570a_100011220607_100000691680 [0,1,0,1,0,0|2,0,0]=4 25517 B12R2.1317 Clc1cc(c(cn1)C2CC2)Cl 271570a_100011220607_100010200927 [0,1,0,1,0,0|2,0,0]=4 25518 B12R2.1317 Clc1cc(ccc1C2CC2)Br 271570a_100011220607_100011216062 [0,1,0,1,0,0|1,0,0]=3 25519 B12R2.1317 Clc1cc(ncc1C2CC2)Br 271570a_100011220607_100010381092 [0,1,0,1,0,0|2,0,0]=4 25520 B12R2.1317 Clc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100011219703 [0,1,0,1,0,0|1,0,0]=3 25521 B12R2.1317 Clc1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100000699841 [0,1,0,1,0,0|1,0,0]=3 25522 B12R2.1317 Clc1cnc(c(c1)Br)C2CC2 271570a_100011220607_100012154958 [0,1,0,1,0,0|2,0,0]=4 25523 B12R2.1317 Clc1nc(ccc1C2CC2)Br 271570a_100011220607_100010246183 [0,1,0,1,0,0|2,0,0]=4 25524 B12R2.1317 Fc1cc(c(cn1)C2CC2)Br 271570a_100011220607_100015451857 [0,1,0,1,0,0|2,0,0]=4 25525 B12R2.1317 Fc1cc(ccc1C2CC2)Br 271570a_100011220607_100009814013 [0,1,0,1,0,0|1,0,0]=3 25526 B12R2.1317 Fc1cc(ccc1C2CC2)Cl 271570a_100011220607_100011216042 [0,1,0,1,0,0|1,0,0]=3 25527 B12R2.1317 Fc1cc(cnc1C2CC2)Br 271570a_100011220607_100012348576 [0,1,0,1,0,0|2,0,0]=4 25528 B12R2.1317 Fc1cc(cnc1C2CC2)Cl 271570a_100011220607_100012348686 [0,1,0,1,0,0|2,0,0]=4 25529 B12R2.1317 Fc1cc(ncc1C2CC2)Cl 271570a_100011220607_100010128100 [0,1,0,1,0,0|2,0,0]=4 25530 B12R2.1317 Fc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100011217111 [0,1,0,1,0,0|1,0,0]=3 25531 B12R2.1317 Fc1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100000733362 [0,1,0,1,0,0|1,0,0]=3 25532 B12R2.1317 Fc1ccc(c(c1)F)C2CC2 271570a_100011220607_100000750030 [0,1,0,1,0,0|1,0,0]=3 25533 B12R2.1317 Fc1ccc(c(n1)F)C2CC2 271570a_100011220607_100000070099 [0,1,0,1,0,0|2,0,0]=4 25534 B12R2.1317 Fc1cnc(c(c1)F)C2CC2 271570a_100011220607_100011219543 [0,1,0,1,0,0|2,0,0]=4 25535 B12R2.1317 Fc1nc(ccc1C2CC2)Cl 271570a_100011220607_100010168078 [0,1,0,1,0,0|2,0,0]=4 25536 B12R2.1317 Nc1[nH]c(=O)ccc1C2CC2 271570a_100011220607_100009884077 [0,1,0,1,0,0|2,0,0]=4 25537 B12R2.1317 Nc1cc(c(cn1)C2CC2)Br 271570a_100011220607_100010074611 [0,1,0,1,0,0|2,0,0]=4 25538 B12R2.1317 Nc1cc(c(cn1)C2CC2)Cl 271570a_100011220607_100000694920 [0,1,0,1,0,0|2,0,0]=4 25539 B12R2.1317 Nc1cc(c(cn1)C2CC2)F 271570a_100011220607_100009844730 [0,1,0,1,0,0|2,0,0]=4 25540 B12R2.1317 Nc1cc(c(cn1)C2CC2)N 271570a_100011220607_200009857908 [0,1,0,1,0,0|2,0,0]=4 25541 B12R2.1317 Nc1cc(ccc1C2CC2)Br 271570a_100011220607_100000743836 [0,1,0,1,0,0|1,0,0]=3 25542 B12R2.1317 Nc1cc(ccc1C2CC2)Cl 271570a_100011220607_100000761886 [0,1,0,1,0,0|1,0,0]=3 25543 B12R2.1317 Nc1cc(ccc1C2CC2)F 271570a_100011220607_100011218093 [0,1,0,1,0,0|1,0,0]=3 25544 B12R2.1317 Nc1cc(ccc1C2CC2)O 271570a_100011220607_100011999798 [0,1,0,1,0,0|1,0,0]=3 25545 B12R2.1317 Nc1cc(cnc1C2CC2)Br 271570a_100011220607_100010090555 [0,1,0,1,0,0|2,0,0]=4 25546 B12R2.1317 Nc1cc(cnc1C2CC2)F 271570a_100011220607_100009817643 [0,1,0,1,0,0|2,0,0]=4 25547 B12R2.1317 Nc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100000750458 [0,1,0,1,0,0|1,0,0]=3 25548 B12R2.1317 Nc1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100000761885 [0,1,0,1,0,0|1,0,0]=3 25549 B12R2.1317 Nc1ccc(c(c1)F)C2CC2 271570a_100011220607_100011356925 [0,1,0,1,0,0|1,0,0]=3 25550 B12R2.1317 Nc1ccc(c(c1)N)C2CC2 271570a_100011220607_200012175722 [0,1,0,1,0,0|1,0,0]=3 25551 B12R2.1317 Nc1ccc(c(n1)Br)C2CC2 271570a_100011220607_100010734177 [0,1,0,1,0,0|2,0,0]=4 25552 B12R2.1317 Nc1ccc(c(n1)Cl)C2CC2 271570a_100011220607_100010270343 [0,1,0,1,0,0|2,0,0]=4 25553 B12R2.1317 Nc1ccc(c(n1)F)C2CC2 271570a_100011220607_100009882772 [0,1,0,1,0,0|2,0,0]=4 25554 B12R2.1317 Nc1ccc(c(n1)N)C2CC2 271570a_100011220607_100011356871 [0,1,0,1,0,0|2,0,0]=4 25555 B12R2.1317 Nc1cnc(c(c1)F)C2CC2 271570a_100011220607_100010280766 [0,1,0,1,0,0|2,0,0]=4 25556 B12R2.1317 Nc1cnc(c(c1)N)C2CC2 271570a_100011220607_200000093520 [0,1,0,1,0,0|2,0,0]=4 25557 B12R2.1317 Nc1nc(ccc1C2CC2)Cl 271570a_100011220607_100010171640 [0,1,0,1,0,0|2,0,0]=4 25558 B12R2.1317 Nc1nc(ccc1C2CC2)F 271570a_100011220607_100009854977 [0,1,0,1,0,0|2,0,0]=4 25559 B12R2.1317 O=c1cc(c(c[nH]1)C2CC2)F 271570a_100011220607_100015631685 [0,1,0,1,0,0|2,0,0]=4 25560 B12R2.1317 Oc1cc(ccc1C2CC2)Br 271570a_100011220607_100012344904 [0,1,0,1,0,0|0,0,0]=2 25561 B12R2.1317 Oc1cc(ccc1C2CC2)Cl 271570a_100011220607_100000050036 [0,1,0,1,0,0|0,0,0]=2 25562 B12R2.1317 Oc1cc(ccc1C2CC2)F 271570a_100011220607_100000690578 [0,1,0,1,0,0|0,0,0]=2 25563 B12R2.1317 Oc1cc(cnc1C2CC2)Br 271570a_100011220607_100010210634 [0,1,0,1,0,0|1,0,0]=3 25564 B12R2.1317 Oc1cc(cnc1C2CC2)Cl 271570a_100011220607_100010233512 [0,1,0,1,0,0|1,0,0]=3 25565 B12R2.1317 Oc1cc(cnc1C2CC2)F 271570a_100011220607_100000079967 [0,1,0,1,0,0|1,0,0]=3 25566 B12R2.1317 Oc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100000701344 [0,1,0,1,0,0|1,0,0]=3 25567 B12R2.1317 Oc1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100000047559 [0,1,0,1,0,0|1,0,0]=3 25568 B12R2.1317 Oc1ccc(c(c1)F)C2CC2 271570a_100011220607_100000755031 [0,1,0,1,0,0|1,0,0]=3 25569 B12R2.1317 Oc1ccc(c(c1)O)C2CC2 271570a_100011220607_100009813921 [0,1,0,1,0,0|0,0,0]=2 25570 B12R2.1317 Oc1ccc(c(n1)F)C2CC2 271570a_100011220607_100009879308 [0,1,0,1,0,0|2,0,0]=4 25571 B12R2.1317 Oc1cnc(c(c1)F)C2CC2 271570a_100011220607_100000063512 [0,1,0,1,0,0|2,0,0]=4 25572 B12R2.1317 [O-][n+]1cc(ccc1C2CC2)F 271570a_100011220607_100009817261 [0,1,0,1,0,0|1,0,1]=4 25573 B12R2.3190 CC(=O)C1Cc2c1cccc2 1458a_200000238571_200000210301 [0,1,0,1,0,0|1,0,1]=4 25574 B12R2.3190 CN(C)C1Cc2c1cccc2 269982a_100102631434_100009813401 [0,1,0,1,0,0|2,0,0]=4 25575 B12R2.3190 [13CH3]C(=O)C1Cc2c1cccc2 1458a_200000238571_200025704644 [0,1,0,1,0,0|1,0,1]=4 25576 B12R2.221 Nc1ccc(c2c1CCC2)O 271570a_203496583355_200010751103 [0,1,0,1,0,0|0,0,0]=2 25577 B12R2.1316 Brc1cc(c(cn1)Br)C2CC2 271570a_100011220607_100010171693 [0,1,0,1,0,0|2,0,0]=4 25578 B12R2.1316 Brc1ccc(c(c1)C2CC2)Br 271570a_100011220607_100011483371 [0,1,0,1,0,0|1,0,0]=3 25579 B12R2.1316 Cc1cc(c(cn1)C)C2CC2 271570a_100011220607_100009862788 [0,1,0,1,0,0|2,0,0]=4 25580 B12R2.1316 Cc1cc(c(cn1)F)C2CC2 271570a_100011220607_100009867690 [0,1,0,1,0,0|2,0,0]=4 25581 B12R2.1316 Cc1cc(c(cn1)O)C2CC2 271570a_100011220607_100009843476 [0,1,0,1,0,0|1,0,0]=3 25582 B12R2.1316 Cc1ccc(c(c1)C2CC2)Br 271570a_100011220607_100012353751 [0,1,0,1,0,0|1,0,0]=3 25583 B12R2.1316 Cc1ccc(c(c1)C2CC2)C 271570a_100011220607_100000210833 [0,1,0,1,0,0|1,0,0]=3 25584 B12R2.1316 Cc1ccc(c(c1)C2CC2)Cl 271570a_100011220607_100012356289 [0,1,0,1,0,0|1,0,0]=3 25585 B12R2.1316 Cc1ccc(c(c1)C2CC2)F 271570a_100011220607_100000736223 [0,1,0,1,0,0|1,0,0]=3 25586 B12R2.1316 Cc1ccc(c(c1)C2CC2)N 271570a_100011220607_100000210942 [0,1,0,1,0,0|1,0,0]=3 25587 B12R2.1316 Cc1ccc(c(c1)C2CC2)O 271570a_100011220607_100000765521 [0,1,0,1,0,0|0,0,0]=2 25588 B12R2.1316 Cc1ccc(c(n1)C2CC2)C 271570a_100011220607_100009854376 [0,1,0,1,0,0|2,0,0]=4 25589 B12R2.1316 Cc1ccc(c(n1)C2CC2)F 271570a_100011220607_100009817602 [0,1,0,1,0,0|2,0,0]=4 25590 B12R2.1316 Cc1ccc(c(n1)C2CC2)N 271570a_100011220607_100000685570 [0,1,0,1,0,0|2,0,0]=4 25591 B12R2.1316 Cc1ccc(c(n1)C2CC2)O 271570a_100011220607_100000702858 [0,1,0,1,0,0|1,0,0]=3 25592 B12R2.1316 Cc1ccc(cc1C2CC2)Br 271570a_100011220607_100011344865 [0,1,0,1,0,0|1,0,0]=3 25593 B12R2.1316 Cc1ccc(cc1C2CC2)Cl 271570a_100011220607_100011263213 [0,1,0,1,0,0|1,0,0]=3 25594 B12R2.1316 Cc1ccc(cc1C2CC2)F 271570a_100011220607_100011218078 [0,1,0,1,0,0|1,0,0]=3 25595 B12R2.1316 Cc1ccc(cc1C2CC2)N 271570a_100011220607_100000736455 [0,1,0,1,0,0|1,0,0]=3 25596 B12R2.1316 Cc1ccc(cc1C2CC2)O 271570a_100011220607_100011380479 [0,1,0,1,0,0|1,0,0]=3 25597 B12R2.1316 Cc1ccc(nc1C2CC2)N 271570a_100011220607_100000126722 [0,1,0,1,0,0|2,0,0]=4 25598 B12R2.1316 Cc1cnc(c(c1)C2CC2)C 271570a_100011220607_100009817436 [0,1,0,1,0,0|2,0,0]=4 25599 B12R2.1316 Cc1cnc(c(c1)C2CC2)Cl 271570a_100011220607_100010210167 [0,1,0,1,0,0|2,0,0]=4 25600 B12R2.1316 Cc1cnc(c(c1)C2CC2)F 271570a_100011220607_100000049784 [0,1,0,1,0,0|2,0,0]=4 25601 B12R2.1316 Cc1cnc(c(c1)C2CC2)N 271570a_100011220607_100000049664 [0,1,0,1,0,0|2,0,0]=4 25602 B12R2.1316 Cc1cnc(c(c1)C2CC2)O 271570a_100011220607_100000049931 [0,1,0,1,0,0|1,0,0]=3 25603 B12R2.1316 Cc1cnc(cc1C2CC2)Br 271570a_100011220607_100010067628 [0,1,0,1,0,0|2,0,0]=4 25604 B12R2.1316 Cc1cnc(cc1C2CC2)Cl 271570a_100011220607_100010068021 [0,1,0,1,0,0|2,0,0]=4 25605 B12R2.1316 Cc1cnc(cc1C2CC2)F 271570a_100011220607_100000049870 [0,1,0,1,0,0|2,0,0]=4 25606 B12R2.1316 Cc1cnc(cc1C2CC2)N 271570a_100011220607_100009819938 [0,1,0,1,0,0|2,0,0]=4 25607 B12R2.1316 Cc1cnc(cc1C2CC2)O 271570a_100011220607_100009831917 [0,1,0,1,0,0|2,0,0]=4 25608 B12R2.1316 Cc1ncc(cc1C2CC2)Br 271570a_100011220607_200010090566 [0,1,0,1,0,0|2,0,0]=4 25609 B12R2.1316 Cc1ncc(cc1C2CC2)F 271570a_100011220607_100009860710 [0,1,0,1,0,0|2,0,0]=4 25610 B12R2.1316 Cc1ncc(cc1C2CC2)N 271570a_100011220607_100011998591 [0,1,0,1,0,0|2,0,0]=4 25611 B12R2.1316 Cc1ncc(cc1C2CC2)O 271570a_100011220607_100009819603 [0,1,0,1,0,0|2,0,0]=4 25612 B12R2.1316 Clc1cc(c(cn1)Br)C2CC2 271570a_100011220607_100009815598 [0,1,0,1,0,0|2,0,0]=4 25613 B12R2.1316 Clc1cc(c(cn1)Cl)C2CC2 271570a_100011220607_100010172835 [0,1,0,1,0,0|2,0,0]=4 25614 B12R2.1316 Clc1ccc(c(c1)C2CC2)Br 271570a_100011220607_100012339723 [0,1,0,1,0,0|1,0,0]=3 25615 B12R2.1316 Clc1ccc(c(c1)C2CC2)Cl 271570a_100011220607_100000707729 [0,1,0,1,0,0|1,0,0]=3 25616 B12R2.1316 Clc1ccc(cc1C2CC2)Br 271570a_100011220607_100011772130 [0,1,0,1,0,0|1,0,0]=3 25617 B12R2.1316 Clc1cnc(c(c1)C2CC2)Cl 271570a_100011220607_200000062399 [0,1,0,1,0,0|2,0,0]=4 25618 B12R2.1316 Clc1cnc(cc1C2CC2)Br 271570a_100011220607_100010223331 [0,1,0,1,0,0|2,0,0]=4 25619 B12R2.1316 Clc1ncc(cc1C2CC2)Br 271570a_100011220607_100009814771 [0,1,0,1,0,0|2,0,0]=4 25620 B12R2.1316 Cn1ccc(=O)c(c1)C2CC2 271570a_100011220607_100010750718 [0,1,0,1,0,0|1,0,1]=4 25621 B12R2.1316 Fc1cc(c(cn1)Cl)C2CC2 271570a_100011220607_100009892587 [0,1,0,1,0,0|2,0,0]=4 25622 B12R2.1316 Fc1cc(c(cn1)F)C2CC2 271570a_100011220607_100010233071 [0,1,0,1,0,0|2,0,0]=4 25623 B12R2.1316 Fc1ccc(c(c1)C2CC2)Br 271570a_100011220607_100011217576 [0,1,0,1,0,0|1,0,0]=3 25624 B12R2.1316 Fc1ccc(c(c1)C2CC2)Cl 271570a_100011220607_100011217299 [0,1,0,1,0,0|1,0,0]=3 25625 B12R2.1316 Fc1ccc(c(c1)C2CC2)F 271570a_100011220607_100000750033 [0,1,0,1,0,0|1,0,0]=3 25626 B12R2.1316 Fc1ccc(c(n1)C2CC2)F 271570a_100011220607_100010997973 [0,1,0,1,0,0|2,0,0]=4 25627 B12R2.1316 Fc1ccc(cc1C2CC2)Br 271570a_100011220607_100011217312 [0,1,0,1,0,0|1,0,0]=3 25628 B12R2.1316 Fc1ccc(cc1C2CC2)Cl 271570a_100011220607_100011218116 [0,1,0,1,0,0|1,0,0]=3 25629 B12R2.1316 Fc1ccc(nc1C2CC2)Cl 271570a_100011220607_100010136221 [0,1,0,1,0,0|2,0,0]=4 25630 B12R2.1316 Fc1cnc(c(c1)C2CC2)F 271570a_100011220607_100009820768 [0,1,0,1,0,0|2,0,0]=4 25631 B12R2.1316 Fc1cnc(cc1C2CC2)Br 271570a_100011220607_100010193852 [0,1,0,1,0,0|2,0,0]=4 25632 B12R2.1316 Fc1cnc(cc1C2CC2)Cl 271570a_100011220607_100000708277 [0,1,0,1,0,0|2,0,0]=4 25633 B12R2.1316 Fc1ncc(cc1C2CC2)Br 271570a_100011220607_100010172738 [0,1,0,1,0,0|2,0,0]=4 25634 B12R2.1316 Fc1ncc(cc1C2CC2)Cl 271570a_100011220607_100010188783 [0,1,0,1,0,0|2,0,0]=4 25635 B12R2.1316 Nc1cc(c(cn1)Cl)C2CC2 271570a_100011220607_100010134119 [0,1,0,1,0,0|2,0,0]=4 25636 B12R2.1316 Nc1cc(c(cn1)F)C2CC2 271570a_100011220607_100015713587 [0,1,0,1,0,0|2,0,0]=4 25637 B12R2.1316 Nc1ccc(c(c1)C2CC2)Br 271570a_100011220607_100000750459 [0,1,0,1,0,0|1,0,0]=3 25638 B12R2.1316 Nc1ccc(c(c1)C2CC2)Cl 271570a_100011220607_100012360549 [0,1,0,1,0,0|1,0,0]=3 25639 B12R2.1316 Nc1ccc(c(c1)C2CC2)F 271570a_100011220607_100000760356 [0,1,0,1,0,0|1,0,0]=3 25640 B12R2.1316 Nc1ccc(c(c1)C2CC2)N 271570a_100011220607_100011534242 [0,1,0,1,0,0|1,0,0]=3 25641 B12R2.1316 Nc1ccc(c(c1)C2CC2)O 271570a_100011220607_100011534360 [0,1,0,1,0,0|0,0,0]=2 25642 B12R2.1316 Nc1ccc(c(c1)C2CC2)O 271570a_203496583355_100010281208 [0,1,0,1,0,0|0,0,0]=2 25643 B12R2.1316 Nc1ccc(c(n1)C2CC2)Br 271570a_100011220607_100010192275 [0,1,0,1,0,0|2,0,0]=4 25644 B12R2.1316 Nc1ccc(c(n1)C2CC2)F 271570a_100011220607_100010892222 [0,1,0,1,0,0|2,0,0]=4 25645 B12R2.1316 Nc1ccc(c(n1)C2CC2)N 271570a_100011220607_200009884323 [0,1,0,1,0,0|2,0,0]=4 25646 B12R2.1316 Nc1ccc(cc1C2CC2)Br 271570a_100011220607_100000187925 [0,1,0,1,0,0|1,0,0]=3 25647 B12R2.1316 Nc1ccc(cc1C2CC2)Cl 271570a_100011220607_100000761889 [0,1,0,1,0,0|1,0,0]=3 25648 B12R2.1316 Nc1ccc(cc1C2CC2)F 271570a_100011220607_100000760547 [0,1,0,1,0,0|1,0,0]=3 25649 B12R2.1316 Nc1ccc(cc1C2CC2)O 271570a_100011220607_100012001276 [0,1,0,1,0,0|1,0,0]=3 25650 B12R2.1316 Nc1ccc(cc1C2CC2)O 271570a_203496583355_100010997530 [0,1,0,1,0,0|1,0,0]=3 25651 B12R2.1316 Nc1ccc(nc1C2CC2)Br 271570a_100011220607_100010168765 [0,1,0,1,0,0|2,0,0]=4 25652 B12R2.1316 Nc1ccc(nc1C2CC2)Cl 271570a_100011220607_100010233647 [0,1,0,1,0,0|2,0,0]=4 25653 B12R2.1316 Nc1ccc(nc1C2CC2)F 271570a_100011220607_100009879877 [0,1,0,1,0,0|2,0,0]=4 25654 B12R2.1316 Nc1cnc(c(c1)C2CC2)Br 271570a_100011220607_100010201102 [0,1,0,1,0,0|2,0,0]=4 25655 B12R2.1316 Nc1cnc(c(c1)C2CC2)Cl 271570a_100011220607_100010253917 [0,1,0,1,0,0|2,0,0]=4 25656 B12R2.1316 Nc1cnc(c(c1)C2CC2)F 271570a_100011220607_100009840397 [0,1,0,1,0,0|2,0,0]=4 25657 B12R2.1316 Nc1cnc(c(c1)C2CC2)N 271570a_100011220607_200011934315 [0,1,0,1,0,0|2,0,0]=4 25658 B12R2.1316 Nc1cnc(cc1C2CC2)Cl 271570a_100011220607_100000050123 [0,1,0,1,0,0|2,0,0]=4 25659 B12R2.1316 Nc1ncc(cc1C2CC2)Br 271570a_100011220607_100000760472 [0,1,0,1,0,0|2,0,0]=4 25660 B12R2.1316 Nc1ncc(cc1C2CC2)Cl 271570a_100011220607_100000050159 [0,1,0,1,0,0|2,0,0]=4 25661 B12R2.1316 Nc1ncc(cc1C2CC2)F 271570a_100011220607_100009814671 [0,1,0,1,0,0|2,0,0]=4 25662 B12R2.1316 O=c1[nH]cc(cc1C2CC2)F 271570a_100011220607_100009817720 [0,1,0,1,0,0|1,0,1]=4 25663 B12R2.1316 O=c1cc(c(c[nH]1)F)C2CC2 271570a_100011220607_100009817642 [0,1,0,1,0,0|2,0,0]=4 25664 B12R2.1316 Oc1cc(c(nn1)O)C2CC2 271570a_100011220607_100000759565 [0,1,0,1,0,0|2,0,0]=4 25665 B12R2.1316 Oc1ccc(c(c1)C2CC2)Br 271570a_100011220607_100012339312 [0,1,0,1,0,0|1,0,0]=3 25666 B12R2.1316 Oc1ccc(c(c1)C2CC2)Cl 271570a_100011220607_100000049588 [0,1,0,1,0,0|1,0,0]=3 25667 B12R2.1316 Oc1ccc(c(c1)C2CC2)F 271570a_100011220607_100000693481 [0,1,0,1,0,0|1,0,0]=3 25668 B12R2.1316 Oc1ccc(c(c1)C2CC2)O 271570a_100011220607_100009813629 [0,1,0,1,0,0|0,0,0]=2 25669 B12R2.1316 Oc1ccc(cc1C2CC2)Br 271570a_100011220607_100012355227 [0,1,0,1,0,0|0,0,0]=2 25670 B12R2.1316 Oc1ccc(cc1C2CC2)Cl 271570a_100011220607_100011356953 [0,1,0,1,0,0|0,0,0]=2 25671 B12R2.1316 Oc1ccc(cc1C2CC2)F 271570a_100011220607_100000211999 [0,1,0,1,0,0|0,0,0]=2 25672 B12R2.1316 Oc1ccc(nc1C2CC2)Br 271570a_100011220607_100010253912 [0,1,0,1,0,0|1,0,0]=3 25673 B12R2.1316 Oc1ccc(nc1C2CC2)Cl 271570a_100011220607_100000696390 [0,1,0,1,0,0|1,0,0]=3 25674 B12R2.1316 Oc1ccc(nc1C2CC2)F 271570a_100011220607_100010382442 [0,1,0,1,0,0|1,0,0]=3 25675 B12R2.1316 Oc1cnc(c(c1)C2CC2)F 271570a_100011220607_100009817267 [0,1,0,1,0,0|2,0,0]=4 25676 B12R2.1316 Oc1cnc(cc1C2CC2)Cl 271570a_100011220607_100000698892 [0,1,0,1,0,0|1,0,0]=3 25677 B12R2.1316 Oc1ncc(cc1C2CC2)Br 271570a_100011220607_100010197142 [0,1,0,1,0,0|1,0,0]=3 25678 B12R2.1316 Oc1ncc(cc1C2CC2)Cl 271570a_100011220607_100010188700 [0,1,0,1,0,0|1,0,0]=3 25679 B12R2.88 NC1(CC1)c2ccccc2O 271570a_203496583355_200000691159 [0,1,0,1,0,0|0,0,0]=2 25680 B12R2.203 NC1CCc2c1c(ccc2)O 271570a_203496583355_100103168669 [0,1,0,1,0,0|0,0,0]=2 25681 B12R2.203 O=C1CCc2c1c(ccc2)O 271570a_203496583355_100009816781 [0,1,0,1,0,0|0,0,1]=3 25682 B12R2.203 O=C1COc2c1c(ccc2)O 271570a_203496583355_100010205902 [0,1,0,1,0,0|1,0,1]=4 25683 B12R2.203 O=C1NCc2c1c(ccc2)O 271570a_203496583355_100000724024 [0,1,0,1,0,0|1,0,1]=4 25684 B12R2.203 O=C1OCc2c1c(ccc2)O 271570a_203496583355_100010132333 [0,1,0,1,0,0|1,0,1]=4 25685 B12R2.203 Oc1cccc2c1C(CS2)O 271570a_203496583355_200010991195 [0,1,0,1,0,0|1,0,0]=3 25686 B12R2.240 Brc1cccc(c1C2CC2)Br 271570a_100011220607_100009994525 [0,1,0,1,0,0|1,0,0]=3 25687 B12R2.240 Brc1cncc(c1C2CC2)Br 271570a_100011220607_100010172828 [0,1,0,1,0,0|2,0,0]=4 25688 B12R2.240 Cc1ccc[n+](c1C2CC2)[O-] 271570a_100011220607_100116209805 [0,1,0,1,0,0|1,0,1]=4 25689 B12R2.240 Cc1cccc(c1C2CC2)C 271570a_100011220607_100000033847 [0,1,0,1,0,0|1,0,0]=3 25690 B12R2.240 Cc1cccc(c1C2CC2)Cl 271570a_100011220607_100000043165 [0,1,0,1,0,0|1,0,0]=3 25691 B12R2.240 Cc1cccc(c1C2CC2)F 271570a_100011220607_100012349962 [0,1,0,1,0,0|1,0,0]=3 25692 B12R2.240 Cc1cccc(c1C2CC2)N 271570a_100011220607_100000684715 [0,1,0,1,0,0|1,0,0]=3 25693 B12R2.240 Cc1cccc(c1C2CC2)O 271570a_100011220607_100000686692 [0,1,0,1,0,0|0,0,0]=2 25694 B12R2.240 Cc1ccnc(c1C2CC2)C 271570a_100011220607_100012000501 [0,1,0,1,0,0|2,0,0]=4 25695 B12R2.240 Cc1ccnc(c1C2CC2)F 271570a_100011220607_100009818256 [0,1,0,1,0,0|2,0,0]=4 25696 B12R2.240 Cc1ccnc(c1C2CC2)N 271570a_100011220607_100011998619 [0,1,0,1,0,0|2,0,0]=4 25697 B12R2.240 Cc1ccnc(c1C2CC2)O 271570a_100011220607_100012000493 [0,1,0,1,0,0|1,0,0]=3 25698 B12R2.240 Cc1cncc(c1C2CC2)C 271570a_100011220607_100009817138 [0,1,0,1,0,0|2,0,0]=4 25699 B12R2.240 Cc1nccc(c1C2CC2)N 271570a_100011220607_100010243816 [0,1,0,1,0,0|2,0,0]=4 25700 B12R2.240 Clc1cccc(c1C2CC2)Br 271570a_100011220607_100010214488 [0,1,0,1,0,0|1,0,0]=3 25701 B12R2.240 Clc1cccc(c1C2CC2)Cl 271570a_100011220607_100000034237 [0,1,0,1,0,0|1,0,0]=3 25702 B12R2.240 Clc1cncc(c1C2CC2)Cl 271570a_100011220607_100000036193 [0,1,0,1,0,0|2,0,0]=4 25703 B12R2.240 Fc1cccc(c1C2CC2)Br 271570a_100011220607_100011219512 [0,1,0,1,0,0|1,0,0]=3 25704 B12R2.240 Fc1cccc(c1C2CC2)Cl 271570a_100011220607_100000050007 [0,1,0,1,0,0|1,0,0]=3 25705 B12R2.240 Fc1cccc(c1C2CC2)F 271570a_100011220607_100000693133 [0,1,0,1,0,0|1,0,0]=3 25706 B12R2.240 Fc1ccnc(c1C2CC2)F 271570a_100011220607_100009874084 [0,1,0,1,0,0|2,0,0]=4 25707 B12R2.240 Fc1cncc(c1C2CC2)F 271570a_100011220607_100000760538 [0,1,0,1,0,0|2,0,0]=4 25708 B12R2.240 Nc1cccc(c1C2CC2)Br 271570a_100011220607_100020590159 [0,1,0,1,0,0|1,0,0]=3 25709 B12R2.240 Nc1cccc(c1C2CC2)Cl 271570a_100011220607_100000049713 [0,1,0,1,0,0|1,0,0]=3 25710 B12R2.240 Nc1cccc(c1C2CC2)F 271570a_100011220607_100011934729 [0,1,0,1,0,0|1,0,0]=3 25711 B12R2.240 Nc1cccc(c1C2CC2)O 271570a_100011220607_100012183704 [0,1,0,1,0,0|0,0,0]=2 25712 B12R2.240 Nc1ccnc(c1C2CC2)F 271570a_100011220607_100010381272 [0,1,0,1,0,0|2,0,0]=4 25713 B12R2.240 Nc1nccc(c1C2CC2)Cl 271570a_100011220607_100010199028 [0,1,0,1,0,0|2,0,0]=4 25714 B12R2.240 O=c1[nH]ncc(c1C2CC2)O 271570a_100011220607_100000116976 [0,1,0,1,0,0|2,0,0]=4 25715 B12R2.240 Oc1cccc(c1C2CC2)Br 271570a_100011220607_100010187912 [0,1,0,1,0,0|0,0,0]=2 25716 B12R2.240 Oc1cccc(c1C2CC2)Cl 271570a_100011220607_100000050174 [0,1,0,1,0,0|0,0,0]=2 25717 B12R2.240 Oc1cccc(c1C2CC2)F 271570a_100011220607_100009820682 [0,1,0,1,0,0|0,0,0]=2 25718 B12R2.240 Oc1cccc(c1C2CC2)F 271570a_203496583355_100010780639 [0,1,0,1,0,0|0,0,0]=2 25719 B12R2.240 Oc1cccc(c1C2CC2)O 271570a_100011220607_100010205330 [0,1,0,1,0,0|0,0,0]=2 25720 B12R2.240 Oc1ccnc(c1C2CC2)O 271570a_100011220607_200009817435 [0,1,0,1,0,0|1,0,0]=3 25721 B8R1.8 CCOc1ccsc1 34a_100000106738_100000210202 [1,0,0,0,1,0|2,0,0]=4 25722 B8R1.8 CCOc1ccsc1 7a_100000106738_100000210202 [1,0,0,0,1,0|2,0,0]=4 25723 B8R1.8 CCSc1ccco1 62a_100000210202_100009814098 [1,0,0,0,1,0|2,0,0]=4 25724 B8R1.8 CCSc1ccco1 62a_100009814098_100000210202 [1,0,0,0,1,0|2,0,0]=4 25725 B8R1.8 CCSc1cccs1 62a_100000210202_100011215356 [1,0,0,0,1,0|2,0,0]=4 25726 B8R1.8 CCSc1cccs1 62a_100011215356_100000210202 [1,0,0,0,1,0|2,0,0]=4 25727 B8R1.8 CCSc1ccoc1 62a_100000210202_100011215275 [1,0,0,0,1,0|2,0,0]=4 25728 B8R1.8 CCSc1ccoc1 62a_100011215275_100000210202 [1,0,0,0,1,0|2,0,0]=4 25729 B8R1.8 CCSc1ccsc1 62a_100000210202_100000738268 [1,0,0,0,1,0|2,0,0]=4 25730 B8R1.8 CCSc1ccsc1 62a_100000738268_100000210202 [1,0,0,0,1,0|2,0,0]=4 25731 B8R1.8 CNCc1ccco1 207a_100102657272_100000186105 [1,0,0,0,1,0|2,0,0]=4 25732 B8R1.8 CNCc1ccco1 2230a_100000185738_200000210301 [1,0,0,0,1,0|2,0,0]=4 25733 B8R1.8 CNCc1ccco1 270004a_106832991635_100000186105 [1,0,0,0,1,0|2,0,0]=4 25734 B8R1.8 CNCc1ccco1 34a_100000185738_200000210301 [1,0,0,0,1,0|2,0,0]=4 25735 B8R1.8 CNCc1cccs1 207a_100102657272_100000209959 [1,0,0,0,1,0|2,0,0]=4 25736 B8R1.8 CNCc1cccs1 2230a_100000211653_200000210301 [1,0,0,0,1,0|2,0,0]=4 25737 B8R1.8 CNCc1cccs1 270004a_106832991635_100000209959 [1,0,0,0,1,0|2,0,0]=4 25738 B8R1.8 CNCc1ccoc1 207a_100102657272_100011215517 [1,0,0,0,1,0|2,0,0]=4 25739 B8R1.8 CNCc1ccoc1 2230a_100015206860_200000210301 [1,0,0,0,1,0|2,0,0]=4 25740 B8R1.8 CNCc1ccoc1 270004a_106832991635_100011215517 [1,0,0,0,1,0|2,0,0]=4 25741 B8R1.8 CNCc1ccoc1 34a_100015206860_200000210301 [1,0,0,0,1,0|2,0,0]=4 25742 B8R1.8 CNCc1ccsc1 207a_100102657272_100000188534 [1,0,0,0,1,0|2,0,0]=4 25743 B8R1.8 CNCc1ccsc1 2230a_100000186416_200000210301 [1,0,0,0,1,0|2,0,0]=4 25744 B8R1.8 CNCc1ccsc1 2230a_106832991635_100011261437 [1,0,0,0,1,0|2,0,0]=4 25745 B8R1.8 CNCc1ccsc1 270004a_106832991635_100000188534 [1,0,0,0,1,0|2,0,0]=4 25746 B8R1.8 CNCc1ccsc1 34a_100000186416_200000210301 [1,0,0,0,1,0|2,0,0]=4 25747 B8R1.8 CNCc1ccsc1 34a_100102657272_100011261437 [1,0,0,0,1,0|2,0,0]=4 25748 B8R1.8 CNCc1ccsc1 7a_106832991635_100011261437 [1,0,0,0,1,0|2,0,0]=4 25749 B8R1.8 COCc1ccco1 34a_100000210059_200000210301 [1,0,0,0,1,0|2,0,0]=4 25750 B8R1.8 COCc1cccs1 34a_100000211240_200000210301 [1,0,0,0,1,0|2,0,0]=4 25751 B8R1.8 COCc1ccoc1 34a_100011215357_200000210301 [1,0,0,0,1,0|2,0,0]=4 25752 B8R1.8 COCc1ccsc1 34a_100011215551_200000210301 [1,0,0,0,1,0|2,0,0]=4 25753 B8R1.8 COCc1ccsc1 34a_100138415774_100011261437 [1,0,0,0,1,0|2,0,0]=4 25754 B8R1.8 CSCc1ccsc1 62a_100011261437_200000210301 [1,0,0,0,1,0|2,0,0]=4 25755 B8R1.8 CSCc1ccsc1 62a_200000210301_100011233845 [1,0,0,0,1,0|2,0,0]=4 25756 B8R1.8 [13CH3]NCc1ccco1 2230a_100000185738_200025704644 [1,0,0,0,1,0|2,0,0]=4 25757 B8R1.8 [13CH3]NCc1ccco1 34a_100000185738_200025704644 [1,0,0,0,1,0|2,0,0]=4 25758 B8R1.8 [13CH3]NCc1cccs1 2230a_100000211653_200025704644 [1,0,0,0,1,0|2,0,0]=4 25759 B8R1.8 [13CH3]NCc1ccoc1 2230a_100015206860_200025704644 [1,0,0,0,1,0|2,0,0]=4 25760 B8R1.8 [13CH3]NCc1ccoc1 34a_100015206860_200025704644 [1,0,0,0,1,0|2,0,0]=4 25761 B8R1.8 [13CH3]NCc1ccsc1 2230a_100000186416_200025704644 [1,0,0,0,1,0|2,0,0]=4 25762 B8R1.8 [13CH3]NCc1ccsc1 34a_100000186416_200025704644 [1,0,0,0,1,0|2,0,0]=4 25763 B8R1.8 [13CH3]OCc1ccco1 34a_100000210059_200025704644 [1,0,0,0,1,0|2,0,0]=4 25764 B8R1.8 [13CH3]OCc1cccs1 34a_100000211240_200025704644 [1,0,0,0,1,0|2,0,0]=4 25765 B8R1.8 [13CH3]OCc1ccoc1 34a_100011215357_200025704644 [1,0,0,0,1,0|2,0,0]=4 25766 B8R1.8 [13CH3]OCc1ccsc1 34a_100011215551_200025704644 [1,0,0,0,1,0|2,0,0]=4 25767 B8R1.8 [13CH3]SCc1ccsc1 62a_100011261437_200025704644 [1,0,0,0,1,0|2,0,0]=4 25768 B8R1.8 [13CH3]SCc1ccsc1 62a_200025704644_100011233845 [1,0,0,0,1,0|2,0,0]=4 25769 B8R1.11 CCc1ccsc1O 271570a_203496583355_200009875468 [1,0,0,0,1,0|1,0,0]=3 25770 B8R1.11 CCc1cscc1O 271570a_203496583355_100011068457 [1,0,0,0,1,0|1,0,0]=3 25771 B8R1.11 CCn1ccnc1O 271570a_203496583355_100011617267 [1,0,0,0,1,0|2,0,0]=4 25772 B8R1.11 CCn1nccc1O 271570a_203496583355_100000728327 [1,0,0,0,1,0|2,0,0]=4 25773 B8R1.11 CSc1sccc1O 271570a_203496583355_200010341309 [1,0,0,0,1,0|2,0,0]=4 25774 B8R1.11 NCc1ccsc1O 271570a_203496583355_100000727803 [1,0,0,0,1,0|2,0,0]=4 25775 B8R1.11 OCc1ccsc1O 271570a_203496583355_100009816922 [1,0,0,0,1,0|2,0,0]=4 25776 B8R1.11 OCc1cscc1O 271570a_203496583355_100000724555 [1,0,0,0,1,0|2,0,0]=4 25777 B8R1.11 OCc1sccc1O 271570a_203496583355_100000702026 [1,0,0,0,1,0|2,0,0]=4 25778 B10R0.2 C=CCC(=O)CC(=C)CCC 1458a_100000138376_100000210623 [0,0,1,0,0,1|0,0,2]=4